A0A077Z4B4_TRITR Loading...

HlyIII domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z4B4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 425 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	33.4	Very low	38.6	Very low	241 Å²	241	144 Å²	144	100%	1.187	75%	0.748	S	S	*	*				0	89.8	0	-78	173.4	153.9	0	0	107.8	G3	M1-G3 PolarHBondContact O-N 3.11Å
2	N	30.8	Very low	39.6	Very low	176 Å²	176	135 Å²	135	94%	0.941	70%	0.703	S	S	*	*			trans	-85.5	89.8	177.3	-80.6	-2.1	0	0	0	108.3	E4	N2-E4 PolarHBondContact O-N 2.92Å
3	G	32.7	Very low	40.9	Very low	70 Å²	70	127.3 Å²	127.3	72%	0.722	67%	0.666	S	S	*	*			trans	-81.6	100.5	169.6	0	0	0	0	0	109.3	M1 K5	M1-G3 PolarHBondContact O-N 3.11Å; G3-K5 PolarHBondContact O-N 3.46Å
4	E	32	Very low	41.7	Very low	194 Å²	194	122.1 Å²	122.1	91%	0.907	64%	0.641	S	S	*	*			trans	-62	101.8	169.7	-162.3	169.8	-164.3	0	0	108.4	N2 R6	N2-E4 PolarHBondContact O-N 2.92Å; E4-R6 PolarHBondContact O-N 3.06Å
5	K	39.8	Very low	42.7	Very low	205 Å²	205	120.5 Å²	120.5	89%	0.891	63%	0.627	S	S	*	*			trans	-67.2	113.2	174.9	-81.6	-172.1	176.1	-173.9	0	108.1	G3	G3-K5 PolarHBondContact O-N 3.46Å
6	R	32.3	Very low	43.5	Very low	232 Å²	232	122.4 Å²	122.4	88%	0.875	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-55.8	140.9	171.2	-89.6	-177.2	-95.1	-163.9	-5	110.2	E4 V8	E4-R6 PolarHBondContact O-N 3.06Å; R6-V8 PolarHBondContact O-N 3.41Å
7	P	38.3	Very low	43.8	Very low	119 Å²	119	122.1 Å²	122.1	77%	0.773	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-60.6	133.4	175.2	24.2	-31.3	0	0	0	110.1
8	V	48.8	Very low	43.7	Very low	76 Å²	76	124.4 Å²	124.4	46%	0.461	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-68.5	129	174.3	-177.5	0	0	0	0	108.1	R6	R6-V8 PolarHBondContact O-N 3.41Å
9	P	41.4	Very low	43.2	Very low	91 Å²	91	127.5 Å²	127.5	59%	0.591	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-59.8	139.8	178.5	-18	29.5	0	0	0	111.2
10	I	46.6	Very low	42.3	Very low	76 Å²	76	126.2 Å²	126.2	39%	0.39	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-83.3	124.2	166.6	-62.9	171.4	0	0	0	106.5	P58 Y81	I10-P58 HydrophobicContact CD1-CB 4.41Å; I10-Y81 HydrophobicContact CG2-CD1 3.97Å; I10-Y81 HydrophobicContact CG2-CG 4.4Å
11	E	48.7	Very low	41.6	Very low	104 Å²	104	127.7 Å²	127.7	49%	0.486	67%	0.672	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.7	135.2	177.1	-159.3	165.1	-161.3	0	0	109.4	E82	E11-E82 PolarHBondContact N-O 3.11Å; E11-E82 PolarHBondContact O-N 3.32Å
12	V	50.4	Low	41.3	Very low	36 Å²	36	121.5 Å²	121.5	22%	0.218	65%	0.653	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.5	113.1	176.3	-176.8	0	0	0	0	107.5	I56 L65 L69 I79 Y81	V12-I56 HydrophobicContact CG2-CD1 4.3Å; V12-L65 HydrophobicContact CG1-CD2 3.92Å; V12-L65 HydrophobicContact CG2-CD2 4.4Å; V12-L69 HydrophobicContact CG1-CD1 3.91Å; V12-I79 HydrophobicContact CG1-CG2 3.56Å; V12-Y81 HydrophobicContact CG2-CD1 3.99Å; V12-Y81 HydrophobicContact CG2-CE1 3.99Å
13	V	56.3	Low	41.2	Very low	35 Å²	35	118.9 Å²	118.9	21%	0.212	65%	0.648	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.3	129.4	-179.5	-175.3	0	0	0	0	108.6	K15 S80 E82	V13-K15 HydrophobicContact CG1-CG 3.99Å; V13-S80 PolarHBondContact N-O 3.48Å; V13-S80 PolarHBondContact O-N 3.37Å; V13-S80 VanDerWaalsContact O-O 3.12Å; V13-E82 HydrophobicContact CB-CG 4.46Å; V13-E82 HydrophobicContact CG2-CB 3.96Å; V13-E82 HydrophobicContact CG2-CG 3.95Å
14	V	52.6	Low	41.1	Very low	54 Å²	54	120.3 Å²	120.3	33%	0.327	65%	0.647	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.2	119	174.6	-175.5	0	0	0	0	107.7	L69 L71 L77 Q78	V14-L69 HydrophobicContact CG2-CD1 4.06Å; V14-L71 HydrophobicContact CG1-CD1 4.2Å; V14-L71 HydrophobicContact CG1-CD2 3.75Å; V14-L71 HydrophobicContact CG2-CD1 3.88Å; V14-L71 HydrophobicContact CG2-CD2 4.23Å; V14-L77 HydrophobicContact CG1-CB 4.09Å; V14-L77 HydrophobicContact CG1-CD2 3.91Å; V14-L77 HydrophobicContact CG1-CG 4.45Å; V14-Q78 WeakPolarHBondContact CA-O 3.47Å
15	K	57.3	Low	41	Very low	98 Å²	98	118.6 Å²	118.6	43%	0.426	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.7	140.3	178	-62	-174.3	-174.5	174.6	0	110.1	V13 L77 Q78 E82	V13-K15 HydrophobicContact CG1-CG 3.99Å; K15-L77 WeakPolarHBondContact O-CA 3.4Å; K15-Q78 PolarHBondContact N-O 3.44Å; K15-Q78 PolarHBondContact O-N 3.06Å; K15-E82 WeakPolarHBondContact CE-OE1 3.29Å; K15-E82 IonicContact NZ-OE1 3.3Å; K15-E82 PolarHBondContact NZ-OE1 2.89Å
16	Q	55.1	Low	40.6	Very low	151 Å²	151	113.2 Å²	113.2	71%	0.706	63%	0.632	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.1	134.6	170	-169.7	164.9	-9.7	0	0	107.3	D18 G76 L77	Q16-D18 PolarHBondContact O-N 3.07Å; Q16-D18 VanDerWaalsContact O-N 3.08Å; Q16-G76 WeakPolarHBondContact CA-O 3.22Å; Q16-L77 HydrophobicContact CB-CD2 3.93Å; Q16-L77 HydrophobicContact CG-CD2 4.29Å
17	N	48.7	Very low	40.6	Very low	117 Å²	117	108.9 Å²	108.9	63%	0.626	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-57.7	117.5	177.6	-82.4	-8	0	0	0	109.7	E19 G76	N17-E19 PolarHBondContact O-N 2.91Å; N17-G76 PolarHBondContact N-O 3.3Å
18	D	42.2	Very low	40.2	Very low	165 Å²	165	108.2 Å²	108.2	88%	0.882	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-62.3	118.2	-177	-73.5	-42.3	0	0	0	111.3	Q16	Q16-D18 PolarHBondContact O-N 3.07Å; Q16-D18 VanDerWaalsContact O-N 3.08Å
19	E	32.9	Very low	39.4	Very low	183 Å²	183	112.7 Å²	112.7	86%	0.855	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-72.4	133.7	155.4	-82.7	-175.8	150.9	0	0	109.1	N17 I21	N17-E19 PolarHBondContact O-N 2.91Å; E19-I21 PolarHBondContact O-N 3.34Å
20	A	25.8	Very low	38.8	Very low	101 Å²	101	114 Å²	114	84%	0.835	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-58.2	120.4	176.6	0	0	0	0	0	112.1
21	I	28	Very low	38.1	Very low	158 Å²	158	119 Å²	119	81%	0.81	65%	0.649	S	S	*	*			trans	-130.7	100	157.3	-58.7	-179.3	0	0	0	108.3	E19	E19-I21 PolarHBondContact O-N 3.34Å
22	S	26.7	Very low	37.3	Very low	111 Å²	111	120 Å²	120	78%	0.776	65%	0.654	S	S	*	*			trans	-74.4	119.4	162.1	57.8	0	0	0	0	109
23	S	28.9	Very low	36.4	Very low	120 Å²	120	124.9 Å²	124.9	84%	0.839	68%	0.679	S	S	*	*			trans	-92.1	106.8	165.5	59.2	0	0	0	0	109.5
24	S	31.2	Very low	35.1	Very low	101 Å²	101	127.5 Å²	127.5	71%	0.706	70%	0.704	S	S	*	*			trans	-94.6	132.5	164.9	54.7	0	0	0	0	110.3
25	D	29.3	Very low	34.2	Very low	157 Å²	157	131.6 Å²	131.6	84%	0.84	72%	0.724	S	S	*	*			trans	51.9	118.4	142.9	-71.4	-21.6	0	0	0	121.4
26	S	31.1	Very low	32.9	Very low	92 Å²	92	133 Å²	133	64%	0.643	74%	0.736	S	S	*	*				120.9	129.1	117.2	93.4	0	0	0	0	118.2
27	D	31.6	Very low	31.7	Very low	142 Å²	142	130.5 Å²	130.5	76%	0.759	74%	0.736	S	S	*	*			trans	75.9	138.7	147.8	-47	-36.4	0	0	0	118.7
28	V	30.4	Very low	31	Very low	104 Å²	104	132.2 Å²	132.2	63%	0.63	74%	0.744	S	S	*	*			cis	-177.4	144.2	-0.2	127.2	0	0	0	0	105.5
29	E	31.7	Very low	30.6	Very low	170 Å²	170	132.8 Å²	132.8	79%	0.794	74%	0.741	S	S	*	*			trans	58.4	150.8	152.4	-73.1	168.7	-173.7	0	0	121.8
30	E	30.3	Very low	30.7	Very low	120 Å²	120	129.3 Å²	129.3	56%	0.561	73%	0.734	S	S	*	*			cis	177	166.2	-13.8	-166.5	-179.5	174.2	0	0	107
31	Y	30.6	Very low	31	Very low	179 Å²	179	129.9 Å²	129.9	70%	0.702	73%	0.732	S	S	*	*			trans	77.2	137.5	164	-74.8	-89.3	0	0	0	119.7
32	H	32	Very low	31.2	Very low	127 Å²	127	129.7 Å²	129.7	59%	0.588	73%	0.733	S	S	*	*			cis	-178.8	144.9	-26.1	-120.7	-85.1	0	0	0	105.6
33	D	31.8	Very low	31.4	Very low	137 Å²	137	130 Å²	130	73%	0.733	74%	0.735	S	S	*	*			trans	59.6	118.2	142.3	-70.1	-15.2	0	0	0	124.9
34	A	29.8	Very low	31.5	Very low	90 Å²	90	127.9 Å²	127.9	74%	0.744	73%	0.732	S	S	*	*				103.9	115.1	109.7	0	0	0	0	0	121.1
35	N	32	Very low	31.4	Very low	140 Å²	140	128 Å²	128	75%	0.749	74%	0.739	S	S	*	*			trans	75.9	120.6	133.7	-92.6	25.8	0	0	0	123.5
36	D	31.4	Very low	31.5	Very low	128 Å²	128	127.3 Å²	127.3	68%	0.684	74%	0.74	S	S	*	*				75.6	104.7	128.1	-76.4	-23.8	0	0	0	121.2
37	S	30.4	Very low	31.6	Very low	99 Å²	99	128.8 Å²	128.8	69%	0.692	75%	0.751	S	S	*	*				97.7	138.3	112.8	74.3	0	0	0	0	120.1
38	L	32.4	Very low	31.6	Very low	152 Å²	152	130.6 Å²	130.6	80%	0.796	76%	0.755	S	S	*	*			trans	81.9	95.5	164	-74	111.6	0	0	0	120.9
39	H	34.1	Very low	31.7	Very low	178 Å²	178	131.8 Å²	131.8	82%	0.824	77%	0.765	S	S	*	*				59.3	157.4	118.1	-96.9	-45	0	0	0	121.6
40	P	35.1	Very low	31.6	Very low	110 Å²	110	127.9 Å²	127.9	71%	0.714	76%	0.762	S	S	*	*				-120.2	152.8	-118	38.4	-22.8	0	0	0	114.2
41	S	32.8	Very low	31.7	Very low	112 Å²	112	127.9 Å²	127.9	78%	0.783	77%	0.774	S	S	*	*			trans	-172.5	123.8	150.6	50.6	0	0	0	0	112.3
42	D	31	Very low	31.7	Very low	155 Å²	155	125 Å²	125	83%	0.829	78%	0.776	S	S	*	*			trans	64.5	123.5	145	-83.3	-26.5	0	0	0	123.8
43	S	31.1	Very low	31.8	Very low	118 Å²	118	123.3 Å²	123.3	83%	0.825	78%	0.778	S	S	*	*			trans	76.5	102.4	137.5	69.5	0	0	0	0	118.4
44	G	31.6	Very low	32.1	Very low	75 Å²	75	123.8 Å²	123.8	77%	0.773	78%	0.776	S	S	*	*			trans	-176.9	99.9	167	0	0	0	0	0	110.6
45	A	28.8	Very low	32.5	Very low	103 Å²	103	125.8 Å²	125.8	85%	0.851	78%	0.779	S	S	*	*			trans	-69.4	128.2	-176.2	0	0	0	0	0	112.9
46	T	32.2	Very low	32.9	Very low	142 Å²	142	120.9 Å²	120.9	87%	0.871	75%	0.752	S	S	*	*			trans	-145.7	119.1	151	38.5	0	0	0	0	108.7
47	S	31.9	Very low	33.3	Very low	123 Å²	123	118.1 Å²	118.1	86%	0.86	75%	0.747	S	S	*	*			trans	-84.9	117.4	-176.9	51.1	0	0	0	0	111.5
48	E	32.6	Very low	33.8	Very low	180 Å²	180	117 Å²	117	84%	0.841	74%	0.738	S	S	*	*			trans	-80.9	147.1	161	-73.3	-173.1	153.7	0	0	110.6	A50	E48-A50 PolarHBondContact O-N 3.38Å
49	P	32.5	Very low	34.6	Very low	130 Å²	130	118.7 Å²	118.7	84%	0.844	73%	0.734	S	S	*	*			trans	-73.4	114.4	177.6	29.9	-29.9	0	0	0	109.9	S51	P49-S51 PolarHBondContact O-N 3.47Å
50	A	28.9	Very low	35.4	Very low	88 Å²	88	111 Å²	111	73%	0.727	70%	0.7	S	S	*	*			trans	-63.7	116.9	172.9	0	0	0	0	0	110.9	E48 T52	E48-A50 PolarHBondContact O-N 3.38Å; A50-T52 PolarHBondContact O-N 2.94Å; A50-T52 VanDerWaalsContact O-N 3.12Å
51	S	33.4	Very low	36.4	Very low	119 Å²	119	110.6 Å²	110.6	83%	0.832	69%	0.692	S	S	*	*			trans	-66.4	109	165.8	61	0	0	0	0	108.7	P49 S53	P49-S51 PolarHBondContact O-N 3.47Å; S51-S53 PolarHBondContact O-N 3.06Å; S51-S53 VanDerWaalsContact O-N 3.16Å
52	T	30.8	Very low	37.9	Very low	118 Å²	118	110.3 Å²	110.3	72%	0.724	68%	0.678	S	S	*	*			trans	-83.8	92.7	179.1	-46.4	0	0	0	0	108.3	A50 Q54	A50-T52 PolarHBondContact O-N 2.94Å; A50-T52 VanDerWaalsContact O-N 3.12Å; T52-Q54 HydrophobicContact CG2-CG 4.46Å; T52-Q54 PolarHBondContact O-N 2.67Å
53	S	33.8	Very low	39.5	Very low	93 Å²	93	107.7 Å²	107.7	65%	0.65	67%	0.668	S	S	*	*			trans	-70.8	107.7	170.1	178.4	0	0	0	0	109.3	S51	S51-S53 PolarHBondContact O-N 3.06Å; S51-S53 VanDerWaalsContact O-N 3.16Å
54	Q	37.8	Very low	41.1	Very low	147 Å²	147	105.9 Å²	105.9	69%	0.687	65%	0.646	S	S	*	*			trans	-98.2	127.9	168.9	-77.8	-168	-7.9	0	0	110.1	T52 I56	T52-Q54 HydrophobicContact CG2-CG 4.46Å; T52-Q54 PolarHBondContact O-N 2.67Å; Q54-I56 PolarHBondContact O-N 2.84Å
55	V	38.3	Very low	42.7	Very low	131 Å²	131	102.5 Å²	102.5	79%	0.794	61%	0.61	S	S	*	*			trans	-75.1	103.7	172.5	-179.1	0	0	0	0	108.6
56	I	39.4	Very low	44.6	Very low	37 Å²	37	101.1 Å²	101.1	19%	0.19	58%	0.583	C	S	.	*			trans	-92.3	132.9	-179.7	-58.2	172.7	0	0	0	109.5	V12 Q54 L69	V12-I56 HydrophobicContact CG2-CD1 4.3Å; Q54-I56 PolarHBondContact O-N 2.84Å; I56-L69 HydrophobicContact CD1-CD2 3.98Å
57	A	40.7	Very low	46.4	Very low	70 Å²	70	98 Å²	98	58%	0.579	57%	0.572	S	S	*	*			trans	-63.4	139.3	174.4	0	0	0	0	0	110.4	W59	A57-W59 PolarHBondContact O-N 2.92Å
58	P	40.7	Very low	48	Very low	77 Å²	77	98.9 Å²	98.9	50%	0.5	56%	0.556	S	S	.	*	S	Bend	trans	-78.1	36.4	-160.3	-11.6	27.9	0	0	0	115.6	I10	I10-P58 HydrophobicContact CD1-CB 4.41Å
59	W	48.9	Very low	49.8	Very low	186 Å²	186	93 Å²	93	71%	0.705	53%	0.53	S	S	*	.			trans	-154.9	31.5	-167.1	-50.9	95.2	0	0	0	116.3	A57	A57-W59 PolarHBondContact O-N 2.92Å
60	S	51.2	Low	51.6	Low	17 Å²	17	91.9 Å²	91.9	12%	0.119	53%	0.525	C	S	.	.			trans	-86.3	143.6	171.1	37.7	0	0	0	0	111.8	L65	S60-L65 WeakPolarHBondContact O-CD1 3.31Å; S60-L65 WeakPolarHBondContact OG-CD1 3.43Å; S60-L65 VanDerWaalsContact OG-CG 3.23Å; S60-L65 WeakPolarHBondContact OG-CG 3.48Å
61	D	56.7	Low	53.4	Low	102 Å²	102	88.7 Å²	88.7	55%	0.545	50%	0.496	S	S	.	.			trans	-54.8	149.7	168.2	175.7	27.1	0	0	0	110.3	T63 E64 L65	D61-T63 PolarHBondContact O-N 3.29Å; D61-T63 VanDerWaalsContact OD2-CB 3.28Å; D61-T63 WeakPolarHBondContact OD2-CB 3.26Å; D61-T63 PolarHBondContact OD2-OG1 3.45Å; D61-E64 HydrophobicContact CB-CB 4.18Å; D61-E64 CarbonylContact O-C 3.58Å; D61-E64 WeakPolarHBondContact O-CA 3.36Å; D61-E64 WeakPolarHBondContact O-CB 3.47Å; D61-E64 PolarHBondContact O-N 2.79Å; D61-L65 PolarHBondContact O-N 3.22Å
62	E	63.6	Low	55	Low	105 Å²	105	85.3 Å²	85.3	49%	0.491	48%	0.48	S	S	.	.	H	α-helix	trans	-57.3	-38.3	-179.7	-172.1	-179.7	164.2	0	0	111	E64 L65 R66	E62-E64 VanDerWaalsContact C-N 3.34Å; E62-E64 PolarHBondContact O-N 3.18Å; E62-L65 PolarHBondContact O-N 3.3Å; E62-R66 HydrophobicContact CG-CG 4.5Å; E62-R66 WeakPolarHBondContact O-CB 3.48Å; E62-R66 WeakPolarHBondContact O-CG 3.26Å; E62-R66 PolarHBondContact O-N 3.44Å; E62-R66 IonicContact OE1-CZ 2.68Å; E62-R66 IonicContact OE1-NE 2.63Å; E62-R66 PolarHBondContact OE1-NE 3.23Å; E62-R66 VanDerWaalsContact OE1-NE 3.13Å; E62-R66 IonicContact OE1-NH2 3.28Å; E62-R66 PolarHBondContact OE1-NH2 2.82Å
63	T	65.6	Low	56.6	Low	101 Å²	101	87.2 Å²	87.2	62%	0.62	49%	0.486	S	S	*	.	H	α-helix	trans	-59.1	-44.8	174	-39	0	0	0	0	111.6	D61 A67	D61-T63 PolarHBondContact O-N 3.29Å; D61-T63 VanDerWaalsContact OD2-CB 3.28Å; D61-T63 WeakPolarHBondContact OD2-CB 3.26Å; D61-T63 PolarHBondContact OD2-OG1 3.45Å; T63-A67 WeakPolarHBondContact O-CB 3.38Å; T63-A67 PolarHBondContact O-N 3.48Å
64	E	64.5	Low	57.8	Low	79 Å²	79	91.2 Å²	91.2	37%	0.369	49%	0.486	S	S	.	.	H	α-helix	trans	-71.1	-36.9	179.3	-172.7	-178.4	-176.8	0	0	111.5	D61 E62 A67 R68	D61-E64 HydrophobicContact CB-CB 4.18Å; D61-E64 CarbonylContact O-C 3.58Å; D61-E64 WeakPolarHBondContact O-CA 3.36Å; D61-E64 WeakPolarHBondContact O-CB 3.47Å; D61-E64 PolarHBondContact O-N 2.79Å; E62-E64 VanDerWaalsContact C-N 3.34Å; E62-E64 PolarHBondContact O-N 3.18Å; E64-A67 PolarHBondContact O-N 2.78Å; E64-R68 WeakPolarHBondContact O-CB 3.01Å; E64-R68 VanDerWaalsContact O-CG 3.23Å; E64-R68 WeakPolarHBondContact O-CG 3.46Å; E64-R68 PolarHBondContact O-N 3.21Å; E64-R68 IonicContact OE1-CZ 2.88Å; E64-R68 VanDerWaalsContact OE1-CZ 3.3Å; E64-R68 IonicContact OE1-NE 3.81Å; E64-R68 PolarHBondContact OE1-NE 3.37Å; E64-R68 IonicContact OE1-NH2 3.84Å; E64-R68 PolarHBondContact OE1-NH2 3.33Å
65	L	65.3	Low	58.6	Low	4 Å²	4	93.6 Å²	93.6	2%	0.021	50%	0.498	C	S	.	.	H	α-helix	trans	-67.2	-44.1	175.9	-117.7	139.6	0	0	0	111.9	V12 S60 D61 E62 A67 R68 L69 I79 Y81	V12-L65 HydrophobicContact CG1-CD2 3.92Å; V12-L65 HydrophobicContact CG2-CD2 4.4Å; S60-L65 WeakPolarHBondContact O-CD1 3.31Å; S60-L65 WeakPolarHBondContact OG-CD1 3.43Å; S60-L65 VanDerWaalsContact OG-CG 3.23Å; S60-L65 WeakPolarHBondContact OG-CG 3.48Å; D61-L65 PolarHBondContact O-N 3.22Å; E62-L65 PolarHBondContact O-N 3.3Å; L65-A67 VanDerWaalsContact C-N 3.32Å; L65-A67 PolarHBondContact O-N 3.32Å; L65-R68 PolarHBondContact O-N 3.09Å; L65-L69 HydrophobicContact CD2-CD1 3.67Å; L65-L69 HydrophobicContact CD2-CG 4.3Å; L65-L69 VanDerWaalsContact O-CB 3.26Å; L65-L69 WeakPolarHBondContact O-CB 3.45Å; L65-L69 VanDerWaalsContact O-CG 3.27Å; L65-L69 WeakPolarHBondContact O-CG 3.28Å; L65-L69 PolarHBondContact O-N 2.81Å; L65-I79 HydrophobicContact CB-CD1 4.42Å; L65-I79 HydrophobicContact CD2-CG2 4.47Å; L65-Y81 HydrophobicContact CD1-CE1 4.41Å; L65-Y81 WeakPolarHBondContact CD1-OH 3.48Å
66	R	66.9	Low	59.5	Low	74 Å²	74	89.2 Å²	89.2	28%	0.279	48%	0.479	S	S	.	.	H	α-helix	trans	-62.6	-39.8	173.8	-74.1	-178.5	-177.4	-147.7	1.9	111.8	E62 S70 L71 I79	E62-R66 HydrophobicContact CG-CG 4.5Å; E62-R66 WeakPolarHBondContact O-CB 3.48Å; E62-R66 WeakPolarHBondContact O-CG 3.26Å; E62-R66 PolarHBondContact O-N 3.44Å; E62-R66 IonicContact OE1-CZ 2.68Å; E62-R66 IonicContact OE1-NE 2.63Å; E62-R66 PolarHBondContact OE1-NE 3.23Å; E62-R66 VanDerWaalsContact OE1-NE 3.13Å; E62-R66 IonicContact OE1-NH2 3.28Å; E62-R66 PolarHBondContact OE1-NH2 2.82Å; R66-S70 PolarHBondContact O-N 3.19Å; R66-L71 HydrophobicContact CB-CB 4.3Å; R66-L71 HydrophobicContact CG-CB 4.39Å; R66-L71 HydrophobicContact CG-CD1 4.39Å; R66-L71 PolarHBondContact O-N 3.36Å; R66-I79 HydrophobicContact CG-CD1 3.74Å
67	A	71.4	Confident	60.2	Low	76 Å²	76	89 Å²	89	63%	0.628	48%	0.479	S	S	*	.	H	α-helix	trans	-64.7	-44.4	174.3	0	0	0	0	0	112	T63 E64 L65 S70	T63-A67 WeakPolarHBondContact O-CB 3.38Å; T63-A67 PolarHBondContact O-N 3.48Å; E64-A67 PolarHBondContact O-N 2.78Å; L65-A67 VanDerWaalsContact C-N 3.32Å; L65-A67 PolarHBondContact O-N 3.32Å; A67-S70 PolarHBondContact O-N 2.7Å
68	R	66.1	Low	60.8	Low	143 Å²	143	91.6 Å²	91.6	54%	0.54	48%	0.478	S	S	.	.	H	α-helix	trans	-67.9	-35.5	178.3	-75.2	177.6	-178.1	-150.5	4.6	113.2	E64 L65 S70	E64-R68 WeakPolarHBondContact O-CB 3.01Å; E64-R68 VanDerWaalsContact O-CG 3.23Å; E64-R68 WeakPolarHBondContact O-CG 3.46Å; E64-R68 PolarHBondContact O-N 3.21Å; E64-R68 IonicContact OE1-CZ 2.88Å; E64-R68 VanDerWaalsContact OE1-CZ 3.3Å; E64-R68 IonicContact OE1-NE 3.81Å; E64-R68 PolarHBondContact OE1-NE 3.37Å; E64-R68 IonicContact OE1-NH2 3.84Å; E64-R68 PolarHBondContact OE1-NH2 3.33Å; L65-R68 PolarHBondContact O-N 3.09Å; R68-S70 VanDerWaalsContact C-N 3.27Å; R68-S70 PolarHBondContact O-N 2.98Å
69	L	68.4	Low	61.5	Low	56 Å²	56	89.1 Å²	89.1	29%	0.293	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	4.6	177.2	-66.8	174.7	0	0	0	113.2	V12 V14 I56 L65 L71 I79	V12-L69 HydrophobicContact CG1-CD1 3.91Å; V14-L69 HydrophobicContact CG2-CD1 4.06Å; I56-L69 HydrophobicContact CD1-CD2 3.98Å; L65-L69 HydrophobicContact CD2-CD1 3.67Å; L65-L69 HydrophobicContact CD2-CG 4.3Å; L65-L69 VanDerWaalsContact O-CB 3.26Å; L65-L69 WeakPolarHBondContact O-CB 3.45Å; L65-L69 VanDerWaalsContact O-CG 3.27Å; L65-L69 WeakPolarHBondContact O-CG 3.28Å; L65-L69 PolarHBondContact O-N 2.81Å; L69-L71 HydrophobicContact CB-CD1 3.66Å; L69-L71 HydrophobicContact CB-CG 3.67Å; L69-L71 HydrophobicContact CD1-CD1 3.77Å; L69-L71 HydrophobicContact CG-CD1 4.39Å; L69-L71 PolarHBondContact O-N 3.22Å; L69-I79 HydrophobicContact CD1-CD1 4.35Å
70	S	72.3	Confident	61.5	Low	106 Å²	106	81.1 Å²	81.1	74%	0.741	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	31.9	-177.3	-51.2	0	0	0	0	113.9	R66 A67 R68	R66-S70 PolarHBondContact O-N 3.19Å; A67-S70 PolarHBondContact O-N 2.7Å; R68-S70 VanDerWaalsContact C-N 3.27Å; R68-S70 PolarHBondContact O-N 2.98Å
71	L	66.3	Low	61.5	Low	22 Å²	22	85.5 Å²	85.5	12%	0.115	45%	0.448	C	S	.	.			trans	-82.4	-19.3	-174.8	-66.5	170.5	0	0	0	113.6	V14 R66 L69 R74 L77 I79	V14-L71 HydrophobicContact CG1-CD1 4.2Å; V14-L71 HydrophobicContact CG1-CD2 3.75Å; V14-L71 HydrophobicContact CG2-CD1 3.88Å; V14-L71 HydrophobicContact CG2-CD2 4.23Å; R66-L71 HydrophobicContact CB-CB 4.3Å; R66-L71 HydrophobicContact CG-CB 4.39Å; R66-L71 HydrophobicContact CG-CD1 4.39Å; R66-L71 PolarHBondContact O-N 3.36Å; L69-L71 HydrophobicContact CB-CD1 3.66Å; L69-L71 HydrophobicContact CB-CG 3.67Å; L69-L71 HydrophobicContact CD1-CD1 3.77Å; L69-L71 HydrophobicContact CG-CD1 4.39Å; L69-L71 PolarHBondContact O-N 3.22Å; L71-R74 WeakPolarHBondContact O-CB 3.38Å; L71-R74 WeakPolarHBondContact O-CG 3.3Å; L71-L77 HydrophobicContact CD2-CD1 3.92Å; L71-I79 HydrophobicContact CD1-CD1 3.83Å; L71-I79 HydrophobicContact CD1-CG1 3.91Å
72	G	66.4	Low	61	Low	47 Å²	47	83.2 Å²	83.2	49%	0.485	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	-156.1	-177.9	0	0	0	0	0	113.4	R74	G72-R74 PolarHBondContact O-N 2.71Å
73	D	64.3	Low	59.9	Low	159 Å²	159	82.7 Å²	82.7	85%	0.85	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	29.6	173.2	-78.5	-23.4	0	0	0	112.4	E75	D73-E75 PolarHBondContact O-N 3.08Å
74	R	59.7	Low	58.8	Low	176 Å²	176	84.4 Å²	84.4	66%	0.664	43%	0.432	S	S	*	.			trans	-65.9	106.7	-180	-72.8	-178.1	-179.9	-172.5	1.6	110.2	L71 G72 L77	L71-R74 WeakPolarHBondContact O-CB 3.38Å; L71-R74 WeakPolarHBondContact O-CG 3.3Å; G72-R74 PolarHBondContact O-N 2.71Å; R74-L77 HydrophobicContact CB-CD1 3.75Å; R74-L77 HydrophobicContact CB-CG 4.49Å; R74-L77 HydrophobicContact CG-CD1 4.45Å
75	E	54.3	Low	57.8	Low	197 Å²	197	83.6 Å²	83.6	92%	0.921	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	136.1	170.1	-68.9	-171.4	157.4	0	0	110	D73	D73-E75 PolarHBondContact O-N 3.08Å
76	G	57.5	Low	56.3	Low	40 Å²	40	92.6 Å²	92.6	41%	0.412	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.3	-3.7	178.5	0	0	0	0	0	116.5	Q16 N17	Q16-G76 WeakPolarHBondContact CA-O 3.22Å; N17-G76 PolarHBondContact N-O 3.3Å
77	L	53	Low	54.7	Low	33 Å²	33	96.9 Å²	96.9	17%	0.173	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.2	172.8	-68.1	168.9	0	0	0	110.9	V14 K15 Q16 L71 R74	V14-L77 HydrophobicContact CG1-CB 4.09Å; V14-L77 HydrophobicContact CG1-CD2 3.91Å; V14-L77 HydrophobicContact CG1-CG 4.45Å; K15-L77 WeakPolarHBondContact O-CA 3.4Å; Q16-L77 HydrophobicContact CB-CD2 3.93Å; Q16-L77 HydrophobicContact CG-CD2 4.29Å; L71-L77 HydrophobicContact CD2-CD1 3.92Å; R74-L77 HydrophobicContact CB-CD1 3.75Å; R74-L77 HydrophobicContact CB-CG 4.49Å; R74-L77 HydrophobicContact CG-CD1 4.45Å
78	Q	54	Low	53	Low	123 Å²	123	98.1 Å²	98.1	58%	0.575	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.3	178.6	-162.7	176	-5.7	0	0	110.4	V14 K15	V14-Q78 WeakPolarHBondContact CA-O 3.47Å; K15-Q78 PolarHBondContact N-O 3.44Å; K15-Q78 PolarHBondContact O-N 3.06Å
79	I	56.1	Low	51.9	Low	26 Å²	26	99.3 Å²	99.3	13%	0.133	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	118.6	175.4	-57.6	175.3	0	0	0	108.3	V12 L65 R66 L69 L71	V12-I79 HydrophobicContact CG1-CG2 3.56Å; L65-I79 HydrophobicContact CB-CD1 4.42Å; L65-I79 HydrophobicContact CD2-CG2 4.47Å; R66-I79 HydrophobicContact CG-CD1 3.74Å; L69-I79 HydrophobicContact CD1-CD1 4.35Å; L71-I79 HydrophobicContact CD1-CD1 3.83Å; L71-I79 HydrophobicContact CD1-CG1 3.91Å
80	S	47.9	Very low	50.6	Low	17 Å²	17	100.9 Å²	100.9	12%	0.119	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.7	169.7	72.7	0	0	0	0	111.1	V13	V13-S80 PolarHBondContact N-O 3.48Å; V13-S80 PolarHBondContact O-N 3.37Å; V13-S80 VanDerWaalsContact O-O 3.12Å
81	Y	52.2	Low	49.2	Very low	110 Å²	110	104.1 Å²	104.1	43%	0.431	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	114.9	172.7	-59.8	-90.6	0	0	0	107.7	I10 V12 L65	I10-Y81 HydrophobicContact CG2-CD1 3.97Å; I10-Y81 HydrophobicContact CG2-CG 4.4Å; V12-Y81 HydrophobicContact CG2-CD1 3.99Å; V12-Y81 HydrophobicContact CG2-CE1 3.99Å; L65-Y81 HydrophobicContact CD1-CE1 4.41Å; L65-Y81 WeakPolarHBondContact CD1-OH 3.48Å
82	E	44.6	Very low	48	Very low	53 Å²	53	108.5 Å²	108.5	25%	0.248	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.5	176.7	-70.3	-171.8	177.3	0	0	109.5	E11 V13 K15 H84	E11-E82 PolarHBondContact N-O 3.11Å; E11-E82 PolarHBondContact O-N 3.32Å; V13-E82 HydrophobicContact CB-CG 4.46Å; V13-E82 HydrophobicContact CG2-CB 3.96Å; V13-E82 HydrophobicContact CG2-CG 3.95Å; K15-E82 WeakPolarHBondContact CE-OE1 3.29Å; K15-E82 IonicContact NZ-OE1 3.3Å; K15-E82 PolarHBondContact NZ-OE1 2.89Å; E82-H84 IonicContact OE2-NE2 3Å
83	Q	41.9	Very low	46.7	Very low	94 Å²	94	113.4 Å²	113.4	44%	0.439	56%	0.555	S	S	.	*			trans	-117.6	103.6	173.2	-166.4	-176.2	1.1	0	0	107.9	I85	Q83-I85 HydrophobicContact CG-CD1 4.22Å; Q83-I85 HydrophobicContact CG-CG1 3.99Å; Q83-I85 PolarHBondContact O-N 3.23Å
84	H	42.4	Very low	45.5	Very low	138 Å²	138	113.1 Å²	113.1	64%	0.639	55%	0.554	S	S	*	*			trans	-75.7	108.2	172.7	-82.8	-87.7	0	0	0	109.5	E82	E82-H84 IonicContact OE2-NE2 3Å
85	I	43.6	Very low	44.4	Very low	61 Å²	61	110.8 Å²	110.8	31%	0.313	55%	0.554	S	S	.	*			trans	-110.8	116.9	173	-59.2	168.2	0	0	0	107.9	Q83 Y87	Q83-I85 HydrophobicContact CG-CD1 4.22Å; Q83-I85 HydrophobicContact CG-CG1 3.99Å; Q83-I85 PolarHBondContact O-N 3.23Å; I85-Y87 HydrophobicContact CG2-CE2 4.49Å; I85-Y87 PolarHBondContact O-N 2.92Å
86	Q	33.1	Very low	43.4	Very low	194 Å²	194	111 Å²	111	91%	0.907	56%	0.555	S	S	*	*			trans	-70.8	118.2	168.7	-119.3	176.6	-33.2	0	0	108.9
87	Y	32.5	Very low	42.2	Very low	163 Å²	163	112.3 Å²	112.3	64%	0.639	57%	0.569	S	S	*	*			trans	-86.3	142.6	173.5	-78.2	-91.5	0	0	0	110.5	I85	I85-Y87 HydrophobicContact CG2-CE2 4.49Å; I85-Y87 PolarHBondContact O-N 2.92Å
88	D	36.1	Very low	41.4	Very low	103 Å²	103	120 Å²	120	55%	0.551	60%	0.604	S	S	*	*			trans	-94.1	101.5	166.2	-178	1.2	0	0	0	107.2	S90	D88-S90 PolarHBondContact O-N 2.97Å; D88-S90 WeakPolarHBondContact OD1-CB 3.27Å; D88-S90 PolarHBondContact OD1-N 3.08Å; D88-S90 PolarHBondContact OD1-OG 3.25Å
89	E	44.2	Very low	40.2	Very low	168 Å²	168	121.7 Å²	121.7	79%	0.785	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-67.6	-10.9	-175.5	-70.7	179.5	162.2	0	0	113.1	K91	E89-K91 PolarHBondContact O-N 2.03Å; E89-K91 VanDerWaalsContact O-N 3.12Å
90	S	39.8	Very low	39.2	Very low	89 Å²	89	130.1 Å²	130.1	62%	0.622	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-76.1	5.9	-174.1	68.5	0	0	0	0	116.3	D88	D88-S90 PolarHBondContact O-N 2.97Å; D88-S90 WeakPolarHBondContact OD1-CB 3.27Å; D88-S90 PolarHBondContact OD1-N 3.08Å; D88-S90 PolarHBondContact OD1-OG 3.25Å
91	K	42.3	Very low	38.4	Very low	174 Å²	174	139 Å²	139	76%	0.757	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-121.1	13.2	-173.2	-70.2	-168.9	178.8	-178.7	0	115.6	E89	E89-K91 PolarHBondContact O-N 2.03Å; E89-K91 VanDerWaalsContact O-N 3.12Å
92	V	43	Very low	37.5	Very low	114 Å²	114	139.1 Å²	139.1	69%	0.691	71%	0.706	S	S	*	*	S	Bend	trans	-104.5	-10.6	-169.8	-175.7	0	0	0	0	113.6	D94	V92-D94 PolarHBondContact O-N 3.03Å
93	D	37.3	Very low	37.1	Very low	149 Å²	149	141.2 Å²	141.2	80%	0.797	72%	0.718	S	S	*	*			trans	-91.1	7.3	-164.7	-69.4	-25.1	0	0	0	117.7
94	D	39.5	Very low	36.8	Very low	154 Å²	154	139.8 Å²	139.8	82%	0.824	72%	0.717	S	S	*	*	S	Bend	trans	-102.5	17	-169.4	-77.7	-28.3	0	0	0	116.5	V92	V92-D94 PolarHBondContact O-N 3.03Å
95	L	38	Very low	37	Very low	126 Å²	126	136.6 Å²	136.6	66%	0.66	71%	0.71	S	S	*	*			trans	-135.2	38.9	-168.6	-67.7	173.1	0	0	0	116.4	K375	L95-K375 PolarHBondContact O-NZ 3.02Å
96	E	32.9	Very low	37	Very low	201 Å²	201	138.6 Å²	138.6	94%	0.939	72%	0.721	S	S	*	*			trans	-112	106	164.7	-70.4	-168.2	158.9	0	0	110.6
97	G	31.4	Very low	37.5	Very low	69 Å²	69	133.7 Å²	133.7	71%	0.711	70%	0.701	S	S	*	*			trans	163.8	119.4	174.3	0	0	0	0	0	112.8
98	E	36.4	Very low	38.3	Very low	193 Å²	193	129 Å²	129	90%	0.902	69%	0.689	S	S	*	*			trans	100.5	106.4	165.2	-52.1	-160	158.9	0	0	117.8
99	D	29.4	Very low	38.8	Very low	159 Å²	159	124.8 Å²	124.8	85%	0.85	67%	0.668	S	S	*	*			trans	-63.4	124.3	175.8	-63.7	-58.3	0	0	0	112.9
100	F	35	Very low	38.9	Very low	203 Å²	203	120.9 Å²	120.9	89%	0.89	65%	0.649	S	S	*	*			trans	-137.8	131.1	152.2	-97	-85.1	0	0	0	111.7	C102	F100-C102 PolarHBondContact O-N 3.05Å
101	F	30.1	Very low	39.2	Very low	205 Å²	205	121.1 Å²	121.1	90%	0.899	64%	0.643	S	S	*	*	S	Bend	trans	-57.2	120.8	-170.6	-136.5	-104	0	0	0	113.3
102	C	33.8	Very low	39.6	Very low	112 Å²	112	118 Å²	118	76%	0.757	63%	0.634	S	S	*	*			trans	141.4	87	150.9	-84.1	0	0	0	0	109.9	F100	F100-C102 PolarHBondContact O-N 3.05Å
103	L	36.1	Very low	39.7	Very low	97 Å²	97	114.5 Å²	114.5	51%	0.508	61%	0.611	S	S	.	*			trans	-167.5	140.5	141	-97.6	174.1	0	0	0	108.7	W379	L103-W379 HydrophobicContact CD1-CB 3.85Å; L103-W379 HydrophobicContact CD1-CG 4.48Å; L103-W379 HydrophobicContact CD2-CB 4.2Å
104	P	36.4	Very low	40.4	Very low	64 Å²	64	111.1 Å²	111.1	42%	0.416	60%	0.596	S	S	.	*			trans	-58.7	145.6	163.9	-12.5	27.6	0	0	0	109.1	T108	P104-T108 HydrophobicContact CB-CG2 3.39Å; P104-T108 HydrophobicContact CG-CG2 4.37Å
105	S	46.6	Very low	40.9	Very low	70 Å²	70	110.7 Å²	110.7	49%	0.49	59%	0.587	S	S	.	*			trans	-48.4	155.5	173.5	72.1	0	0	0	0	111.2	D107 T108 A109	S105-D107 PolarHBondContact O-N 3.3Å; S105-T108 WeakPolarHBondContact O-CA 3.48Å; S105-T108 WeakPolarHBondContact O-CB 3.47Å; S105-T108 PolarHBondContact O-N 2.97Å; S105-T108 PolarHBondContact OG-N 3.49Å; S105-T108 PolarHBondContact OG-OG1 2.99Å; S105-A109 PolarHBondContact O-N 3.03Å
106	L	44	Very low	41.6	Very low	103 Å²	103	106.8 Å²	106.8	54%	0.539	57%	0.568	S	S	.	*	H	α-helix	trans	-46.4	-35.9	176.5	-175.1	70.9	0	0	0	112	A109 K110	L106-A109 PolarHBondContact O-N 3.11Å; L106-K110 VanDerWaalsContact O-CG 3.27Å; L106-K110 WeakPolarHBondContact O-CG 3.46Å; L106-K110 PolarHBondContact O-N 3.07Å
107	D	43.1	Very low	42.5	Very low	91 Å²	91	98.3 Å²	98.3	49%	0.487	53%	0.53	S	S	.	.	H	α-helix	trans	-74.7	-31	177.5	-64.7	-32.9	0	0	0	113.6	S105 K110 N111	S105-D107 PolarHBondContact O-N 3.3Å; D107-K110 IonicContact OD1-NZ 2.81Å; D107-K110 PolarHBondContact OD1-NZ 3.47Å; D107-N111 WeakPolarHBondContact O-CB 3.42Å; D107-N111 VanDerWaalsContact O-CG 3.24Å; D107-N111 PolarHBondContact O-N 3.15Å; D107-N111 PolarHBondContact O-ND2 3.39Å
108	T	48.3	Very low	43.4	Very low	66 Å²	66	99.3 Å²	99.3	41%	0.405	52%	0.518	S	S	.	.	H	α-helix	trans	-72.8	-35.8	172.5	-42.2	0	0	0	0	111.6	P104 S105 N111 L112	P104-T108 HydrophobicContact CB-CG2 3.39Å; P104-T108 HydrophobicContact CG-CG2 4.37Å; S105-T108 WeakPolarHBondContact O-CA 3.48Å; S105-T108 WeakPolarHBondContact O-CB 3.47Å; S105-T108 PolarHBondContact O-N 2.97Å; S105-T108 PolarHBondContact OG-N 3.49Å; S105-T108 PolarHBondContact OG-OG1 2.99Å; T108-N111 PolarHBondContact O-N 3.26Å; T108-L112 WeakPolarHBondContact O-CB 3.44Å; T108-L112 PolarHBondContact O-N 2.96Å
109	A	46.7	Very low	44.1	Very low	13 Å²	13	98.3 Å²	98.3	11%	0.107	51%	0.511	C	S	.	.	H	α-helix	trans	-65.7	-43.1	172.3	0	0	0	0	0	112	S105 L106 N111 L112 L113 W379	S105-A109 PolarHBondContact O-N 3.03Å; L106-A109 PolarHBondContact O-N 3.11Å; A109-N111 PolarHBondContact O-N 2.83Å; A109-L112 PolarHBondContact O-N 3.25Å; A109-L113 PolarHBondContact O-N 3.39Å; A109-W379 HydrophobicContact CB-CZ2 4.41Å
110	K	46.4	Very low	44.9	Very low	87 Å²	87	95.9 Å²	95.9	38%	0.378	49%	0.493	S	S	.	.	H	α-helix	trans	-56.4	-49	171.1	-73.4	171.8	-168	158.9	0	111.3	L106 D107 L112 L113 V114 I179	L106-K110 VanDerWaalsContact O-CG 3.27Å; L106-K110 WeakPolarHBondContact O-CG 3.46Å; L106-K110 PolarHBondContact O-N 3.07Å; D107-K110 IonicContact OD1-NZ 2.81Å; D107-K110 PolarHBondContact OD1-NZ 3.47Å; K110-L112 VanDerWaalsContact C-N 3.33Å; K110-L112 PolarHBondContact O-N 3.01Å; K110-L113 PolarHBondContact O-N 2.87Å; K110-V114 WeakPolarHBondContact O-CB 3.43Å; K110-V114 VanDerWaalsContact O-CG2 3.26Å; K110-V114 WeakPolarHBondContact O-CG2 3.1Å; K110-V114 PolarHBondContact O-N 3.43Å; K110-I179 HydrophobicContact CG-CD1 4.36Å
111	N	47	Very low	45.8	Very low	94 Å²	94	88.4 Å²	88.4	50%	0.503	46%	0.461	S	S	.	.	H	α-helix	trans	-64.9	-35.5	179.8	-79	-41	0	0	0	112.8	D107 T108 A109 K115	D107-N111 WeakPolarHBondContact O-CB 3.42Å; D107-N111 VanDerWaalsContact O-CG 3.24Å; D107-N111 PolarHBondContact O-N 3.15Å; D107-N111 PolarHBondContact O-ND2 3.39Å; T108-N111 PolarHBondContact O-N 3.26Å; A109-N111 PolarHBondContact O-N 2.83Å; N111-K115 VanDerWaalsContact O-CB 3.25Å; N111-K115 WeakPolarHBondContact O-CB 3.07Å; N111-K115 WeakPolarHBondContact O-CG 3.43Å; N111-K115 PolarHBondContact O-N 3.16Å
112	L	49.9	Very low	46.9	Very low	107 Å²	107	84.5 Å²	84.5	56%	0.56	45%	0.445	S	S	*	.	H	α-helix	trans	-71.1	-41.5	178.3	-155.6	76.6	0	0	0	111.3	T108 A109 K110 T116	T108-L112 WeakPolarHBondContact O-CB 3.44Å; T108-L112 PolarHBondContact O-N 2.96Å; A109-L112 PolarHBondContact O-N 3.25Å; K110-L112 VanDerWaalsContact C-N 3.33Å; K110-L112 PolarHBondContact O-N 3.01Å; L112-T116 VanDerWaalsContact O-CB 3.27Å; L112-T116 WeakPolarHBondContact O-CB 3.47Å; L112-T116 PolarHBondContact O-N 2.93Å; L112-T116 PolarHBondContact O-OG1 2.89Å
113	L	46.1	Very low	47.8	Very low	41 Å²	41	84.7 Å²	84.7	22%	0.215	45%	0.445	C	S	.	.	H	α-helix	trans	-59.5	-53.7	171.6	-96.4	151.8	0	0	0	111.2	A109 K110 K115 T116 V117 W187 W379	A109-L113 PolarHBondContact O-N 3.39Å; K110-L113 PolarHBondContact O-N 2.87Å; L113-K115 VanDerWaalsContact C-N 3.32Å; L113-K115 PolarHBondContact O-N 3.43Å; L113-T116 PolarHBondContact O-N 3.17Å; L113-T116 VanDerWaalsContact O-N 3.12Å; L113-V117 WeakPolarHBondContact O-CB 3.2Å; L113-V117 VanDerWaalsContact O-CG2 3.23Å; L113-V117 WeakPolarHBondContact O-CG2 3.32Å; L113-V117 PolarHBondContact O-N 3.24Å; L113-W187 HydrophobicContact CD2-CD2 4.19Å; L113-W187 HydrophobicContact CD2-CG 4.13Å; L113-W379 HydrophobicContact CD1-CH2 3.63Å; L113-W379 HydrophobicContact CD1-CZ2 3.97Å
114	V	51.2	Low	48.6	Very low	79 Å²	79	86.6 Å²	86.6	48%	0.479	45%	0.454	S	S	.	.	H	α-helix	trans	-58.2	-44.8	179.8	172.1	0	0	0	0	111	K110 T116 V117 I118	K110-V114 WeakPolarHBondContact O-CB 3.43Å; K110-V114 VanDerWaalsContact O-CG2 3.26Å; K110-V114 WeakPolarHBondContact O-CG2 3.1Å; K110-V114 PolarHBondContact O-N 3.43Å; V114-T116 PolarHBondContact O-N 3.33Å; V114-V117 PolarHBondContact O-N 3.33Å; V114-I118 HydrophobicContact CG1-CD1 3.65Å; V114-I118 HydrophobicContact CG1-CG1 4.44Å; V114-I118 WeakPolarHBondContact O-CB 2.96Å; V114-I118 WeakPolarHBondContact O-CD1 3.26Å; V114-I118 WeakPolarHBondContact O-CG1 3.27Å; V114-I118 PolarHBondContact O-N 3.47Å
115	K	51.3	Low	49.4	Very low	145 Å²	145	85.3 Å²	85.3	63%	0.63	44%	0.444	S	S	*	.	H	α-helix	trans	-64.2	-39.3	176.4	-76.7	175.2	177.7	-178.2	0	113	N111 L113 F119	N111-K115 VanDerWaalsContact O-CB 3.25Å; N111-K115 WeakPolarHBondContact O-CB 3.07Å; N111-K115 WeakPolarHBondContact O-CG 3.43Å; N111-K115 PolarHBondContact O-N 3.16Å; L113-K115 VanDerWaalsContact C-N 3.32Å; L113-K115 PolarHBondContact O-N 3.43Å; K115-F119 VanDerWaalsContact O-CB 3.23Å; K115-F119 WeakPolarHBondContact O-CB 3.47Å; K115-F119 PolarHBondContact O-N 3.5Å
116	T	51.5	Low	49.6	Very low	43 Å²	43	88 Å²	88	26%	0.264	45%	0.452	S	S	.	.	H	α-helix	trans	-69	-42.1	178.9	-54.5	0	0	0	0	110.8	L112 L113 V114 F119 F120 L191	L112-T116 VanDerWaalsContact O-CB 3.27Å; L112-T116 WeakPolarHBondContact O-CB 3.47Å; L112-T116 PolarHBondContact O-N 2.93Å; L112-T116 PolarHBondContact O-OG1 2.89Å; L113-T116 PolarHBondContact O-N 3.17Å; L113-T116 VanDerWaalsContact O-N 3.12Å; V114-T116 PolarHBondContact O-N 3.33Å; T116-F119 PolarHBondContact O-N 3.36Å; T116-F120 HydrophobicContact CG2-CD2 3.77Å; T116-F120 HydrophobicContact CG2-CE2 3.97Å; T116-F120 WeakPolarHBondContact O-CD2 3.48Å; T116-F120 PolarHBondContact O-N 2.87Å; T116-F120 VanDerWaalsContact O-N 3.08Å; T116-L191 HydrophobicContact CG2-CD1 3.74Å
117	V	51.1	Low	49.9	Very low	24 Å²	24	88.5 Å²	88.5	15%	0.145	46%	0.462	C	S	.	.	H	α-helix	trans	-61.4	-48	174.6	175	0	0	0	0	111.1	L113 V114 F121 L125 W187	L113-V117 WeakPolarHBondContact O-CB 3.2Å; L113-V117 VanDerWaalsContact O-CG2 3.23Å; L113-V117 WeakPolarHBondContact O-CG2 3.32Å; L113-V117 PolarHBondContact O-N 3.24Å; V114-V117 PolarHBondContact O-N 3.33Å; V117-F121 WeakPolarHBondContact O-CB 3.33Å; V117-F121 PolarHBondContact O-N 3.28Å; V117-F121 VanDerWaalsContact O-N 3.17Å; V117-L125 HydrophobicContact CG1-CD1 3.99Å; V117-W187 HydrophobicContact CB-CH2 4.43Å; V117-W187 HydrophobicContact CG1-CH2 4.39Å; V117-W187 HydrophobicContact CG2-CE3 4.41Å; V117-W187 HydrophobicContact CG2-CH2 3.29Å; V117-W187 HydrophobicContact CG2-CZ2 3.81Å; V117-W187 HydrophobicContact CG2-CZ3 3.62Å
118	I	51.4	Low	50.3	Low	90 Å²	90	87.3 Å²	87.3	46%	0.462	46%	0.455	S	S	.	.	H	α-helix	trans	-62.5	-47	178	-67.9	168.1	0	0	0	110.2	V114 F120 H122	V114-I118 HydrophobicContact CG1-CD1 3.65Å; V114-I118 HydrophobicContact CG1-CG1 4.44Å; V114-I118 WeakPolarHBondContact O-CB 2.96Å; V114-I118 WeakPolarHBondContact O-CD1 3.26Å; V114-I118 WeakPolarHBondContact O-CG1 3.27Å; V114-I118 PolarHBondContact O-N 3.47Å; I118-F120 PolarHBondContact O-N 3.28Å; I118-H122 WeakPolarHBondContact O-CA 3.45Å; I118-H122 WeakPolarHBondContact O-CB 3.35Å; I118-H122 PolarHBondContact O-N 3.09Å
119	F	49.9	Very low	50.4	Low	171 Å²	171	88.3 Å²	88.3	75%	0.75	46%	0.461	S	S	*	.	H	α-helix	trans	-66.2	-41.7	-174.4	-166.6	-95.3	0	0	0	113.6	K115 T116	K115-F119 VanDerWaalsContact O-CB 3.23Å; K115-F119 WeakPolarHBondContact O-CB 3.47Å; K115-F119 PolarHBondContact O-N 3.5Å; T116-F119 PolarHBondContact O-N 3.36Å
120	F	48.2	Very low	50.3	Low	108 Å²	108	95.2 Å²	95.2	47%	0.474	50%	0.495	S	S	.	.	H	α-helix	trans	-81.2	-26.2	-177.5	-82.8	-82.1	0	0	0	113.9	T116 I118 L191	T116-F120 HydrophobicContact CG2-CD2 3.77Å; T116-F120 HydrophobicContact CG2-CE2 3.97Å; T116-F120 WeakPolarHBondContact O-CD2 3.48Å; T116-F120 PolarHBondContact O-N 2.87Å; T116-F120 VanDerWaalsContact O-N 3.08Å; I118-F120 PolarHBondContact O-N 3.28Å; F120-L191 HydrophobicContact CB-CD2 4.35Å; F120-L191 HydrophobicContact CD2-CD2 4.31Å; F120-L191 HydrophobicContact CG-CD2 4.24Å
121	F	53.8	Low	50.5	Low	47 Å²	47	95.4 Å²	95.4	21%	0.206	50%	0.5	C	S	.	.	H	α-helix	trans	-121.6	6.8	-170.9	-64.8	-88.5	0	0	0	114.1	V117 P123 L124 L125 W187 L191	V117-F121 WeakPolarHBondContact O-CB 3.33Å; V117-F121 PolarHBondContact O-N 3.28Å; V117-F121 VanDerWaalsContact O-N 3.17Å; F121-P123 VanDerWaalsContact C-N 3.25Å; F121-P123 VanDerWaalsContact O-N 3.11Å; F121-L124 PolarHBondContact O-N 3.49Å; F121-L125 HydrophobicContact CB-CB 4.45Å; F121-L125 HydrophobicContact CB-CD1 3.19Å; F121-L125 HydrophobicContact CB-CG 3.61Å; F121-L125 HydrophobicContact CG-CD1 4.01Å; F121-L125 HydrophobicContact CG-CG 4.48Å; F121-L125 WeakPolarHBondContact O-CB 3.34Å; F121-L125 PolarHBondContact O-N 3.21Å; F121-W187 HydrophobicContact CE2-CZ3 4.13Å; F121-L191 HydrophobicContact CE2-CD2 3.86Å; F121-L191 HydrophobicContact CZ-CD2 4.48Å
122	H	52.3	Low	50.6	Low	122 Å²	122	94.6 Å²	94.6	57%	0.565	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.9	-40.2	176.2	-160.2	-78.6	0	0	0	114.3	I118	I118-H122 WeakPolarHBondContact O-CA 3.45Å; I118-H122 WeakPolarHBondContact O-CB 3.35Å; I118-H122 PolarHBondContact O-N 3.09Å
123	P	51.7	Low	50.4	Low	116 Å²	116	98.4 Å²	98.4	75%	0.753	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-16.2	179.5	-11.3	29	0	0	0	113.9	F121	F121-P123 VanDerWaalsContact C-N 3.25Å; F121-P123 VanDerWaalsContact O-N 3.11Å
124	L	54.7	Low	50.3	Low	137 Å²	137	103.2 Å²	103.2	72%	0.717	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-23.2	-176	-124.1	90.6	0	0	0	113.6	F121	F121-L124 PolarHBondContact O-N 3.49Å
125	L	53.3	Low	50.2	Low	38 Å²	38	101 Å²	101	20%	0.199	52%	0.515	C	S	.	.	S	Bend	trans	-101.7	0.3	-172.1	-73.7	174.3	0	0	0	114.8	V117 F121 P127 L128	V117-L125 HydrophobicContact CG1-CD1 3.99Å; F121-L125 HydrophobicContact CB-CB 4.45Å; F121-L125 HydrophobicContact CB-CD1 3.19Å; F121-L125 HydrophobicContact CB-CG 3.61Å; F121-L125 HydrophobicContact CG-CD1 4.01Å; F121-L125 HydrophobicContact CG-CG 4.48Å; F121-L125 WeakPolarHBondContact O-CB 3.34Å; F121-L125 PolarHBondContact O-N 3.21Å; L125-P127 VanDerWaalsContact C-N 3.27Å; L125-L128 HydrophobicContact CD2-CB 3.91Å; L125-L128 HydrophobicContact CD2-CD1 4.29Å; L125-L128 HydrophobicContact CD2-CD2 3.87Å; L125-L128 HydrophobicContact CD2-CG 4.24Å; L125-L128 WeakPolarHBondContact O-CB 3.23Å; L125-L128 PolarHBondContact O-N 2.96Å
126	L	49.7	Very low	50.1	Low	125 Å²	125	103.2 Å²	103.2	65%	0.654	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-56.9	-33.3	-180	-158.8	67.1	0	0	0	113.8	L128 T129	L126-L128 VanDerWaalsContact C-N 3.32Å; L126-L128 PolarHBondContact O-N 3.12Å; L126-T129 PolarHBondContact O-OG1 3.24Å
127	P	49.9	Very low	50	Low	115 Å²	115	109 Å²	109	75%	0.747	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-79.5	-7.3	173	-8.5	25.8	0	0	0	114.6	L125	L125-P127 VanDerWaalsContact C-N 3.27Å
128	L	51.7	Low	50.2	Low	66 Å²	66	109 Å²	109	35%	0.346	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-99.2	-2.2	-170.4	-124.6	106.1	0	0	0	114.3	L125 L126 L130 D131	L125-L128 HydrophobicContact CD2-CB 3.91Å; L125-L128 HydrophobicContact CD2-CD1 4.29Å; L125-L128 HydrophobicContact CD2-CD2 3.87Å; L125-L128 HydrophobicContact CD2-CG 4.24Å; L125-L128 WeakPolarHBondContact O-CB 3.23Å; L125-L128 PolarHBondContact O-N 2.96Å; L126-L128 VanDerWaalsContact C-N 3.32Å; L126-L128 PolarHBondContact O-N 3.12Å; L128-L130 VanDerWaalsContact C-N 3.29Å; L128-L130 PolarHBondContact O-N 3.12Å; L128-D131 PolarHBondContact O-N 3.45Å
129	T	50.6	Low	51.1	Low	86 Å²	86	108.9 Å²	108.9	53%	0.528	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.3	-17.5	-169.8	52.8	0	0	0	0	114.3	L126	L126-T129 PolarHBondContact O-OG1 3.24Å
130	L	44.9	Very low	52.9	Low	158 Å²	158	101.9 Å²	101.9	83%	0.827	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-25.4	176.6	-92	140.5	0	0	0	113.8	L128	L128-L130 VanDerWaalsContact C-N 3.29Å; L128-L130 PolarHBondContact O-N 3.12Å
131	D	51.3	Low	55	Low	91 Å²	91	105.6 Å²	105.6	49%	0.487	54%	0.537	S	S	.	.	H	α-helix	trans	-80.6	-17.9	176.5	-84.5	-30.8	0	0	0	113.4	L128 F133 Q134 M135	L128-D131 PolarHBondContact O-N 3.45Å; D131-F133 VanDerWaalsContact C-N 3.29Å; D131-F133 PolarHBondContact O-N 3.06Å; D131-Q134 PolarHBondContact O-N 2.83Å; D131-M135 HydrophobicContact CB-SD 4.5Å; D131-M135 WeakPolarHBondContact O-CB 3.37Å; D131-M135 VanDerWaalsContact O-CG 3.24Å; D131-M135 WeakPolarHBondContact O-CG 3.48Å; D131-M135 PolarHBondContact O-N 2.96Å
132	L	47.7	Very low	56.9	Low	78 Å²	78	106.3 Å²	106.3	41%	0.408	55%	0.545	S	S	.	.	H	α-helix	trans	-63.3	-29.8	-174	-101.4	146.5	0	0	0	113.9
133	F	45.9	Very low	58.9	Low	187 Å²	187	101.3 Å²	101.3	82%	0.82	52%	0.523	S	S	*	.	H	α-helix	trans	-76.9	-41.3	176.2	-94.3	-85.3	0	0	0	112.5	D131 M135 W136	D131-F133 VanDerWaalsContact C-N 3.29Å; D131-F133 PolarHBondContact O-N 3.06Å; F133-M135 VanDerWaalsContact C-N 3.31Å; F133-M135 PolarHBondContact O-N 3.19Å; F133-W136 WeakPolarHBondContact O-CB 3.2Å; F133-W136 PolarHBondContact O-N 2.81Å
134	Q	45	Very low	61	Low	142 Å²	142	98.6 Å²	98.6	66%	0.664	50%	0.501	S	S	*	.	H	α-helix	trans	-71.2	-25.3	175.2	-88.8	176	-20.8	0	0	112.8	D131 W136 E137	D131-Q134 PolarHBondContact O-N 2.83Å; Q134-W136 PolarHBondContact O-N 3.48Å; Q134-E137 PolarHBondContact O-N 3.01Å
135	M	47.5	Very low	63	Low	33 Å²	33	93.3 Å²	93.3	16%	0.163	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-65.8	-20.8	173	-76.7	176.2	64.5	0	0	113.6	D131 F133 E137 K174 F177	D131-M135 HydrophobicContact CB-SD 4.5Å; D131-M135 WeakPolarHBondContact O-CB 3.37Å; D131-M135 VanDerWaalsContact O-CG 3.24Å; D131-M135 WeakPolarHBondContact O-CG 3.48Å; D131-M135 PolarHBondContact O-N 2.96Å; F133-M135 VanDerWaalsContact C-N 3.31Å; F133-M135 PolarHBondContact O-N 3.19Å; M135-E137 VanDerWaalsContact C-N 3.34Å; M135-K174 HydrophobicContact CE-CG 4.22Å; M135-K174 HydrophobicContact CG-CG 4.49Å; M135-F177 HydrophobicContact CE-CD2 3.37Å; M135-F177 HydrophobicContact CE-CE2 3.69Å; M135-F177 HydrophobicContact CE-CG 4.28Å
136	W	50.2	Low	65	Low	191 Å²	191	98.8 Å²	98.8	72%	0.723	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-73.7	-23.1	-179	-168.9	-95.4	0	0	0	113.2	F133 Q134 A138	F133-W136 WeakPolarHBondContact O-CB 3.2Å; F133-W136 PolarHBondContact O-N 2.81Å; Q134-W136 PolarHBondContact O-N 3.48Å; W136-A138 PolarHBondContact O-N 3.27Å; W136-A138 VanDerWaalsContact O-N 3.1Å
137	E	49.2	Very low	67.1	Low	164 Å²	164	95.6 Å²	95.6	77%	0.766	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-82.3	26.6	-178.7	-68.2	-171.6	158.2	0	0	114.5	Q134 M135 S139	Q134-E137 PolarHBondContact O-N 3.01Å; M135-E137 VanDerWaalsContact C-N 3.34Å; E137-S139 PolarHBondContact O-N 2.89Å
138	A	55.4	Low	69.2	Low	24 Å²	24	90.4 Å²	90.4	20%	0.198	45%	0.451	C	S	.	.			trans	-66.1	110.5	171.5	0	0	0	0	0	110.3	W136 W140 R178	W136-A138 PolarHBondContact O-N 3.27Å; W136-A138 VanDerWaalsContact O-N 3.1Å; A138-W140 PolarHBondContact O-N 3.48Å; A138-R178 PolarHBondContact O-NH1 3.44Å; A138-R178 VanDerWaalsContact O-NH1 3.15Å
139	S	69.7	Low	71.3	Confident	88 Å²	88	89.2 Å²	89.2	62%	0.615	45%	0.447	S	S	*	.			trans	-61.8	43.3	-175.9	-167.2	0	0	0	0	115.9	E137	E137-S139 PolarHBondContact O-N 2.89Å
140	W	88.8	Confident	73.3	Confident	24 Å²	24	91.2 Å²	91.2	9%	0.091	45%	0.454	C	S	.	.			trans	-132.9	142	175.1	67.4	-94.4	0	0	0	111.9	A138 V142 R163 P164 L166 R178 H180	A138-W140 PolarHBondContact O-N 3.48Å; W140-V142 HydrophobicContact CH2-CG1 4.35Å; W140-V142 HydrophobicContact CZ3-CG1 3.72Å; W140-R163 HydrophobicContact CH2-CG 3.56Å; W140-R163 HydrophobicContact CZ2-CG 4.14Å; W140-R163 HydrophobicContact CZ3-CB 4.43Å; W140-R163 HydrophobicContact CZ3-CG 3.9Å; W140-P164 HydrophobicContact CB-CG 4.06Å; W140-P164 HydrophobicContact CD2-CG 4.44Å; W140-P164 HydrophobicContact CE3-CG 4.06Å; W140-P164 HydrophobicContact CG-CG 4.48Å; W140-L166 HydrophobicContact CB-CD2 4.09Å; W140-L166 HydrophobicContact CD2-CD1 4.33Å; W140-L166 HydrophobicContact CD2-CD2 4.42Å; W140-L166 HydrophobicContact CG-CD1 4.45Å; W140-L166 HydrophobicContact CG-CD2 3.87Å; W140-L166 HydrophobicContact CZ2-CD1 4.46Å; W140-R178 VanDerWaalsContact CD2-NH1 3.25Å; W140-R178 HydrophobicContact CH2-CB 4.46Å; W140-R178 HydrophobicContact CZ2-CB 4.21Å; W140-R178 HydrophobicContact CZ2-CG 4.5Å; W140-R178 PolarHBondContact O-NH1 3.49Å; W140-R178 PolarHBondContact O-NH2 2.88Å; W140-R178 VanDerWaalsContact O-NH2 3.1Å; W140-H180 HydrophobicContact CH2-CB 4.42Å; W140-H180 AromaticContact CH2-CD2 3.96Å
141	K	91.4	Very high	75.6	Confident	186 Å²	186	86.7 Å²	86.7	81%	0.809	43%	0.426	S	S	*	.			trans	-102.8	145.2	172.9	-66.7	-178	-179.5	177.9	0	109
142	V	94.2	Very high	77.7	Confident	61 Å²	61	83.8 Å²	83.8	37%	0.37	41%	0.41	S	S	.	.			trans	-59.3	147.1	170	-70.5	0	0	0	0	109.6	W140 H162 H180	W140-V142 HydrophobicContact CH2-CG1 4.35Å; W140-V142 HydrophobicContact CZ3-CG1 3.72Å; V142-H162 CarbonylContact C-O 3.54Å; V142-H162 VanDerWaalsContact CA-O 3.26Å; V142-H162 WeakPolarHBondContact CA-O 3.41Å; V142-H180 HydrophobicContact CG1-CB 4.37Å
143	T	94	Very high	79.9	Confident	17 Å²	17	83 Å²	83	10%	0.104	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-120	158.4	-174.9	-171.2	0	0	0	0	111.7	S147 L148 H162 P164	T143-S147 WeakPolarHBondContact OG1-CB 3.29Å; T143-L148 HydrophobicContact CG2-CD2 3.55Å; T143-L148 HydrophobicContact CG2-CG 4.29Å; T143-H162 HydrophobicContact CG2-CB 4.11Å; T143-H162 PolarHBondContact N-O 3.41Å; T143-H162 WeakPolarHBondContact O-CB 3.32Å; T143-H162 PolarHBondContact O-N 2.89Å; T143-H162 VanDerWaalsContact O-N 3.13Å; T143-P164 HydrophobicContact CG2-CB 4.42Å
144	H	96.6	Very high	82.1	Confident	60 Å²	60	76.9 Å²	76.9	28%	0.278	38%	0.38	S	S	.	.			trans	-79.8	147.3	175.3	-174.7	-98.9	0	0	0	110.5	Q146 S147 K159	H144-Q146 PolarHBondContact ND1-N 3.38Å; H144-Q146 PolarHBondContact O-N 2.98Å; H144-Q146 VanDerWaalsContact O-N 3.14Å; H144-S147 WeakPolarHBondContact O-CB 3.32Å; H144-S147 PolarHBondContact O-N 2.92Å; H144-K159 CarbonylContact C-O 3.56Å; H144-K159 WeakPolarHBondContact CA-O 3.43Å; H144-K159 PolarHBondContact CD2-O 3.03Å; H144-K159 PolarHBondContact NE2-O 3.27Å
145	F	95.9	Very high	84.5	Confident	25 Å²	25	70.5 Å²	70.5	11%	0.11	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-53.3	-38.8	-175.6	178.9	-93.7	0	0	0	113.6	S147 L148 K153 N155 D156 L158 K159 H162	F145-S147 PolarHBondContact O-N 3.4Å; F145-L148 HydrophobicContact CD2-CD1 4.11Å; F145-L148 WeakPolarHBondContact O-CB 3.29Å; F145-L148 PolarHBondContact O-N 2.92Å; F145-K153 HydrophobicContact CE1-CB 4.41Å; F145-K153 HydrophobicContact CE1-CD 4.27Å; F145-K153 HydrophobicContact CE1-CG 4.2Å; F145-K153 HydrophobicContact CE2-CB 3.95Å; F145-K153 HydrophobicContact CE2-CG 4.1Å; F145-K153 HydrophobicContact CZ-CB 3.62Å; F145-K153 HydrophobicContact CZ-CD 4.28Å; F145-K153 HydrophobicContact CZ-CG 3.8Å; F145-N155 VanDerWaalsContact CE2-C 3.49Å; F145-N155 VanDerWaalsContact CE2-O 3.3Å; F145-N155 WeakPolarHBondContact CE2-O 3.4Å; F145-D156 HydrophobicContact CD1-CB 4.27Å; F145-D156 HydrophobicContact CE1-CB 3.49Å; F145-D156 VanDerWaalsContact CE1-CB 3.49Å; F145-D156 HydrophobicContact CE2-CB 4.32Å; F145-D156 HydrophobicContact CZ-CB 3.53Å; F145-L158 WeakPolarHBondContact CB-O 3.37Å; F145-K159 WeakPolarHBondContact CB-O 3.25Å; F145-K159 PolarHBondContact N-O 2.67Å; F145-H162 AromaticContact CD2-NE2 3.83Å
146	Q	95.4	Very high	86.8	Confident	153 Å²	153	72.2 Å²	72.2	72%	0.715	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-65.7	-25.4	180	-68	177.2	3.5	0	0	113.2	H144 L148	H144-Q146 PolarHBondContact ND1-N 3.38Å; H144-Q146 PolarHBondContact O-N 2.98Å; H144-Q146 VanDerWaalsContact O-N 3.14Å; Q146-L148 VanDerWaalsContact C-N 3.34Å
147	S	94.4	Very high	89.1	Confident	58 Å²	58	64.9 Å²	64.9	41%	0.406	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-86.3	-6.4	-179.9	-54	0	0	0	0	112.9	T143 H144 F145	T143-S147 WeakPolarHBondContact OG1-CB 3.29Å; H144-S147 WeakPolarHBondContact O-CB 3.32Å; H144-S147 PolarHBondContact O-N 2.92Å; F145-S147 PolarHBondContact O-N 3.4Å
148	L	94.4	Very high	91.3	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.037	30%	0.299	C	S	.	.	S	Bend	trans	-70.8	150.3	177.4	-68.3	173.7	0	0	0	111.6	T143 F145 Q146 L152 K153 H162	T143-L148 HydrophobicContact CG2-CD2 3.55Å; T143-L148 HydrophobicContact CG2-CG 4.29Å; F145-L148 HydrophobicContact CD2-CD1 4.11Å; F145-L148 WeakPolarHBondContact O-CB 3.29Å; F145-L148 PolarHBondContact O-N 2.92Å; Q146-L148 VanDerWaalsContact C-N 3.34Å; L148-L152 HydrophobicContact CB-CB 4.2Å; L148-L152 HydrophobicContact CD1-CB 4.26Å; L148-L152 HydrophobicContact CD2-CB 4.22Å; L148-L152 HydrophobicContact CD2-CD1 4.08Å; L148-L152 HydrophobicContact CG-CB 4.48Å; L148-K153 HydrophobicContact CB-CG 4.02Å; L148-K153 WeakPolarHBondContact O-CE 3.34Å; L148-K153 PolarHBondContact O-NZ 3.07Å; L148-H162 HydrophobicContact CD1-CB 3.88Å; L148-H162 HydrophobicContact CD2-CB 3.97Å; L148-H162 HydrophobicContact CG-CB 4.27Å
149	P	94.7	Very high	93.3	Very high	40 Å²	40	60 Å²	60	26%	0.26	31%	0.305	S	S	.	.			trans	-69.1	155	163.4	33.2	-37.4	0	0	0	110.8	W151 L152 P165	P149-W151 VanDerWaalsContact C-N 3.26Å; P149-W151 HydrophobicContact CG-CD2 4.45Å; P149-W151 HydrophobicContact CG-CZ2 4.01Å; P149-W151 PolarHBondContact O-N 3.45Å; P149-W151 VanDerWaalsContact O-N 3.12Å; P149-L152 HydrophobicContact CG-CB 4.31Å; P149-L152 HydrophobicContact CG-CD1 3.89Å; P149-L152 HydrophobicContact CG-CG 4.13Å; P149-L152 PolarHBondContact O-N 2.92Å; P149-P165 HydrophobicContact CG-CG 3.75Å
150	D	93.2	Very high	94.6	Very high	128 Å²	128	58.5 Å²	58.5	68%	0.684	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-61.1	-29.3	-169.1	-66.7	-22.5	0	0	0	114.8	L152 K153	D150-L152 PolarHBondContact O-N 3.38Å; D150-K153 PolarHBondContact O-N 3.48Å; D150-K153 IonicContact OD1-NZ 2.67Å; D150-K153 PolarHBondContact OD1-NZ 2.99Å
151	W	92.3	Very high	94.9	Very high	64 Å²	64	57.7 Å²	57.7	24%	0.242	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-70.9	-15.1	177.2	62.3	-87.7	0	0	0	113.8	P149 P165 S240 V244 T247	P149-W151 VanDerWaalsContact C-N 3.26Å; P149-W151 HydrophobicContact CG-CD2 4.45Å; P149-W151 HydrophobicContact CG-CZ2 4.01Å; P149-W151 PolarHBondContact O-N 3.45Å; P149-W151 VanDerWaalsContact O-N 3.12Å; W151-P165 HydrophobicContact CZ2-CB 4.15Å; W151-P165 HydrophobicContact CZ2-CG 4.17Å; W151-S240 VanDerWaalsContact CZ3-O 3.23Å; W151-S240 WeakPolarHBondContact CZ3-O 3.27Å; W151-V244 HydrophobicContact CB-CG2 4.39Å; W151-V244 HydrophobicContact CD2-CG2 4.01Å; W151-V244 HydrophobicContact CG-CG2 3.77Å; W151-T247 HydrophobicContact CE3-CG2 4.17Å; W151-T247 HydrophobicContact CZ3-CG2 4.43Å; W151-T247 WeakPolarHBondContact CZ3-OG1 3.27Å
152	L	95.1	Very high	95.2	Very high	29 Å²	29	49.6 Å²	49.6	15%	0.152	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-97.5	-9.1	172.9	-72.1	179.4	0	0	0	113.4	L148 P149 D150 D154 P165 S240	L148-L152 HydrophobicContact CB-CB 4.2Å; L148-L152 HydrophobicContact CD1-CB 4.26Å; L148-L152 HydrophobicContact CD2-CB 4.22Å; L148-L152 HydrophobicContact CD2-CD1 4.08Å; L148-L152 HydrophobicContact CG-CB 4.48Å; P149-L152 HydrophobicContact CG-CB 4.31Å; P149-L152 HydrophobicContact CG-CD1 3.89Å; P149-L152 HydrophobicContact CG-CG 4.13Å; P149-L152 PolarHBondContact O-N 2.92Å; D150-L152 PolarHBondContact O-N 3.38Å; L152-D154 VanDerWaalsContact C-N 3.31Å; L152-D154 PolarHBondContact O-N 3.13Å; L152-P165 HydrophobicContact CD1-CG 4.18Å; L152-S240 WeakPolarHBondContact CD2-O 3.49Å
153	K	94.4	Very high	95.3	Very high	63 Å²	63	47.1 Å²	47.1	27%	0.274	24%	0.243	S	C	.	.			trans	-82	69.7	-178.6	-70.3	-177.5	-175.4	146.7	0	112	F145 L148 D150	F145-K153 HydrophobicContact CE1-CB 4.41Å; F145-K153 HydrophobicContact CE1-CD 4.27Å; F145-K153 HydrophobicContact CE1-CG 4.2Å; F145-K153 HydrophobicContact CE2-CB 3.95Å; F145-K153 HydrophobicContact CE2-CG 4.1Å; F145-K153 HydrophobicContact CZ-CB 3.62Å; F145-K153 HydrophobicContact CZ-CD 4.28Å; F145-K153 HydrophobicContact CZ-CG 3.8Å; L148-K153 HydrophobicContact CB-CG 4.02Å; L148-K153 WeakPolarHBondContact O-CE 3.34Å; L148-K153 PolarHBondContact O-NZ 3.07Å; D150-K153 PolarHBondContact O-N 3.48Å; D150-K153 IonicContact OD1-NZ 2.67Å; D150-K153 PolarHBondContact OD1-NZ 2.99Å
154	D	92.5	Very high	95.4	Very high	58 Å²	58	47.6 Å²	47.6	31%	0.31	25%	0.247	S	C	.	.	S	Bend	trans	-82.3	-46.1	179.3	178.9	60	0	0	0	113.5	L152 R310	L152-D154 VanDerWaalsContact C-N 3.31Å; L152-D154 PolarHBondContact O-N 3.13Å; D154-R310 PolarHBondContact O-NH2 3.46Å; D154-R310 IonicContact OD1-NH2 3.56Å; D154-R310 PolarHBondContact OD1-NH2 3.1Å; D154-R310 VanDerWaalsContact OD1-NH2 3.14Å; D154-R310 IonicContact OD2-CZ 3.59Å; D154-R310 IonicContact OD2-NH1 2.7Å; D154-R310 IonicContact OD2-NH2 2.84Å; D154-R310 PolarHBondContact OD2-NH2 3.36Å
155	N	95.9	Very high	95.4	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.037	25%	0.25	C	S	.	.			trans	-130.7	103.9	-176	-169.1	3.7	0	0	0	111.8	F145 F157 L158 R366 E369	F145-N155 VanDerWaalsContact CE2-C 3.49Å; F145-N155 VanDerWaalsContact CE2-O 3.3Å; F145-N155 WeakPolarHBondContact CE2-O 3.4Å; N155-F157 PolarHBondContact O-N 2.91Å; N155-F157 PolarHBondContact OD1-N 2.72Å; N155-L158 HydrophobicContact CB-CD1 4.24Å; N155-L158 HydrophobicContact CB-CG 4.22Å; N155-L158 PolarHBondContact O-N 3.16Å; N155-R366 WeakPolarHBondContact OD1-CD 3.23Å; N155-R366 PolarHBondContact OD1-NH1 2.98Å; N155-R366 VanDerWaalsContact OD1-NH1 3.09Å; N155-E369 PolarHBondContact ND2-OE1 3.29Å
156	D	96.1	Very high	95.3	Very high	70 Å²	70	47 Å²	47	37%	0.374	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.4	-178.5	65.5	-23.4	0	0	0	114.8	F145 K159 R366	F145-D156 HydrophobicContact CD1-CB 4.27Å; F145-D156 HydrophobicContact CE1-CB 3.49Å; F145-D156 VanDerWaalsContact CE1-CB 3.49Å; F145-D156 HydrophobicContact CE2-CB 4.32Å; F145-D156 HydrophobicContact CZ-CB 3.53Å; D156-K159 WeakPolarHBondContact O-CE 3.38Å; D156-K159 PolarHBondContact O-NZ 2.63Å; D156-R366 IonicContact OD1-CZ 2.89Å; D156-R366 IonicContact OD1-NH1 3.98Å; D156-R366 PolarHBondContact OD1-NH1 3.37Å; D156-R366 IonicContact OD1-NH2 2.67Å
157	F	96.9	Very high	95.2	Very high	36 Å²	36	43.6 Å²	43.6	16%	0.158	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-21.6	171.8	-61.6	-42.9	0	0	0	113.3	N155 R366 E369 R370 P373 G374	N155-F157 PolarHBondContact O-N 2.91Å; N155-F157 PolarHBondContact OD1-N 2.72Å; F157-R366 HydrophobicContact CD2-CB 3.88Å; F157-R366 HydrophobicContact CE2-CB 4.04Å; F157-E369 HydrophobicContact CB-CB 4.11Å; F157-E369 HydrophobicContact CB-CG 3.71Å; F157-E369 HydrophobicContact CD2-CG 4.25Å; F157-E369 HydrophobicContact CG-CG 4.45Å; F157-R370 HydrophobicContact CD2-CB 3.96Å; F157-R370 HydrophobicContact CE2-CB 3.61Å; F157-R370 HydrophobicContact CE2-CG 3.82Å; F157-R370 HydrophobicContact CZ-CB 4.12Å; F157-R370 HydrophobicContact CZ-CG 3.88Å; F157-P373 HydrophobicContact CB-CB 4.49Å; F157-P373 HydrophobicContact CD1-CB 4.32Å; F157-P373 HydrophobicContact CD1-CG 4Å; F157-P373 WeakPolarHBondContact O-CA 3.43Å; F157-G374 PolarHBondContact O-N 3.02Å
158	L	97	Very high	95.1	Very high	11 Å²	11	43.4 Å²	43.4	6%	0.058	24%	0.239	C	C	.	.			trans	-85.6	109.9	173.2	-51.6	-179.5	0	0	0	108.5	F145 N155 H162 E369 D377 Q381	F145-L158 WeakPolarHBondContact CB-O 3.37Å; N155-L158 HydrophobicContact CB-CD1 4.24Å; N155-L158 HydrophobicContact CB-CG 4.22Å; N155-L158 PolarHBondContact O-N 3.16Å; L158-H162 PolarHBondContact O-NE2 2.98Å; L158-E369 HydrophobicContact CD2-CB 4.12Å; L158-E369 HydrophobicContact CD2-CG 4.11Å; L158-D377 WeakPolarHBondContact CA-OD1 3.39Å; L158-Q381 HydrophobicContact CD1-CG 4.39Å; L158-Q381 HydrophobicContact CD2-CB 3.8Å; L158-Q381 HydrophobicContact CD2-CG 4.11Å
159	K	97.2	Very high	95.1	Very high	75 Å²	75	48.6 Å²	48.6	33%	0.326	26%	0.259	S	S	.	.			trans	-90.4	-43.2	-167.1	-58.8	-58	-177.9	-173.8	0	113	H144 F145 D156 D377	H144-K159 CarbonylContact C-O 3.56Å; H144-K159 WeakPolarHBondContact CA-O 3.43Å; H144-K159 PolarHBondContact CD2-O 3.03Å; H144-K159 PolarHBondContact NE2-O 3.27Å; F145-K159 WeakPolarHBondContact CB-O 3.25Å; F145-K159 PolarHBondContact N-O 2.67Å; D156-K159 WeakPolarHBondContact O-CE 3.38Å; D156-K159 PolarHBondContact O-NZ 2.63Å; K159-D377 PolarHBondContact N-OD1 2.86Å; K159-D377 PolarHBondContact N-OD2 3.22Å
160	S	95.4	Very high	95	Very high	57 Å²	57	51 Å²	51	40%	0.399	27%	0.27	S	S	.	.	S	Bend	trans	-127.5	177.7	-173.1	73.5	0	0	0	0	111.8	H162 T181 D377	S160-H162 VanDerWaalsContact C-N 3.35Å; S160-H162 PolarHBondContact O-N 2.92Å; S160-T181 VanDerWaalsContact O-CG2 3.24Å; S160-T181 WeakPolarHBondContact O-CG2 3.38Å; S160-D377 WeakPolarHBondContact CA-OD2 3.2Å; S160-D377 WeakPolarHBondContact CB-OD2 3.17Å; S160-D377 PolarHBondContact N-OD2 2.83Å; S160-D377 PolarHBondContact OG-OD2 3.43Å
161	G	95.6	Very high	95	Very high	7 Å²	7	46 Å²	46	7%	0.072	25%	0.246	C	C	.	.			trans	79.6	11	173.7	0	0	0	0	0	115.3	H180 T181	G161-H180 CarbonylContact O-C 3.52Å; G161-H180 WeakPolarHBondContact O-CA 2.91Å; G161-H180 VanDerWaalsContact O-CB 3.23Å; G161-H180 WeakPolarHBondContact O-CB 3.34Å; G161-T181 PolarHBondContact O-N 3.48Å
162	H	97.7	Very high	95.1	Very high	16 Å²	16	43 Å²	43	7%	0.074	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-79.1	149.1	-177.9	-65.2	-82.5	0	0	0	111.7	V142 T143 F145 L148 L158 S160 T181	V142-H162 CarbonylContact C-O 3.54Å; V142-H162 VanDerWaalsContact CA-O 3.26Å; V142-H162 WeakPolarHBondContact CA-O 3.41Å; T143-H162 HydrophobicContact CG2-CB 4.11Å; T143-H162 PolarHBondContact N-O 3.41Å; T143-H162 WeakPolarHBondContact O-CB 3.32Å; T143-H162 PolarHBondContact O-N 2.89Å; T143-H162 VanDerWaalsContact O-N 3.13Å; F145-H162 AromaticContact CD2-NE2 3.83Å; L148-H162 HydrophobicContact CD1-CB 3.88Å; L148-H162 HydrophobicContact CD2-CB 3.97Å; L148-H162 HydrophobicContact CG-CB 4.27Å; L158-H162 PolarHBondContact O-NE2 2.98Å; S160-H162 VanDerWaalsContact C-N 3.35Å; S160-H162 PolarHBondContact O-N 2.92Å; H162-T181 PolarHBondContact ND1-OG1 3.14Å
163	R	97	Very high	95.1	Very high	8 Å²	8	46.1 Å²	46.1	3%	0.03	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-75.1	135.1	169.1	-70.5	178.2	-68.2	170.6	12.6	109.6	W140 S175 H180 H237 T238 S240 C241	W140-R163 HydrophobicContact CH2-CG 3.56Å; W140-R163 HydrophobicContact CZ2-CG 4.14Å; W140-R163 HydrophobicContact CZ3-CB 4.43Å; W140-R163 HydrophobicContact CZ3-CG 3.9Å; R163-S175 PolarHBondContact NH1-OG 2.66Å; R163-H180 HydrophobicContact CG-CB 3.96Å; R163-H237 PolarHBondContact NH1-O 3.29Å; R163-H237 PolarHBondContact NH2-O 3.41Å; R163-T238 PolarHBondContact NH1-O 2.74Å; R163-S240 PolarHBondContact NH2-OG 3.29Å; R163-C241 HydrophobicContact CB-CB 3.95Å; R163-C241 VanDerWaalsContact CZ-SG 3.58Å
164	P	95.4	Very high	95	Very high	28 Å²	28	46.5 Å²	46.5	18%	0.182	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-67.2	171.7	167.5	31.8	-34	0	0	0	110	W140 T143 L166	W140-P164 HydrophobicContact CB-CG 4.06Å; W140-P164 HydrophobicContact CD2-CG 4.44Å; W140-P164 HydrophobicContact CE3-CG 4.06Å; W140-P164 HydrophobicContact CG-CG 4.48Å; T143-P164 HydrophobicContact CG2-CB 4.42Å; P164-L166 HydrophobicContact CG-CD2 4.07Å; P164-L166 WeakPolarHBondContact O-CG 3.49Å; P164-L166 PolarHBondContact O-N 3.15Å
165	P	96.4	Very high	95.1	Very high	55 Å²	55	43.8 Å²	43.8	36%	0.357	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-56.4	121.7	167.4	-25.8	37.3	0	0	0	110.9	P149 W151 L152 P167 C241	P149-P165 HydrophobicContact CG-CG 3.75Å; W151-P165 HydrophobicContact CZ2-CB 4.15Å; W151-P165 HydrophobicContact CZ2-CG 4.17Å; L152-P165 HydrophobicContact CD1-CG 4.18Å; P165-P167 WeakPolarHBondContact O-CD 3.36Å; P165-C241 CarbonylContact C-O 3.55Å; P165-C241 WeakPolarHBondContact CA-O 3.13Å
166	L	94.8	Very high	95.1	Very high	16 Å²	16	44.3 Å²	44.3	8%	0.084	24%	0.241	C	C	.	.			trans	-119.6	83.8	179.8	-64.1	-179	0	0	0	108.8	W140 P164 S168 A171 C172 C241 H242	W140-L166 HydrophobicContact CB-CD2 4.09Å; W140-L166 HydrophobicContact CD2-CD1 4.33Å; W140-L166 HydrophobicContact CD2-CD2 4.42Å; W140-L166 HydrophobicContact CG-CD1 4.45Å; W140-L166 HydrophobicContact CG-CD2 3.87Å; W140-L166 HydrophobicContact CZ2-CD1 4.46Å; P164-L166 HydrophobicContact CG-CD2 4.07Å; P164-L166 WeakPolarHBondContact O-CG 3.49Å; P164-L166 PolarHBondContact O-N 3.15Å; L166-S168 PolarHBondContact O-N 3.24Å; L166-A171 HydrophobicContact CB-CB 4.26Å; L166-A171 HydrophobicContact CD1-CB 4.37Å; L166-C172 PolarHBondContact O-SG 3.29Å; L166-C172 VanDerWaalsContact O-SG 3.38Å; L166-C241 PolarHBondContact N-O 2.88Å; L166-H242 VanDerWaalsContact O-CA 3.32Å; L166-H242 WeakPolarHBondContact O-CA 3.23Å
167	P	93.5	Very high	95	Very high	83 Å²	83	44.7 Å²	44.7	54%	0.539	24%	0.239	S	C	.	.			trans	-73.9	41.5	-176.1	34.1	-38.1	0	0	0	113	P165 H242	P165-P167 WeakPolarHBondContact O-CD 3.36Å; P167-H242 WeakPolarHBondContact CA-O 3.37Å
168	S	92.3	Very high	94.8	Very high	53 Å²	53	45.3 Å²	45.3	37%	0.371	24%	0.241	S	C	.	.			trans	-142.2	122.4	176.4	170	0	0	0	0	108.7	L166 N170 A171 C172	L166-S168 PolarHBondContact O-N 3.24Å; S168-N170 PolarHBondContact O-N 3.01Å; S168-N170 PolarHBondContact OG-N 3.39Å; S168-A171 PolarHBondContact O-N 3.43Å; S168-A171 PolarHBondContact OG-N 2.87Å; S168-C172 PolarHBondContact O-N 3.5Å; S168-C172 PolarHBondContact O-SG 2.81Å
169	Y	93.4	Very high	94.8	Very high	117 Å²	117	48 Å²	48	46%	0.459	25%	0.254	S	S	.	.	H	α-helix	trans	-58.2	-36.8	173.2	-71.6	-73.7	0	0	0	111.9	C172 L173 V239 H242 V246	Y169-C172 PolarHBondContact O-N 3.42Å; Y169-L173 WeakPolarHBondContact O-CB 3.47Å; Y169-L173 VanDerWaalsContact O-CG 3.29Å; Y169-L173 WeakPolarHBondContact O-CG 3.23Å; Y169-L173 PolarHBondContact O-N 3.48Å; Y169-V239 HydrophobicContact CD1-CG1 3.99Å; Y169-V239 HydrophobicContact CE1-CG1 4.22Å; Y169-H242 AromaticContact CD1-CD2 3.88Å; Y169-H242 AromaticContact CD2-NE2 3.63Å; Y169-H242 AromaticContact CE1-CD2 3.98Å; Y169-H242 AromaticContact CE2-NE2 3.64Å; Y169-H242 AromaticContact CG-CD2 3.93Å; Y169-H242 AromaticContact CG-NE2 3.96Å; Y169-H242 AromaticContact CZ-NE2 3.96Å; Y169-V246 HydrophobicContact CE1-CG1 4.16Å; Y169-V246 VanDerWaalsContact OH-CG2 3.31Å; Y169-V246 WeakPolarHBondContact OH-CG2 3.47Å
170	N	93	Very high	94.7	Very high	91 Å²	91	44.5 Å²	44.5	49%	0.487	24%	0.239	S	C	.	.	H	α-helix	trans	-63.1	-44	177.2	-172	-82.8	0	0	0	111.2	S168 C172 L173 K174	S168-N170 PolarHBondContact O-N 3.01Å; S168-N170 PolarHBondContact OG-N 3.39Å; N170-C172 PolarHBondContact O-N 3.11Å; N170-L173 PolarHBondContact O-N 3.3Å; N170-K174 WeakPolarHBondContact O-CB 3.37Å; N170-K174 WeakPolarHBondContact O-CG 3.45Å; N170-K174 PolarHBondContact O-N 3.09Å; N170-K174 WeakPolarHBondContact OD1-CD 3.4Å; N170-K174 WeakPolarHBondContact OD1-CE 3.5Å; N170-K174 PolarHBondContact OD1-NZ 2.95Å
171	A	92.5	Very high	94.9	Very high	22 Å²	22	42 Å²	42	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-39.6	175.6	0	0	0	0	0	112.2	L166 S168 S175	L166-A171 HydrophobicContact CB-CB 4.26Å; L166-A171 HydrophobicContact CD1-CB 4.37Å; S168-A171 PolarHBondContact O-N 3.43Å; S168-A171 PolarHBondContact OG-N 2.87Å; A171-S175 PolarHBondContact O-N 3.39Å
172	C	95.1	Very high	95	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.5	-45.1	173.9	-65.8	0	0	0	0	111.8	L166 S168 Y169 N170 S175 V239 C241	L166-C172 PolarHBondContact O-SG 3.29Å; L166-C172 VanDerWaalsContact O-SG 3.38Å; S168-C172 PolarHBondContact O-N 3.5Å; S168-C172 PolarHBondContact O-SG 2.81Å; Y169-C172 PolarHBondContact O-N 3.42Å; N170-C172 PolarHBondContact O-N 3.11Å; C172-S175 WeakPolarHBondContact O-CB 3.45Å; C172-S175 PolarHBondContact O-N 2.9Å; C172-S175 PolarHBondContact O-OG 3.23Å; C172-V239 HydrophobicContact CB-CG1 4.4Å; C172-C241 VanDerWaalsContact SG-SG 3.69Å
173	L	95	Very high	95	Very high	95 Å²	95	43 Å²	43	50%	0.497	22%	0.224	S	C	.	.	H	α-helix	trans	-65.4	-44.1	177.6	-72	169	0	0	0	111.9	Y169 N170 S175 I176 T238	Y169-L173 WeakPolarHBondContact O-CB 3.47Å; Y169-L173 VanDerWaalsContact O-CG 3.29Å; Y169-L173 WeakPolarHBondContact O-CG 3.23Å; Y169-L173 PolarHBondContact O-N 3.48Å; N170-L173 PolarHBondContact O-N 3.3Å; L173-S175 PolarHBondContact O-N 3.13Å; L173-I176 HydrophobicContact CD2-CD1 4.22Å; L173-I176 VanDerWaalsContact O-CB 3.29Å; L173-I176 WeakPolarHBondContact O-CB 3.44Å; L173-I176 WeakPolarHBondContact O-CD1 3.4Å; L173-I176 WeakPolarHBondContact O-CG1 3.42Å; L173-I176 PolarHBondContact O-N 3.38Å; L173-I176 VanDerWaalsContact O-N 3.14Å; L173-T238 HydrophobicContact CD2-CG2 4.13Å
174	K	92.9	Very high	94.9	Very high	72 Å²	72	42.9 Å²	42.9	31%	0.313	23%	0.226	S	C	.	.	H	α-helix	trans	-60.3	-30.2	174.1	-74.6	-179.5	175.1	176.3	0	112.1	M135 N170 I176 F177	M135-K174 HydrophobicContact CE-CG 4.22Å; M135-K174 HydrophobicContact CG-CG 4.49Å; N170-K174 WeakPolarHBondContact O-CB 3.37Å; N170-K174 WeakPolarHBondContact O-CG 3.45Å; N170-K174 PolarHBondContact O-N 3.09Å; N170-K174 WeakPolarHBondContact OD1-CD 3.4Å; N170-K174 WeakPolarHBondContact OD1-CE 3.5Å; N170-K174 PolarHBondContact OD1-NZ 2.95Å; K174-I176 PolarHBondContact O-N 3.14Å; K174-F177 PolarHBondContact O-N 2.65Å
175	S	94.6	Very high	95.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-21.7	178	81	0	0	0	0	113.8	R163 A171 C172 L173 F177 R178 H180	R163-S175 PolarHBondContact NH1-OG 2.66Å; A171-S175 PolarHBondContact O-N 3.39Å; C172-S175 WeakPolarHBondContact O-CB 3.45Å; C172-S175 PolarHBondContact O-N 2.9Å; C172-S175 PolarHBondContact O-OG 3.23Å; L173-S175 PolarHBondContact O-N 3.13Å; S175-F177 PolarHBondContact O-N 2.97Å; S175-R178 PolarHBondContact O-N 3.31Å; S175-H180 PolarHBondContact O-NE2 3.43Å
176	I	95.6	Very high	95.2	Very high	18 Å²	18	39 Å²	39	9%	0.092	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-35	175	-64.3	171.6	0	0	0	111.8	L173 K174 I186 W187 M190 T238	L173-I176 HydrophobicContact CD2-CD1 4.22Å; L173-I176 VanDerWaalsContact O-CB 3.29Å; L173-I176 WeakPolarHBondContact O-CB 3.44Å; L173-I176 WeakPolarHBondContact O-CD1 3.4Å; L173-I176 WeakPolarHBondContact O-CG1 3.42Å; L173-I176 PolarHBondContact O-N 3.38Å; L173-I176 VanDerWaalsContact O-N 3.14Å; K174-I176 PolarHBondContact O-N 3.14Å; I176-I186 HydrophobicContact CG1-CG2 4.21Å; I176-I186 HydrophobicContact CG2-CG2 4.31Å; I176-W187 HydrophobicContact CG2-CZ2 3.77Å; I176-W187 PolarHBondContact O-NE1 3.21Å; I176-M190 HydrophobicContact CG2-CE 3.97Å; I176-T238 HydrophobicContact CD1-CG2 3.88Å; I176-T238 HydrophobicContact CG1-CG2 3.88Å
177	F	94.4	Very high	95.3	Very high	79 Å²	79	39.2 Å²	39.2	35%	0.346	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	9.1	-178.6	-58	-78.1	0	0	0	113.6	M135 K174 S175 W187	M135-F177 HydrophobicContact CE-CD2 3.37Å; M135-F177 HydrophobicContact CE-CE2 3.69Å; M135-F177 HydrophobicContact CE-CG 4.28Å; K174-F177 PolarHBondContact O-N 2.65Å; S175-F177 PolarHBondContact O-N 2.97Å; F177-W187 HydrophobicContact CD1-CZ2 4.1Å; F177-W187 HydrophobicContact CE1-CH2 4.13Å; F177-W187 AromaticContact CE1-CZ2 3.95Å; F177-W187 HydrophobicContact CE1-CZ2 3.95Å
178	R	92.8	Very high	95.6	Very high	49 Å²	49	36.7 Å²	36.7	19%	0.185	18%	0.183	C	C	.	.	S	Bend	trans	-109	156.3	173.3	-67.8	-165.6	63.9	-170.7	-2.4	111.1	A138 W140 S175 H180 T183	A138-R178 PolarHBondContact O-NH1 3.44Å; A138-R178 VanDerWaalsContact O-NH1 3.15Å; W140-R178 VanDerWaalsContact CD2-NH1 3.25Å; W140-R178 HydrophobicContact CH2-CB 4.46Å; W140-R178 HydrophobicContact CZ2-CB 4.21Å; W140-R178 HydrophobicContact CZ2-CG 4.5Å; W140-R178 PolarHBondContact O-NH1 3.49Å; W140-R178 PolarHBondContact O-NH2 2.88Å; W140-R178 VanDerWaalsContact O-NH2 3.1Å; S175-R178 PolarHBondContact O-N 3.31Å; R178-H180 PolarHBondContact O-CD2 2.91Å; R178-T183 PolarHBondContact O-OG1 3.09Å
179	I	95.9	Very high	95.8	Very high	68 Å²	68	34.3 Å²	34.3	35%	0.349	17%	0.166	S	C	.	.			trans	-89.9	120.8	177.6	-59.2	178.4	0	0	0	109.2	K110 T183 I378	K110-I179 HydrophobicContact CG-CD1 4.36Å; I179-T183 WeakPolarHBondContact CA-OG1 3.33Å; I179-I378 HydrophobicContact CG2-CD1 4.4Å; I179-I378 HydrophobicContact CG2-CG1 4.45Å; I179-I378 HydrophobicContact CG2-CG2 3.57Å
180	H	96.6	Very high	96.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	-159.8	174	178.2	53.2	67.9	0	0	0	109.8	W140 V142 G161 R163 S175 R178 E182 T183	W140-H180 HydrophobicContact CH2-CB 4.42Å; W140-H180 AromaticContact CH2-CD2 3.96Å; V142-H180 HydrophobicContact CG1-CB 4.37Å; G161-H180 CarbonylContact O-C 3.52Å; G161-H180 WeakPolarHBondContact O-CA 2.91Å; G161-H180 VanDerWaalsContact O-CB 3.23Å; G161-H180 WeakPolarHBondContact O-CB 3.34Å; R163-H180 HydrophobicContact CG-CB 3.96Å; S175-H180 PolarHBondContact O-NE2 3.43Å; R178-H180 PolarHBondContact O-CD2 2.91Å; H180-E182 PolarHBondContact ND1-N 3.49Å; H180-E182 PolarHBondContact O-N 3.27Å; H180-E182 VanDerWaalsContact O-N 3.08Å; H180-T183 PolarHBondContact CE1-N 2.99Å; H180-T183 PolarHBondContact N-OG1 2.63Å; H180-T183 PolarHBondContact ND1-N 3.39Å; H180-T183 PolarHBondContact ND1-OG1 2.98Å; H180-T183 WeakPolarHBondContact O-CB 3.29Å; H180-T183 PolarHBondContact O-N 3.47Å; H180-T183 PolarHBondContact O-OG1 3.32Å
181	T	97.6	Very high	96.3	Very high	4 Å²	4	27.8 Å²	27.8	3%	0.025	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-31.8	-177	53.5	0	0	0	0	114.3	S160 G161 H162 D377	S160-T181 VanDerWaalsContact O-CG2 3.24Å; S160-T181 WeakPolarHBondContact O-CG2 3.38Å; G161-T181 PolarHBondContact O-N 3.48Å; H162-T181 PolarHBondContact ND1-OG1 3.14Å; T181-D377 WeakPolarHBondContact CA-O 3.29Å; T181-D377 VanDerWaalsContact CG2-O 3.3Å; T181-D377 WeakPolarHBondContact CG2-O 3.4Å
182	E	98.1	Very high	96.6	Very high	42 Å²	42	26.9 Å²	26.9	20%	0.196	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-5.6	180	-61.4	-66.8	170.9	0	0	115.1	H180 G184 N185 I186 H237	H180-E182 PolarHBondContact ND1-N 3.49Å; H180-E182 PolarHBondContact O-N 3.27Å; H180-E182 VanDerWaalsContact O-N 3.08Å; E182-G184 PolarHBondContact O-N 3.02Å; E182-N185 PolarHBondContact O-N 3.1Å; E182-N185 PolarHBondContact OE2-ND2 3.49Å; E182-I186 HydrophobicContact CB-CD1 4.38Å; E182-I186 WeakPolarHBondContact O-CG1 3.31Å; E182-I186 PolarHBondContact O-N 3.45Å; E182-H237 IonicContact OE2-CE1 3.17Å; E182-H237 IonicContact OE2-CG 3.13Å; E182-H237 IonicContact OE2-ND1 2.73Å; E182-H237 PolarHBondContact OE2-ND1 3.49Å
183	T	97.3	Very high	96.7	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.018	14%	0.137	C	C	.	.	H	α-helix	trans	-58.6	-51.3	-172.8	-57.7	0	0	0	0	111.4	R178 I179 H180 N185 I186 W187 W379	R178-T183 PolarHBondContact O-OG1 3.09Å; I179-T183 WeakPolarHBondContact CA-OG1 3.33Å; H180-T183 PolarHBondContact CE1-N 2.99Å; H180-T183 PolarHBondContact N-OG1 2.63Å; H180-T183 PolarHBondContact ND1-N 3.39Å; H180-T183 PolarHBondContact ND1-OG1 2.98Å; H180-T183 WeakPolarHBondContact O-CB 3.29Å; H180-T183 PolarHBondContact O-N 3.47Å; H180-T183 PolarHBondContact O-OG1 3.32Å; T183-N185 VanDerWaalsContact C-N 3.35Å; T183-N185 PolarHBondContact O-N 3.26Å; T183-I186 PolarHBondContact O-N 2.81Å; T183-W187 VanDerWaalsContact O-CD1 3.26Å; T183-W187 PolarHBondContact O-N 2.92Å; T183-W379 HydrophobicContact CG2-CH2 4.32Å
184	G	96.6	Very high	96.9	Very high	6 Å²	6	25.2 Å²	25.2	6%	0.062	13%	0.13	C	C	.	.	H	α-helix	trans	-65.3	-35.1	178.3	0	0	0	0	0	113.4	E182 T188	E182-G184 PolarHBondContact O-N 3.02Å; G184-T188 WeakPolarHBondContact O-CB 3.44Å; G184-T188 WeakPolarHBondContact O-CG2 3.39Å; G184-T188 PolarHBondContact O-N 3.43Å; G184-T188 PolarHBondContact O-OG1 3.45Å
185	N	98.2	Very high	97.1	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.011	13%	0.128	C	C	.	.	H	α-helix	trans	-64.5	-43	178.6	-62	-28.6	0	0	0	111	E182 T183 T188 H237 Q381 Q384 H387	E182-N185 PolarHBondContact O-N 3.1Å; E182-N185 PolarHBondContact OE2-ND2 3.49Å; T183-N185 VanDerWaalsContact C-N 3.35Å; T183-N185 PolarHBondContact O-N 3.26Å; N185-T188 PolarHBondContact O-OG1 2.98Å; N185-H237 HydrophobicContact CB-CB 4.22Å; N185-Q381 PolarHBondContact ND2-NE2 3.2Å; N185-Q381 PolarHBondContact OD1-NE2 2.85Å; N185-Q381 VanDerWaalsContact OD1-NE2 3.09Å; N185-Q384 WeakPolarHBondContact OD1-CA 3.49Å; N185-Q384 WeakPolarHBondContact OD1-CG 3.37Å; N185-Q384 PolarHBondContact OD1-N 3.44Å; N185-H387 PolarHBondContact O-CE1 3.32Å; N185-H387 PolarHBondContact O-ND1 2.8Å
186	I	98.4	Very high	97.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.2	-58.5	175.6	-63.7	167.4	0	0	0	110.1	I176 E182 T183 T188 H189 M190 H237	I176-I186 HydrophobicContact CG1-CG2 4.21Å; I176-I186 HydrophobicContact CG2-CG2 4.31Å; E182-I186 HydrophobicContact CB-CD1 4.38Å; E182-I186 WeakPolarHBondContact O-CG1 3.31Å; E182-I186 PolarHBondContact O-N 3.45Å; T183-I186 PolarHBondContact O-N 2.81Å; I186-T188 PolarHBondContact O-N 3.44Å; I186-H189 PolarHBondContact O-N 2.83Å; I186-M190 WeakPolarHBondContact O-CB 3.23Å; I186-M190 PolarHBondContact O-N 3.29Å; I186-H237 HydrophobicContact CG1-CB 3.7Å
187	W	98.3	Very high	97.4	Very high	20 Å²	20	27.3 Å²	27.3	8%	0.076	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-39	-170.3	-83.2	98.3	0	0	0	113.2	L113 V117 F121 I176 F177 T183 M190 L191	L113-W187 HydrophobicContact CD2-CD2 4.19Å; L113-W187 HydrophobicContact CD2-CG 4.13Å; V117-W187 HydrophobicContact CB-CH2 4.43Å; V117-W187 HydrophobicContact CG1-CH2 4.39Å; V117-W187 HydrophobicContact CG2-CE3 4.41Å; V117-W187 HydrophobicContact CG2-CH2 3.29Å; V117-W187 HydrophobicContact CG2-CZ2 3.81Å; V117-W187 HydrophobicContact CG2-CZ3 3.62Å; F121-W187 HydrophobicContact CE2-CZ3 4.13Å; I176-W187 HydrophobicContact CG2-CZ2 3.77Å; I176-W187 PolarHBondContact O-NE1 3.21Å; F177-W187 HydrophobicContact CD1-CZ2 4.1Å; F177-W187 HydrophobicContact CE1-CH2 4.13Å; F177-W187 AromaticContact CE1-CZ2 3.95Å; F177-W187 HydrophobicContact CE1-CZ2 3.95Å; T183-W187 VanDerWaalsContact O-CD1 3.26Å; T183-W187 PolarHBondContact O-N 2.92Å; W187-M190 HydrophobicContact CD2-CE 3.58Å; W187-M190 HydrophobicContact CE3-CE 3.3Å; W187-M190 HydrophobicContact CG-CE 4.36Å; W187-M190 HydrophobicContact CH2-CE 3.55Å; W187-M190 HydrophobicContact CZ2-CE 3.86Å; W187-M190 HydrophobicContact CZ3-CE 3.29Å; W187-M190 PolarHBondContact O-N 2.95Å; W187-L191 HydrophobicContact CE3-CD1 4.15Å; W187-L191 HydrophobicContact CE3-CD2 4.3Å; W187-L191 HydrophobicContact CE3-CG 4.06Å; W187-L191 HydrophobicContact CZ3-CD2 4.36Å; W187-L191 VanDerWaalsContact O-CB 3.3Å; W187-L191 WeakPolarHBondContact O-CB 3.31Å; W187-L191 VanDerWaalsContact O-CG 3.26Å; W187-L191 WeakPolarHBondContact O-CG 3.33Å; W187-L191 PolarHBondContact O-N 2.88Å
188	T	98.1	Very high	97.5	Very high	29 Å²	29	25.5 Å²	25.5	18%	0.178	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-49	-179.7	48.1	0	0	0	0	112.3	G184 N185 I186 G192 H387 L388	G184-T188 WeakPolarHBondContact O-CB 3.44Å; G184-T188 WeakPolarHBondContact O-CG2 3.39Å; G184-T188 PolarHBondContact O-N 3.43Å; G184-T188 PolarHBondContact O-OG1 3.45Å; N185-T188 PolarHBondContact O-OG1 2.98Å; I186-T188 PolarHBondContact O-N 3.44Å; T188-G192 PolarHBondContact O-N 3.29Å; T188-H387 VanDerWaalsContact OG1-CB 3.31Å; T188-H387 WeakPolarHBondContact OG1-CB 3.41Å; T188-H387 PolarHBondContact OG1-ND1 3.38Å; T188-L388 HydrophobicContact CG2-CD2 3.57Å; T188-L388 HydrophobicContact CG2-CG 3.96Å
189	H	98.5	Very high	97.7	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.019	15%	0.148	C	C	.	.	H	α-helix	trans	-79.4	-29.5	178.2	-79.3	-175	0	0	0	113.3	I186 G192 C193 L230 S233 H387	I186-H189 PolarHBondContact O-N 2.83Å; H189-G192 PolarHBondContact O-N 3.22Å; H189-C193 WeakPolarHBondContact O-CB 3.23Å; H189-C193 PolarHBondContact O-N 3.45Å; H189-L230 HydrophobicContact CB-CD2 4.31Å; H189-S233 WeakPolarHBondContact ND1-CB 3.22Å; H189-S233 PolarHBondContact ND1-OG 3.41Å; H189-H387 AromaticContact CD2-CG 3.73Å; H189-H387 AromaticContact CD2-ND1 3.66Å; H189-H387 AromaticContact CE1-CD2 3.49Å; H189-H387 PolarHBondContact CE1-CD2 3.34Å; H189-H387 VanDerWaalsContact CE1-CD2 3.49Å; H189-H387 AromaticContact CE1-CE1 3.59Å; H189-H387 AromaticContact CE1-CG 3.42Å; H189-H387 VanDerWaalsContact CE1-CG 3.42Å; H189-H387 AromaticContact CE1-ND1 3.49Å; H189-H387 PolarHBondContact CE1-ND1 2.9Å; H189-H387 AromaticContact CE1-NE2 3.6Å; H189-H387 AromaticContact CG-CE1 3.89Å; H189-H387 AromaticContact CG-CG 3.97Å; H189-H387 AromaticContact CG-ND1 3.45Å; H189-H387 AromaticContact ND1-CE1 3.34Å; H189-H387 PolarHBondContact ND1-CE1 3.09Å; H189-H387 VanDerWaalsContact ND1-CE1 3.34Å; H189-H387 AromaticContact ND1-CG 3.77Å; H189-H387 AromaticContact ND1-ND1 3.33Å; H189-H387 PolarHBondContact ND1-ND1 3.27Å; H189-H387 AromaticContact ND1-NE2 3.79Å; H189-H387 VanDerWaalsContact NE2-CA 3.31Å; H189-H387 WeakPolarHBondContact NE2-CA 3.38Å; H189-H387 WeakPolarHBondContact NE2-CB 3.46Å; H189-H387 AromaticContact NE2-CD2 3.83Å; H189-H387 AromaticContact NE2-CG 3.41Å; H189-H387 AromaticContact NE2-ND1 3.72Å; H189-H387 PolarHBondContact NE2-O 3.12Å
190	M	98	Very high	97.7	Very high	41 Å²	41	21.7 Å²	21.7	20%	0.202	14%	0.135	C	C	.	.	H	α-helix	trans	-62.7	-49.2	173.1	-171.4	169.2	59.9	0	0	111.4	I176 I186 W187 C193 A194 S234	I176-M190 HydrophobicContact CG2-CE 3.97Å; I186-M190 WeakPolarHBondContact O-CB 3.23Å; I186-M190 PolarHBondContact O-N 3.29Å; W187-M190 HydrophobicContact CD2-CE 3.58Å; W187-M190 HydrophobicContact CE3-CE 3.3Å; W187-M190 HydrophobicContact CG-CE 4.36Å; W187-M190 HydrophobicContact CH2-CE 3.55Å; W187-M190 HydrophobicContact CZ2-CE 3.86Å; W187-M190 HydrophobicContact CZ3-CE 3.29Å; W187-M190 PolarHBondContact O-N 2.95Å; M190-C193 PolarHBondContact O-N 3.26Å; M190-A194 PolarHBondContact O-N 2.87Å; M190-S234 WeakPolarHBondContact CB-OG 3.42Å
191	L	97.8	Very high	97.8	Very high	30 Å²	30	24.6 Å²	24.6	16%	0.157	16%	0.159	C	C	.	.	H	α-helix	trans	-67	-40.1	176.5	-68.6	173.8	0	0	0	111.5	T116 F120 F121 W187 C193 A194 T195	T116-L191 HydrophobicContact CG2-CD1 3.74Å; F120-L191 HydrophobicContact CB-CD2 4.35Å; F120-L191 HydrophobicContact CD2-CD2 4.31Å; F120-L191 HydrophobicContact CG-CD2 4.24Å; F121-L191 HydrophobicContact CE2-CD2 3.86Å; F121-L191 HydrophobicContact CZ-CD2 4.48Å; W187-L191 HydrophobicContact CE3-CD1 4.15Å; W187-L191 HydrophobicContact CE3-CD2 4.3Å; W187-L191 HydrophobicContact CE3-CG 4.06Å; W187-L191 HydrophobicContact CZ3-CD2 4.36Å; W187-L191 VanDerWaalsContact O-CB 3.3Å; W187-L191 WeakPolarHBondContact O-CB 3.31Å; W187-L191 VanDerWaalsContact O-CG 3.26Å; W187-L191 WeakPolarHBondContact O-CG 3.33Å; W187-L191 PolarHBondContact O-N 2.88Å; L191-C193 PolarHBondContact O-N 3.26Å; L191-A194 PolarHBondContact O-N 3.03Å; L191-T195 WeakPolarHBondContact O-CB 3.2Å; L191-T195 PolarHBondContact O-N 3.4Å; L191-T195 PolarHBondContact O-OG1 3.44Å
192	G	97.9	Very high	97.7	Very high	3 Å²	3	31 Å²	31	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-56.1	-49.7	172.1	0	0	0	0	0	111.9	T188 H189 T195 F196	T188-G192 PolarHBondContact O-N 3.29Å; H189-G192 PolarHBondContact O-N 3.22Å; G192-T195 PolarHBondContact O-N 3.41Å; G192-F196 WeakPolarHBondContact O-CD2 3.25Å; G192-F196 PolarHBondContact O-N 3.29Å
193	C	98.4	Very high	97.5	Very high	17 Å²	17	30 Å²	30	12%	0.115	18%	0.179	C	C	.	.	H	α-helix	trans	-58.5	-51	178.1	-175.4	0	0	0	0	111.6	H189 M190 L191 T195 F196 I197 L230	H189-C193 WeakPolarHBondContact O-CB 3.23Å; H189-C193 PolarHBondContact O-N 3.45Å; M190-C193 PolarHBondContact O-N 3.26Å; L191-C193 PolarHBondContact O-N 3.26Å; C193-T195 VanDerWaalsContact C-N 3.27Å; C193-T195 PolarHBondContact O-N 2.65Å; C193-F196 PolarHBondContact O-N 2.98Å; C193-I197 WeakPolarHBondContact O-CG1 3.47Å; C193-I197 PolarHBondContact O-N 3.41Å; C193-L230 HydrophobicContact CB-CB 3.74Å
194	A	98	Very high	97.4	Very high	43 Å²	43	33.1 Å²	33.1	36%	0.355	20%	0.195	S	C	.	.	H	α-helix	trans	-58.3	-39.9	177.4	0	0	0	0	0	112.2	M190 L191 I197 G198	M190-A194 PolarHBondContact O-N 2.87Å; L191-A194 PolarHBondContact O-N 3.03Å; A194-I197 PolarHBondContact O-N 2.96Å; A194-G198 PolarHBondContact O-N 3.41Å
195	T	97.6	Very high	97.4	Very high	44 Å²	44	36.8 Å²	36.8	27%	0.27	22%	0.22	S	C	.	.	H	α-helix	trans	-67.1	-44.4	177.9	-50.2	0	0	0	0	111.3	L191 G192 C193 I197 G198 V199 F395	L191-T195 WeakPolarHBondContact O-CB 3.2Å; L191-T195 PolarHBondContact O-N 3.4Å; L191-T195 PolarHBondContact O-OG1 3.44Å; G192-T195 PolarHBondContact O-N 3.41Å; C193-T195 VanDerWaalsContact C-N 3.27Å; C193-T195 PolarHBondContact O-N 2.65Å; T195-I197 VanDerWaalsContact C-N 3.32Å; T195-I197 PolarHBondContact O-N 3.3Å; T195-G198 PolarHBondContact O-N 3.29Å; T195-G198 VanDerWaalsContact O-N 3.15Å; T195-V199 HydrophobicContact CG2-CG2 4.38Å; T195-V199 WeakPolarHBondContact O-CG2 3.26Å; T195-V199 PolarHBondContact O-N 3.46Å; T195-F395 HydrophobicContact CG2-CE1 4.19Å; T195-F395 HydrophobicContact CG2-CZ 3.54Å
196	F	97.7	Very high	97.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-33.2	176.4	-89.7	-79.3	0	0	0	112.9	G192 C193 A200 F222 F223 A226 I227 L230 A394 F395	G192-F196 WeakPolarHBondContact O-CD2 3.25Å; G192-F196 PolarHBondContact O-N 3.29Å; C193-F196 PolarHBondContact O-N 2.98Å; F196-A200 WeakPolarHBondContact O-CB 3.31Å; F196-A200 PolarHBondContact O-N 3.31Å; F196-F222 AromaticContact CE1-CE1 3.83Å; F196-F222 HydrophobicContact CE1-CE1 3.83Å; F196-F222 AromaticContact CE1-CZ 3.78Å; F196-F222 HydrophobicContact CE1-CZ 3.78Å; F196-F222 HydrophobicContact CZ-CZ 4.3Å; F196-F223 HydrophobicContact CD1-CD1 4.21Å; F196-A226 HydrophobicContact CD1-CB 4.02Å; F196-A226 HydrophobicContact CE1-CB 4.3Å; F196-A226 HydrophobicContact CG-CB 4.21Å; F196-I227 HydrophobicContact CB-CG1 4Å; F196-L230 HydrophobicContact CD2-CD1 3.62Å; F196-L230 HydrophobicContact CE2-CD1 4.16Å; F196-L230 HydrophobicContact CG-CD1 4.46Å; F196-A394 HydrophobicContact CE1-CB 4.45Å; F196-A394 HydrophobicContact CE2-CB 3.77Å; F196-A394 HydrophobicContact CZ-CB 3.46Å; F196-A394 VanDerWaalsContact CZ-CB 3.46Å; F196-F395 HydrophobicContact CD2-CZ 4.29Å; F196-F395 HydrophobicContact CE2-CD2 4.22Å; F196-F395 HydrophobicContact CE2-CE1 4.28Å; F196-F395 AromaticContact CE2-CE2 3.9Å; F196-F395 HydrophobicContact CE2-CE2 3.9Å; F196-F395 AromaticContact CE2-CZ 3.9Å; F196-F395 HydrophobicContact CE2-CZ 3.9Å; F196-F395 HydrophobicContact CZ-CD1 4.23Å; F196-F395 HydrophobicContact CZ-CD2 4.45Å; F196-F395 HydrophobicContact CZ-CE1 4.22Å; F196-F395 HydrophobicContact CZ-CE2 4.45Å; F196-F395 HydrophobicContact CZ-CG 4.33Å; F196-F395 HydrophobicContact CZ-CZ 4.3Å
197	I	98.3	Very high	96.9	Very high	89 Å²	89	43 Å²	43	46%	0.456	25%	0.251	S	S	.	.	H	α-helix	trans	-60.5	-48.3	169.6	-68.7	167.3	0	0	0	110.2	C193 A194 T195 A200 A201 I227	C193-I197 WeakPolarHBondContact O-CG1 3.47Å; C193-I197 PolarHBondContact O-N 3.41Å; A194-I197 PolarHBondContact O-N 2.96Å; T195-I197 VanDerWaalsContact C-N 3.32Å; T195-I197 PolarHBondContact O-N 3.3Å; I197-A200 PolarHBondContact O-N 3Å; I197-A201 WeakPolarHBondContact O-CB 3.28Å; I197-A201 PolarHBondContact O-N 3.1Å; I197-I227 HydrophobicContact CD1-CG2 4.27Å; I197-I227 HydrophobicContact CG1-CD1 3.85Å; I197-I227 HydrophobicContact CG1-CG1 3.93Å; I197-I227 HydrophobicContact CG1-CG2 3.94Å
198	G	97.7	Very high	96.5	Very high	41 Å²	41	48.4 Å²	48.4	42%	0.423	28%	0.277	S	S	.	.	H	α-helix	trans	-62.1	-45.1	178.1	0	0	0	0	0	113.3	A194 T195 A201 Y202	A194-G198 PolarHBondContact O-N 3.41Å; T195-G198 PolarHBondContact O-N 3.29Å; T195-G198 VanDerWaalsContact O-N 3.15Å; G198-A201 PolarHBondContact O-N 2.94Å; G198-Y202 WeakPolarHBondContact O-CB 3.21Å; G198-Y202 PolarHBondContact O-N 3.45Å
199	V	96.3	Very high	96	Very high	29 Å²	29	53.3 Å²	53.3	18%	0.176	31%	0.307	C	S	.	.	H	α-helix	trans	-62.8	-44.3	176.4	173.6	0	0	0	0	110.9	T195 Y202 F203 F223 F395 Y398	T195-V199 HydrophobicContact CG2-CG2 4.38Å; T195-V199 WeakPolarHBondContact O-CG2 3.26Å; T195-V199 PolarHBondContact O-N 3.46Å; V199-Y202 PolarHBondContact O-N 3.45Å; V199-F203 WeakPolarHBondContact O-CB 3.37Å; V199-F203 PolarHBondContact O-N 2.88Å; V199-F223 HydrophobicContact CG1-CE1 3.77Å; V199-F223 HydrophobicContact CG1-CZ 4.06Å; V199-F395 HydrophobicContact CG2-CE1 4.41Å; V199-Y398 HydrophobicContact CG1-CD1 4.45Å; V199-Y398 HydrophobicContact CG1-CE1 3.86Å; V199-Y398 HydrophobicContact CG1-CE2 4.23Å
200	A	97.1	Very high	95.3	Very high	8 Å²	8	57.8 Å²	57.8	7%	0.066	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-46	176.9	0	0	0	0	0	111.5	F196 I197 Y202 F203 L204 F223 I227	F196-A200 WeakPolarHBondContact O-CB 3.31Å; F196-A200 PolarHBondContact O-N 3.31Å; I197-A200 PolarHBondContact O-N 3Å; A200-Y202 VanDerWaalsContact C-N 3.35Å; A200-Y202 PolarHBondContact O-N 3.4Å; A200-F203 PolarHBondContact O-N 3.02Å; A200-L204 WeakPolarHBondContact O-CB 3.19Å; A200-L204 WeakPolarHBondContact O-CG 3.46Å; A200-L204 PolarHBondContact O-N 2.82Å; A200-F223 HydrophobicContact CB-CB 3.8Å; A200-F223 HydrophobicContact CB-CD1 3.95Å; A200-F223 HydrophobicContact CB-CD2 3.85Å; A200-F223 HydrophobicContact CB-CE1 4.47Å; A200-F223 HydrophobicContact CB-CE2 4.37Å; A200-F223 HydrophobicContact CB-CG 3.61Å; A200-I227 HydrophobicContact CB-CD1 4.31Å
201	A	97.8	Very high	94.8	Very high	61 Å²	61	56.8 Å²	56.8	50%	0.504	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-44.9	176.9	0	0	0	0	0	111.6	I197 G198 S205	I197-A201 WeakPolarHBondContact O-CB 3.28Å; I197-A201 PolarHBondContact O-N 3.1Å; G198-A201 PolarHBondContact O-N 2.94Å; A201-S205 VanDerWaalsContact O-CB 3.25Å; A201-S205 WeakPolarHBondContact O-CB 3.08Å; A201-S205 PolarHBondContact O-N 3.35Å; A201-S205 PolarHBondContact O-OG 3.32Å
202	Y	96	Very high	94.4	Very high	140 Å²	140	60.2 Å²	60.2	55%	0.549	34%	0.339	S	S	.	.	H	α-helix	trans	-59.8	-51.9	175.3	176.2	-99.1	0	0	0	111.7	G198 V199 A200 L204 S205 R206	G198-Y202 WeakPolarHBondContact O-CB 3.21Å; G198-Y202 PolarHBondContact O-N 3.45Å; V199-Y202 PolarHBondContact O-N 3.45Å; A200-Y202 VanDerWaalsContact C-N 3.35Å; A200-Y202 PolarHBondContact O-N 3.4Å; Y202-L204 PolarHBondContact O-N 3.17Å; Y202-S205 PolarHBondContact O-N 2.9Å; Y202-S205 PolarHBondContact O-OG 3.45Å; Y202-R206 PolarHBondContact O-N 3.46Å; Y202-R206 PolarHBondContact OH-NH1 3.43Å
203	F	94.1	Very high	94.2	Very high	20 Å²	20	67.9 Å²	67.9	9%	0.088	37%	0.368	C	S	.	.	H	α-helix	trans	-60.3	-45.9	-179.2	-174.1	-85.6	0	0	0	112.3	V199 A200 S205 R206 V211 K216 F219 F223	V199-F203 WeakPolarHBondContact O-CB 3.37Å; V199-F203 PolarHBondContact O-N 2.88Å; A200-F203 PolarHBondContact O-N 3.02Å; F203-S205 VanDerWaalsContact C-N 3.3Å; F203-S205 PolarHBondContact O-N 2.89Å; F203-R206 WeakPolarHBondContact O-CB 3.27Å; F203-R206 WeakPolarHBondContact O-CG 3.17Å; F203-R206 PolarHBondContact O-N 2.78Å; F203-V211 HydrophobicContact CE1-CG1 3.84Å; F203-V211 HydrophobicContact CZ-CG1 3.76Å; F203-K216 HydrophobicContact CE1-CG 4.43Å; F203-F219 HydrophobicContact CD1-CB 4.2Å; F203-F219 HydrophobicContact CE1-CB 3.57Å; F203-F219 HydrophobicContact CE1-CD1 4.19Å; F203-F219 HydrophobicContact CE1-CD2 4.11Å; F203-F219 AromaticContact CE1-CG 3.72Å; F203-F219 HydrophobicContact CE1-CG 3.72Å; F203-F219 AromaticContact CE2-CD1 3.94Å; F203-F219 HydrophobicContact CE2-CD1 3.94Å; F203-F219 HydrophobicContact CE2-CD2 4.47Å; F203-F219 HydrophobicContact CE2-CE1 4.02Å; F203-F219 HydrophobicContact CE2-CG 4.17Å; F203-F219 HydrophobicContact CE2-CZ 4.33Å; F203-F219 HydrophobicContact CZ-CB 3.92Å; F203-F219 AromaticContact CZ-CD1 3.74Å; F203-F219 HydrophobicContact CZ-CD1 3.74Å; F203-F219 AromaticContact CZ-CD2 3.63Å; F203-F219 HydrophobicContact CZ-CD2 3.63Å; F203-F219 HydrophobicContact CZ-CE1 4.1Å; F203-F219 AromaticContact CZ-CE2 3.99Å; F203-F219 HydrophobicContact CZ-CE2 3.99Å; F203-F219 AromaticContact CZ-CG 3.49Å; F203-F219 HydrophobicContact CZ-CG 3.49Å; F203-F219 VanDerWaalsContact CZ-CG 3.49Å; F203-F219 HydrophobicContact CZ-CZ 4.22Å; F203-F223 HydrophobicContact CB-CE2 3.86Å; F203-F223 HydrophobicContact CB-CZ 3.97Å; F203-F223 AromaticContact CD1-CE2 3.77Å; F203-F223 HydrophobicContact CD1-CE2 3.77Å; F203-F223 HydrophobicContact CD1-CZ 4.47Å; F203-F223 HydrophobicContact CD2-CZ 4.46Å; F203-F223 HydrophobicContact CE1-CE2 4.47Å; F203-F223 AromaticContact CG-CE2 3.8Å; F203-F223 HydrophobicContact CG-CE2 3.8Å; F203-F223 HydrophobicContact CG-CZ 4.06Å
204	L	95	Very high	93.9	Very high	68 Å²	68	71.9 Å²	71.9	36%	0.356	39%	0.385	S	S	.	.	H	α-helix	trans	-71.2	-25.9	-178.3	-64.7	174.4	0	0	0	112.8	A200 Y202 R206 K216 S220	A200-L204 WeakPolarHBondContact O-CB 3.19Å; A200-L204 WeakPolarHBondContact O-CG 3.46Å; A200-L204 PolarHBondContact O-N 2.82Å; Y202-L204 PolarHBondContact O-N 3.17Å; L204-R206 VanDerWaalsContact C-N 3.32Å; L204-K216 HydrophobicContact CD2-CB 3.87Å; L204-K216 HydrophobicContact CD2-CD 4.5Å; L204-K216 HydrophobicContact CD2-CG 4.22Å; L204-K216 PolarHBondContact O-NZ 3.3Å; L204-S220 WeakPolarHBondContact CD2-OG 3.33Å
205	S	96.2	Very high	93.6	Very high	84 Å²	84	69.9 Å²	69.9	59%	0.587	37%	0.369	S	S	*	.	H	α-helix	trans	-75.9	-13.2	175.7	75	0	0	0	0	114.5	A201 Y202 F203	A201-S205 VanDerWaalsContact O-CB 3.25Å; A201-S205 WeakPolarHBondContact O-CB 3.08Å; A201-S205 PolarHBondContact O-N 3.35Å; A201-S205 PolarHBondContact O-OG 3.32Å; Y202-S205 PolarHBondContact O-N 2.9Å; Y202-S205 PolarHBondContact O-OG 3.45Å; F203-S205 VanDerWaalsContact C-N 3.3Å; F203-S205 PolarHBondContact O-N 2.89Å
206	R	93.7	Very high	93.4	Very high	72 Å²	72	69.7 Å²	69.7	27%	0.272	36%	0.364	S	S	.	.	S	Bend	trans	-59.1	139.2	177.6	-60.2	-51.2	-62.6	-179	-1.3	110.5	Y202 F203 L204 E210 V211 K216	Y202-R206 PolarHBondContact O-N 3.46Å; Y202-R206 PolarHBondContact OH-NH1 3.43Å; F203-R206 WeakPolarHBondContact O-CB 3.27Å; F203-R206 WeakPolarHBondContact O-CG 3.17Å; F203-R206 PolarHBondContact O-N 2.78Å; L204-R206 VanDerWaalsContact C-N 3.32Å; R206-E210 IonicContact CZ-OE1 2.7Å; R206-E210 IonicContact CZ-OE2 2.86Å; R206-E210 IonicContact NE-OE2 3.6Å; R206-E210 PolarHBondContact NE-OE2 3.06Å; R206-E210 IonicContact NH2-OE1 3.06Å; R206-E210 PolarHBondContact NH2-OE1 3.31Å; R206-E210 IonicContact NH2-OE2 3.27Å; R206-E210 PolarHBondContact NH2-OE2 3.44Å; R206-V211 HydrophobicContact CB-CB 4.25Å; R206-V211 HydrophobicContact CB-CG2 3.78Å; R206-V211 HydrophobicContact CG-CG2 4.15Å; R206-K216 VanDerWaalsContact O-CE 3.29Å; R206-K216 WeakPolarHBondContact O-CE 3.5Å; R206-K216 PolarHBondContact O-NZ 2.91Å
207	P	93.3	Very high	93.4	Very high	60 Å²	60	72.8 Å²	72.8	39%	0.39	38%	0.383	S	S	.	.			trans	-64.4	154.9	179.5	27.8	-35	0	0	0	111.4	T209 E210 V211	P207-T209 PolarHBondContact O-N 2.91Å; P207-T209 VanDerWaalsContact O-N 3.15Å; P207-E210 HydrophobicContact CG-CB 4.38Å; P207-E210 HydrophobicContact CG-CG 3.92Å; P207-E210 PolarHBondContact O-N 3.43Å; P207-V211 PolarHBondContact O-N 3.42Å
208	E	89.8	Confident	93.3	Very high	134 Å²	134	69.2 Å²	69.2	63%	0.626	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.8	-178.8	-168.4	167.8	-166.4	0	0	113.2	E210 V211	E208-E210 PolarHBondContact O-N 2.89Å; E208-V211 WeakPolarHBondContact CA-O 3.45Å
209	T	87	Confident	93.2	Very high	131 Å²	131	67.3 Å²	67.3	80%	0.804	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.8	170.9	53.8	0	0	0	0	113.5	P207	P207-T209 PolarHBondContact O-N 2.91Å; P207-T209 VanDerWaalsContact O-N 3.15Å
210	E	84.7	Confident	93.3	Very high	98 Å²	98	67.2 Å²	67.2	46%	0.458	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-43.2	180	-64.4	177.1	-172.3	0	0	112.6	R206 P207 E208	R206-E210 IonicContact CZ-OE1 2.7Å; R206-E210 IonicContact CZ-OE2 2.86Å; R206-E210 IonicContact NE-OE2 3.6Å; R206-E210 PolarHBondContact NE-OE2 3.06Å; R206-E210 IonicContact NH2-OE1 3.06Å; R206-E210 PolarHBondContact NH2-OE1 3.31Å; R206-E210 IonicContact NH2-OE2 3.27Å; R206-E210 PolarHBondContact NH2-OE2 3.44Å; P207-E210 HydrophobicContact CG-CB 4.38Å; P207-E210 HydrophobicContact CG-CG 3.92Å; P207-E210 PolarHBondContact O-N 3.43Å; E208-E210 PolarHBondContact O-N 2.89Å
211	V	86.8	Confident	93.3	Very high	21 Å²	21	69.5 Å²	69.5	13%	0.127	36%	0.359	C	S	.	.	S	Bend	trans	-128.8	105.4	178.3	-172.5	0	0	0	0	108.5	F203 R206 P207 E208 E215 K216	F203-V211 HydrophobicContact CE1-CG1 3.84Å; F203-V211 HydrophobicContact CZ-CG1 3.76Å; R206-V211 HydrophobicContact CB-CB 4.25Å; R206-V211 HydrophobicContact CB-CG2 3.78Å; R206-V211 HydrophobicContact CG-CG2 4.15Å; P207-V211 PolarHBondContact O-N 3.42Å; E208-V211 WeakPolarHBondContact CA-O 3.45Å; V211-E215 HydrophobicContact CG1-CB 3.85Å; V211-K216 HydrophobicContact CB-CG 4.47Å; V211-K216 HydrophobicContact CG1-CG 3.75Å; V211-K216 VanDerWaalsContact O-CE 3.27Å; V211-K216 WeakPolarHBondContact O-CE 3.35Å
212	Q	89.6	Confident	93.4	Very high	102 Å²	102	66.6 Å²	66.6	48%	0.477	34%	0.335	S	S	.	.			trans	-60.4	155.6	178.1	-79.2	176.8	4.9	0	0	111.9	Q214 E215 K216	Q212-Q214 VanDerWaalsContact C-N 3.27Å; Q212-Q214 PolarHBondContact O-N 2.68Å; Q212-E215 WeakPolarHBondContact CB-OE2 3.32Å; Q212-E215 WeakPolarHBondContact O-CB 3.43Å; Q212-E215 PolarHBondContact O-N 2.77Å; Q212-K216 PolarHBondContact O-N 3.38Å
213	Y	92.8	Very high	93.5	Very high	163 Å²	163	60 Å²	60	64%	0.639	31%	0.309	S	S	*	.	H	α-helix	trans	-58.6	-36.9	-174.9	177	-100.4	0	0	0	113.2	E215 K216 V217	Y213-E215 VanDerWaalsContact C-N 3.34Å; Y213-E215 PolarHBondContact O-N 3.44Å; Y213-K216 WeakPolarHBondContact O-CB 3.45Å; Y213-K216 PolarHBondContact O-N 3.02Å; Y213-V217 HydrophobicContact CD1-CG2 4.14Å; Y213-V217 HydrophobicContact CE1-CG2 3.63Å; Y213-V217 HydrophobicContact CE2-CG2 4.19Å; Y213-V217 WeakPolarHBondContact O-CG2 3.3Å; Y213-V217 PolarHBondContact O-N 3.08Å
214	Q	92.2	Very high	93.7	Very high	101 Å²	101	63.8 Å²	63.8	47%	0.472	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-40.6	-177.6	-179.5	170.8	0.1	0	0	111.9	Q212 V217 V218 F271	Q212-Q214 VanDerWaalsContact C-N 3.27Å; Q212-Q214 PolarHBondContact O-N 2.68Å; Q214-V217 PolarHBondContact O-N 3.31Å; Q214-V218 VanDerWaalsContact O-CG2 3.3Å; Q214-V218 WeakPolarHBondContact O-CG2 3.38Å; Q214-V218 PolarHBondContact O-N 3.42Å; Q214-F271 HydrophobicContact CG-CE2 4.44Å; Q214-F271 HydrophobicContact CG-CZ 4.02Å; Q214-F271 VanDerWaalsContact NE2-CE2 3.27Å
215	E	91.1	Very high	93.9	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.009	32%	0.317	C	S	.	.	H	α-helix	trans	-64.7	-44.5	178.2	-67	49.8	-136.2	0	0	108.5	V211 Q212 Y213 V217 V218 F219 Y272 L409	V211-E215 HydrophobicContact CG1-CB 3.85Å; Q212-E215 WeakPolarHBondContact CB-OE2 3.32Å; Q212-E215 WeakPolarHBondContact O-CB 3.43Å; Q212-E215 PolarHBondContact O-N 2.77Å; Y213-E215 VanDerWaalsContact C-N 3.34Å; Y213-E215 PolarHBondContact O-N 3.44Å; E215-V217 VanDerWaalsContact C-N 3.34Å; E215-V217 PolarHBondContact O-N 3.38Å; E215-V218 PolarHBondContact O-N 2.89Å; E215-F219 WeakPolarHBondContact O-CB 3.36Å; E215-F219 WeakPolarHBondContact O-CD2 3.43Å; E215-F219 PolarHBondContact O-N 2.87Å; E215-Y272 WeakPolarHBondContact CG-OH 3.28Å; E215-L409 HydrophobicContact CG-CD1 4.23Å; E215-L409 HydrophobicContact CG-CD2 4.39Å
216	K	94.7	Very high	94	Very high	39 Å²	39	57.2 Å²	57.2	17%	0.17	29%	0.289	C	S	.	.	H	α-helix	trans	-57.6	-45.2	173.9	-66.5	-175.4	-179.2	-172	0	112.3	F203 L204 R206 V211 Q212 Y213 S220	F203-K216 HydrophobicContact CE1-CG 4.43Å; L204-K216 HydrophobicContact CD2-CB 3.87Å; L204-K216 HydrophobicContact CD2-CD 4.5Å; L204-K216 HydrophobicContact CD2-CG 4.22Å; L204-K216 PolarHBondContact O-NZ 3.3Å; R206-K216 VanDerWaalsContact O-CE 3.29Å; R206-K216 WeakPolarHBondContact O-CE 3.5Å; R206-K216 PolarHBondContact O-NZ 2.91Å; V211-K216 HydrophobicContact CB-CG 4.47Å; V211-K216 HydrophobicContact CG1-CG 3.75Å; V211-K216 VanDerWaalsContact O-CE 3.27Å; V211-K216 WeakPolarHBondContact O-CE 3.35Å; Q212-K216 PolarHBondContact O-N 3.38Å; Y213-K216 WeakPolarHBondContact O-CB 3.45Å; Y213-K216 PolarHBondContact O-N 3.02Å; K216-S220 VanDerWaalsContact O-CB 3.27Å; K216-S220 WeakPolarHBondContact O-CB 3.46Å; K216-S220 PolarHBondContact O-N 3.22Å; K216-S220 PolarHBondContact O-OG 3.49Å
217	V	96.5	Very high	94.2	Very high	65 Å²	65	55.7 Å²	55.7	39%	0.394	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-46.3	178.3	172.1	0	0	0	0	110.6	Y213 Q214 E215 S220 V221	Y213-V217 HydrophobicContact CD1-CG2 4.14Å; Y213-V217 HydrophobicContact CE1-CG2 3.63Å; Y213-V217 HydrophobicContact CE2-CG2 4.19Å; Y213-V217 WeakPolarHBondContact O-CG2 3.3Å; Y213-V217 PolarHBondContact O-N 3.08Å; Q214-V217 PolarHBondContact O-N 3.31Å; E215-V217 VanDerWaalsContact C-N 3.34Å; E215-V217 PolarHBondContact O-N 3.38Å; V217-S220 WeakPolarHBondContact O-CB 3.13Å; V217-S220 PolarHBondContact O-N 2.91Å; V217-V221 PolarHBondContact O-N 3.48Å
218	V	96.2	Very high	94.5	Very high	14 Å²	14	55.8 Å²	55.8	9%	0.085	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-46.2	-178.7	169.1	0	0	0	0	111.8	Q214 E215 V221 P268 F271 Y272	Q214-V218 VanDerWaalsContact O-CG2 3.3Å; Q214-V218 WeakPolarHBondContact O-CG2 3.38Å; Q214-V218 PolarHBondContact O-N 3.42Å; E215-V218 PolarHBondContact O-N 2.89Å; V218-V221 PolarHBondContact O-N 3.1Å; V218-P268 VanDerWaalsContact CG1-CA 3.41Å; V218-P268 HydrophobicContact CG1-CB 3.71Å; V218-F271 HydrophobicContact CG1-CB 3.93Å; V218-F271 HydrophobicContact CG1-CD1 3.99Å; V218-F271 HydrophobicContact CG1-CG 3.97Å; V218-F271 HydrophobicContact CG2-CD1 4.11Å; V218-F271 HydrophobicContact CG2-CD2 3.89Å; V218-F271 HydrophobicContact CG2-CE1 4.29Å; V218-F271 HydrophobicContact CG2-CE2 4.12Å; V218-F271 HydrophobicContact CG2-CG 3.91Å; V218-F271 HydrophobicContact CG2-CZ 4.32Å; V218-Y272 HydrophobicContact CG1-CE2 4.32Å
219	F	97.1	Very high	94.9	Very high	1 Å²	1	49.6 Å²	49.6	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-67.7	-33.1	175.7	-87.9	-102.8	0	0	0	112.8	F203 E215 V221 F222 F223 Y272 Y398 I401 A405	F203-F219 HydrophobicContact CD1-CB 4.2Å; F203-F219 HydrophobicContact CE1-CB 3.57Å; F203-F219 HydrophobicContact CE1-CD1 4.19Å; F203-F219 HydrophobicContact CE1-CD2 4.11Å; F203-F219 AromaticContact CE1-CG 3.72Å; F203-F219 HydrophobicContact CE1-CG 3.72Å; F203-F219 AromaticContact CE2-CD1 3.94Å; F203-F219 HydrophobicContact CE2-CD1 3.94Å; F203-F219 HydrophobicContact CE2-CD2 4.47Å; F203-F219 HydrophobicContact CE2-CE1 4.02Å; F203-F219 HydrophobicContact CE2-CG 4.17Å; F203-F219 HydrophobicContact CE2-CZ 4.33Å; F203-F219 HydrophobicContact CZ-CB 3.92Å; F203-F219 AromaticContact CZ-CD1 3.74Å; F203-F219 HydrophobicContact CZ-CD1 3.74Å; F203-F219 AromaticContact CZ-CD2 3.63Å; F203-F219 HydrophobicContact CZ-CD2 3.63Å; F203-F219 HydrophobicContact CZ-CE1 4.1Å; F203-F219 AromaticContact CZ-CE2 3.99Å; F203-F219 HydrophobicContact CZ-CE2 3.99Å; F203-F219 AromaticContact CZ-CG 3.49Å; F203-F219 HydrophobicContact CZ-CG 3.49Å; F203-F219 VanDerWaalsContact CZ-CG 3.49Å; F203-F219 HydrophobicContact CZ-CZ 4.22Å; E215-F219 WeakPolarHBondContact O-CB 3.36Å; E215-F219 WeakPolarHBondContact O-CD2 3.43Å; E215-F219 PolarHBondContact O-N 2.87Å; F219-V221 PolarHBondContact O-N 3.25Å; F219-F222 PolarHBondContact O-N 3.43Å; F219-F222 VanDerWaalsContact O-N 3.1Å; F219-F223 HydrophobicContact CB-CD2 4.22Å; F219-F223 HydrophobicContact CB-CE2 3.9Å; F219-F223 HydrophobicContact CD1-CE2 4.22Å; F219-F223 HydrophobicContact CD1-CZ 4.27Å; F219-F223 VanDerWaalsContact O-CD2 3.28Å; F219-F223 WeakPolarHBondContact O-CD2 3.45Å; F219-F223 PolarHBondContact O-N 3.37Å; F219-Y272 HydrophobicContact CD2-CE2 4.29Å; F219-Y272 AromaticContact CE2-CE2 3.59Å; F219-Y272 HydrophobicContact CE2-CE2 3.59Å; F219-Y272 AromaticContact CE2-CZ 3.9Å; F219-Y272 WeakPolarHBondContact CE2-OH 3.4Å; F219-Y272 HydrophobicContact CZ-CE2 4.37Å; F219-Y398 HydrophobicContact CD1-CD2 4.4Å; F219-Y398 HydrophobicContact CD1-CE2 4.1Å; F219-Y398 HydrophobicContact CE1-CD2 4.18Å; F219-Y398 AromaticContact CE1-CE2 3.93Å; F219-Y398 HydrophobicContact CE1-CE2 3.93Å; F219-I401 HydrophobicContact CD1-CD1 3.84Å; F219-I401 HydrophobicContact CD1-CG1 4.45Å; F219-I401 HydrophobicContact CE1-CD1 3.52Å; F219-I401 HydrophobicContact CE1-CG1 3.64Å; F219-I401 HydrophobicContact CZ-CB 4.39Å; F219-I401 HydrophobicContact CZ-CD1 4.09Å; F219-I401 HydrophobicContact CZ-CG1 3.93Å; F219-A405 HydrophobicContact CE2-CB 4.03Å; F219-A405 HydrophobicContact CZ-CB 4.15Å
220	S	97.7	Very high	95.4	Very high	27 Å²	27	43.4 Å²	43.4	19%	0.189	22%	0.216	C	C	.	.	H	α-helix	trans	-58.8	-34.4	177.8	-65.8	0	0	0	0	112.3	L204 K216 V217 F222 F223 I224	L204-S220 WeakPolarHBondContact CD2-OG 3.33Å; K216-S220 VanDerWaalsContact O-CB 3.27Å; K216-S220 WeakPolarHBondContact O-CB 3.46Å; K216-S220 PolarHBondContact O-N 3.22Å; K216-S220 PolarHBondContact O-OG 3.49Å; V217-S220 WeakPolarHBondContact O-CB 3.13Å; V217-S220 PolarHBondContact O-N 2.91Å; S220-F222 VanDerWaalsContact C-N 3.34Å; S220-F222 PolarHBondContact O-N 3.42Å; S220-F223 PolarHBondContact O-N 3.14Å; S220-I224 WeakPolarHBondContact O-CB 3.29Å; S220-I224 VanDerWaalsContact O-CG1 3.23Å; S220-I224 WeakPolarHBondContact O-CG1 3.17Å; S220-I224 PolarHBondContact O-N 2.93Å
221	V	98	Very high	96.1	Very high	56 Å²	56	39.9 Å²	39.9	34%	0.339	21%	0.206	S	C	.	.	H	α-helix	trans	-61.9	-43.7	176.9	-179.9	0	0	0	0	111	V217 V218 F219 S225 V267	V217-V221 PolarHBondContact O-N 3.48Å; V218-V221 PolarHBondContact O-N 3.1Å; F219-V221 PolarHBondContact O-N 3.25Å; V221-S225 VanDerWaalsContact O-CB 3.29Å; V221-S225 WeakPolarHBondContact O-CB 3.49Å; V221-S225 PolarHBondContact O-N 2.92Å; V221-S225 PolarHBondContact O-OG 3.28Å; V221-V267 HydrophobicContact CB-CB 4.38Å; V221-V267 HydrophobicContact CB-CG1 4.25Å; V221-V267 HydrophobicContact CG1-CB 4.04Å; V221-V267 HydrophobicContact CG1-CG1 4.28Å; V221-V267 HydrophobicContact CG1-CG2 3.87Å; V221-V267 HydrophobicContact CG2-CG1 4.35Å
222	F	98.3	Very high	96.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66	-48	174.7	166.2	-111.3	0	0	0	111.6	F196 F219 S220 I224 S225 A226 L261 P268 H397 Y398 I401	F196-F222 AromaticContact CE1-CE1 3.83Å; F196-F222 HydrophobicContact CE1-CE1 3.83Å; F196-F222 AromaticContact CE1-CZ 3.78Å; F196-F222 HydrophobicContact CE1-CZ 3.78Å; F196-F222 HydrophobicContact CZ-CZ 4.3Å; F219-F222 PolarHBondContact O-N 3.43Å; F219-F222 VanDerWaalsContact O-N 3.1Å; S220-F222 VanDerWaalsContact C-N 3.34Å; S220-F222 PolarHBondContact O-N 3.42Å; F222-I224 PolarHBondContact O-N 3.25Å; F222-S225 PolarHBondContact O-N 3.3Å; F222-A226 HydrophobicContact CE2-CB 4.41Å; F222-A226 WeakPolarHBondContact O-CB 3.49Å; F222-A226 PolarHBondContact O-N 3.49Å; F222-L261 HydrophobicContact CD2-CD1 4.46Å; F222-L261 HydrophobicContact CE2-CD1 4.01Å; F222-P268 HydrophobicContact CB-CG 3.95Å; F222-H397 AromaticContact CD2-CD2 3.79Å; F222-H397 AromaticContact CE2-CD2 3.52Å; F222-H397 AromaticContact CZ-CD2 3.86Å; F222-Y398 HydrophobicContact CE1-CD2 4.13Å; F222-Y398 HydrophobicContact CE1-CG 4.41Å; F222-I401 HydrophobicContact CD1-CD1 3.96Å; F222-I401 HydrophobicContact CE1-CD1 4.45Å; F222-I401 HydrophobicContact CG-CD1 4.33Å
223	F	98.4	Very high	97.1	Very high	3 Å²	3	36.6 Å²	36.6	1%	0.013	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-49	-179.3	-70.7	-48.2	0	0	0	112.8	F196 V199 A200 F203 F219 S220 S225 A226 I227 Y398	F196-F223 HydrophobicContact CD1-CD1 4.21Å; V199-F223 HydrophobicContact CG1-CE1 3.77Å; V199-F223 HydrophobicContact CG1-CZ 4.06Å; A200-F223 HydrophobicContact CB-CB 3.8Å; A200-F223 HydrophobicContact CB-CD1 3.95Å; A200-F223 HydrophobicContact CB-CD2 3.85Å; A200-F223 HydrophobicContact CB-CE1 4.47Å; A200-F223 HydrophobicContact CB-CE2 4.37Å; A200-F223 HydrophobicContact CB-CG 3.61Å; F203-F223 HydrophobicContact CB-CE2 3.86Å; F203-F223 HydrophobicContact CB-CZ 3.97Å; F203-F223 AromaticContact CD1-CE2 3.77Å; F203-F223 HydrophobicContact CD1-CE2 3.77Å; F203-F223 HydrophobicContact CD1-CZ 4.47Å; F203-F223 HydrophobicContact CD2-CZ 4.46Å; F203-F223 HydrophobicContact CE1-CE2 4.47Å; F203-F223 AromaticContact CG-CE2 3.8Å; F203-F223 HydrophobicContact CG-CE2 3.8Å; F203-F223 HydrophobicContact CG-CZ 4.06Å; F219-F223 HydrophobicContact CB-CD2 4.22Å; F219-F223 HydrophobicContact CB-CE2 3.9Å; F219-F223 HydrophobicContact CD1-CE2 4.22Å; F219-F223 HydrophobicContact CD1-CZ 4.27Å; F219-F223 VanDerWaalsContact O-CD2 3.28Å; F219-F223 WeakPolarHBondContact O-CD2 3.45Å; F219-F223 PolarHBondContact O-N 3.37Å; S220-F223 PolarHBondContact O-N 3.14Å; F223-S225 VanDerWaalsContact C-N 3.26Å; F223-S225 PolarHBondContact O-N 3.41Å; F223-A226 PolarHBondContact O-N 3.03Å; F223-I227 WeakPolarHBondContact O-CB 3.38Å; F223-I227 WeakPolarHBondContact O-CD1 3.27Å; F223-I227 WeakPolarHBondContact O-CG1 3.28Å; F223-I227 PolarHBondContact O-N 3.47Å; F223-Y398 AromaticContact CE1-CD2 3.9Å; F223-Y398 HydrophobicContact CE1-CD2 3.9Å; F223-Y398 AromaticContact CE1-CE2 3.8Å; F223-Y398 HydrophobicContact CE1-CE2 3.8Å; F223-Y398 HydrophobicContact CZ-CD2 4.01Å; F223-Y398 AromaticContact CZ-CE2 3.49Å; F223-Y398 HydrophobicContact CZ-CE2 3.49Å; F223-Y398 VanDerWaalsContact CZ-CE2 3.49Å
224	I	98.5	Very high	97.4	Very high	98 Å²	98	29.5 Å²	29.5	50%	0.503	16%	0.163	S	C	.	.	H	α-helix	trans	-58.7	-43.8	177.7	-69.2	166.4	0	0	0	109.8	S220 F222 I227 L228	S220-I224 WeakPolarHBondContact O-CB 3.29Å; S220-I224 VanDerWaalsContact O-CG1 3.23Å; S220-I224 WeakPolarHBondContact O-CG1 3.17Å; S220-I224 PolarHBondContact O-N 2.93Å; F222-I224 PolarHBondContact O-N 3.25Å; I224-I227 PolarHBondContact O-N 3.48Å; I224-L228 HydrophobicContact CG2-CD1 3.77Å; I224-L228 HydrophobicContact CG2-CG 4.24Å; I224-L228 WeakPolarHBondContact O-CB 3.18Å; I224-L228 VanDerWaalsContact O-CG 3.22Å; I224-L228 WeakPolarHBondContact O-CG 3.29Å; I224-L228 PolarHBondContact O-N 3.39Å
225	S	98.7	Very high	97.6	Very high	13 Å²	13	26.2 Å²	26.2	9%	0.091	15%	0.153	C	C	.	.	H	α-helix	trans	-65.4	-41.5	-179.8	-58.2	0	0	0	0	112.7	V221 F222 F223 C229 L260	V221-S225 VanDerWaalsContact O-CB 3.29Å; V221-S225 WeakPolarHBondContact O-CB 3.49Å; V221-S225 PolarHBondContact O-N 2.92Å; V221-S225 PolarHBondContact O-OG 3.28Å; F222-S225 PolarHBondContact O-N 3.3Å; F223-S225 VanDerWaalsContact C-N 3.26Å; F223-S225 PolarHBondContact O-N 3.41Å; S225-C229 VanDerWaalsContact O-CB 3.28Å; S225-C229 WeakPolarHBondContact O-CB 3.32Å; S225-C229 PolarHBondContact O-N 3.43Å; S225-L260 VanDerWaalsContact CB-O 3.28Å; S225-L260 WeakPolarHBondContact CB-O 3.44Å; S225-L260 PolarHBondContact OG-O 3.49Å
226	A	98.5	Very high	98	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.008	16%	0.158	C	C	.	.	H	α-helix	trans	-65.1	-45.6	175.1	0	0	0	0	0	112.1	F196 F222 F223 C229 L230 L261	F196-A226 HydrophobicContact CD1-CB 4.02Å; F196-A226 HydrophobicContact CE1-CB 4.3Å; F196-A226 HydrophobicContact CG-CB 4.21Å; F222-A226 HydrophobicContact CE2-CB 4.41Å; F222-A226 WeakPolarHBondContact O-CB 3.49Å; F222-A226 PolarHBondContact O-N 3.49Å; F223-A226 PolarHBondContact O-N 3.03Å; A226-C229 PolarHBondContact O-N 3.29Å; A226-L230 WeakPolarHBondContact O-CB 3.43Å; A226-L230 VanDerWaalsContact O-CG 3.26Å; A226-L230 WeakPolarHBondContact O-CG 3.28Å; A226-L230 PolarHBondContact O-N 2.9Å; A226-L261 HydrophobicContact CB-CD1 3.98Å
227	I	98.7	Very high	98.2	Very high	41 Å²	41	25.6 Å²	25.6	21%	0.21	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-45.4	177.9	-67.7	164.2	0	0	0	110.5	F196 I197 A200 F223 I224 G231	F196-I227 HydrophobicContact CB-CG1 4Å; I197-I227 HydrophobicContact CD1-CG2 4.27Å; I197-I227 HydrophobicContact CG1-CD1 3.85Å; I197-I227 HydrophobicContact CG1-CG1 3.93Å; I197-I227 HydrophobicContact CG1-CG2 3.94Å; A200-I227 HydrophobicContact CB-CD1 4.31Å; F223-I227 WeakPolarHBondContact O-CB 3.38Å; F223-I227 WeakPolarHBondContact O-CD1 3.27Å; F223-I227 WeakPolarHBondContact O-CG1 3.28Å; F223-I227 PolarHBondContact O-N 3.47Å; I224-I227 PolarHBondContact O-N 3.48Å; I227-G231 WeakPolarHBondContact O-CA 3.32Å; I227-G231 PolarHBondContact O-N 2.96Å
228	L	98.5	Very high	98.2	Very high	61 Å²	61	22.8 Å²	22.8	32%	0.319	13%	0.134	S	C	.	.	H	α-helix	trans	-63.8	-44.3	177	-71.8	175.8	0	0	0	111.8	I224 F232 L260	I224-L228 HydrophobicContact CG2-CD1 3.77Å; I224-L228 HydrophobicContact CG2-CG 4.24Å; I224-L228 WeakPolarHBondContact O-CB 3.18Å; I224-L228 VanDerWaalsContact O-CG 3.22Å; I224-L228 WeakPolarHBondContact O-CG 3.29Å; I224-L228 PolarHBondContact O-N 3.39Å; L228-F232 HydrophobicContact CB-CD2 4.45Å; L228-F232 HydrophobicContact CB-CE2 4.15Å; L228-F232 HydrophobicContact CD2-CE1 4.3Å; L228-F232 HydrophobicContact CD2-CE2 4.28Å; L228-F232 HydrophobicContact CD2-CZ 3.85Å; L228-F232 VanDerWaalsContact O-CB 3.25Å; L228-F232 WeakPolarHBondContact O-CB 3.22Å; L228-F232 VanDerWaalsContact O-CD2 3.27Å; L228-F232 WeakPolarHBondContact O-CD2 3.35Å; L228-F232 WeakPolarHBondContact O-CG 3.35Å; L228-F232 PolarHBondContact O-N 3.09Å; L228-L260 HydrophobicContact CB-CD1 4.44Å; L228-L260 HydrophobicContact CD1-CD1 4.1Å
229	C	98.8	Very high	98.3	Very high	4 Å²	4	22.6 Å²	22.6	3%	0.027	13%	0.133	C	C	.	.	H	α-helix	trans	-59.7	-54	178.1	-177.6	0	0	0	0	112.2	S225 A226 S233 G257 L261	S225-C229 VanDerWaalsContact O-CB 3.28Å; S225-C229 WeakPolarHBondContact O-CB 3.32Å; S225-C229 PolarHBondContact O-N 3.43Å; A226-C229 PolarHBondContact O-N 3.29Å; C229-S233 VanDerWaalsContact O-CB 3.31Å; C229-S233 WeakPolarHBondContact O-CB 3.31Å; C229-S233 PolarHBondContact O-N 3.36Å; C229-G257 VanDerWaalsContact CB-O 3.31Å; C229-G257 WeakPolarHBondContact CB-O 3.39Å; C229-G257 PolarHBondContact SG-O 3.38Å; C229-L261 HydrophobicContact CB-CB 3.76Å; C229-L261 HydrophobicContact CB-CD2 4.22Å
230	L	98.6	Very high	98.3	Very high	1 Å²	1	23 Å²	23	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-68.3	-38.2	-177.6	-62	174.2	0	0	0	111.1	H189 C193 F196 A226 S234 V390 V391	H189-L230 HydrophobicContact CB-CD2 4.31Å; C193-L230 HydrophobicContact CB-CB 3.74Å; F196-L230 HydrophobicContact CD2-CD1 3.62Å; F196-L230 HydrophobicContact CE2-CD1 4.16Å; F196-L230 HydrophobicContact CG-CD1 4.46Å; A226-L230 WeakPolarHBondContact O-CB 3.43Å; A226-L230 VanDerWaalsContact O-CG 3.26Å; A226-L230 WeakPolarHBondContact O-CG 3.28Å; A226-L230 PolarHBondContact O-N 2.9Å; L230-S234 VanDerWaalsContact O-CB 3.32Å; L230-S234 WeakPolarHBondContact O-CB 3.16Å; L230-S234 PolarHBondContact O-N 3.03Å; L230-V390 HydrophobicContact CD2-CG1 4.23Å; L230-V391 HydrophobicContact CD2-CG2 3.95Å
231	G	98.5	Very high	98.2	Very high	24 Å²	24	21.8 Å²	21.8	25%	0.247	13%	0.127	C	C	.	.	H	α-helix	trans	-64.5	-48.8	176	0	0	0	0	0	113	I227 S233 S234 A235	I227-G231 WeakPolarHBondContact O-CA 3.32Å; I227-G231 PolarHBondContact O-N 2.96Å; G231-S233 VanDerWaalsContact C-N 3.33Å; G231-S233 PolarHBondContact O-N 2.9Å; G231-S234 PolarHBondContact O-N 3.49Å; G231-A235 VanDerWaalsContact O-CB 3.28Å; G231-A235 WeakPolarHBondContact O-CB 3.38Å; G231-A235 PolarHBondContact O-N 3.46Å
232	F	98.6	Very high	98.2	Very high	54 Å²	54	20.2 Å²	20.2	24%	0.237	12%	0.116	C	C	.	.	H	α-helix	trans	-63.3	-40	176.8	-68.5	-23.8	0	0	0	112.1	L228 A235 F236 L253 L260	L228-F232 HydrophobicContact CB-CD2 4.45Å; L228-F232 HydrophobicContact CB-CE2 4.15Å; L228-F232 HydrophobicContact CD2-CE1 4.3Å; L228-F232 HydrophobicContact CD2-CE2 4.28Å; L228-F232 HydrophobicContact CD2-CZ 3.85Å; L228-F232 VanDerWaalsContact O-CB 3.25Å; L228-F232 WeakPolarHBondContact O-CB 3.22Å; L228-F232 VanDerWaalsContact O-CD2 3.27Å; L228-F232 WeakPolarHBondContact O-CD2 3.35Å; L228-F232 WeakPolarHBondContact O-CG 3.35Å; L228-F232 PolarHBondContact O-N 3.09Å; F232-A235 PolarHBondContact O-N 3.35Å; F232-F236 WeakPolarHBondContact O-CB 3.45Å; F232-F236 PolarHBondContact O-N 2.63Å; F232-L253 HydrophobicContact CB-CB 4.23Å; F232-L253 HydrophobicContact CD1-CB 4.4Å; F232-L253 HydrophobicContact CD2-CB 4.29Å; F232-L253 VanDerWaalsContact CD2-O 3.32Å; F232-L253 WeakPolarHBondContact CD2-O 3.47Å; F232-L253 HydrophobicContact CG-CB 4.07Å; F232-L260 HydrophobicContact CE2-CD1 4.47Å
233	S	98.6	Very high	98.1	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-50.5	176.2	-171.6	0	0	0	0	112.2	H189 C229 G231 A235 F236 H237 D254 H387	H189-S233 WeakPolarHBondContact ND1-CB 3.22Å; H189-S233 PolarHBondContact ND1-OG 3.41Å; C229-S233 VanDerWaalsContact O-CB 3.31Å; C229-S233 WeakPolarHBondContact O-CB 3.31Å; C229-S233 PolarHBondContact O-N 3.36Å; G231-S233 VanDerWaalsContact C-N 3.33Å; G231-S233 PolarHBondContact O-N 2.9Å; S233-A235 VanDerWaalsContact C-N 3.28Å; S233-A235 PolarHBondContact O-N 2.88Å; S233-F236 PolarHBondContact O-N 2.89Å; S233-H237 PolarHBondContact O-CD2 2.67Å; S233-H237 PolarHBondContact O-N 3.46Å; S233-D254 WeakPolarHBondContact CA-OD1 3.34Å; S233-D254 WeakPolarHBondContact CB-OD1 3.42Å; S233-D254 PolarHBondContact OG-OD1 2.69Å; S233-D254 VanDerWaalsContact OG-OD1 3.05Å; S233-H387 PolarHBondContact OG-CE1 2.73Å
234	S	98.5	Very high	97.9	Very high	13 Å²	13	23.8 Å²	23.8	9%	0.091	14%	0.139	C	C	.	.	H	α-helix	trans	-57.1	-42.3	175.5	-178.3	0	0	0	0	112	M190 L230 G231 T238	M190-S234 WeakPolarHBondContact CB-OG 3.42Å; L230-S234 VanDerWaalsContact O-CB 3.32Å; L230-S234 WeakPolarHBondContact O-CB 3.16Å; L230-S234 PolarHBondContact O-N 3.03Å; G231-S234 PolarHBondContact O-N 3.49Å; S234-T238 WeakPolarHBondContact O-CB 3.34Å; S234-T238 PolarHBondContact O-N 2.93Å; S234-T238 PolarHBondContact O-OG1 3.35Å
235	A	98.3	Very high	97.7	Very high	32 Å²	32	25.1 Å²	25.1	26%	0.264	15%	0.147	S	C	.	.	H	α-helix	trans	-64.2	-47.1	177.5	0	0	0	0	0	111.2	G231 F232 S233 T238 V239 F250	G231-A235 VanDerWaalsContact O-CB 3.28Å; G231-A235 WeakPolarHBondContact O-CB 3.38Å; G231-A235 PolarHBondContact O-N 3.46Å; F232-A235 PolarHBondContact O-N 3.35Å; S233-A235 VanDerWaalsContact C-N 3.28Å; S233-A235 PolarHBondContact O-N 2.88Å; A235-T238 WeakPolarHBondContact O-CB 3.29Å; A235-T238 PolarHBondContact O-N 3.4Å; A235-T238 VanDerWaalsContact O-N 3.13Å; A235-V239 WeakPolarHBondContact O-CG2 3.47Å; A235-V239 PolarHBondContact O-N 3.4Å; A235-F250 HydrophobicContact CB-CD1 3.94Å; A235-F250 HydrophobicContact CB-CE1 3.81Å
236	F	98.2	Very high	97.6	Very high	27 Å²	27	25.1 Å²	25.1	12%	0.118	15%	0.146	C	C	.	.	H	α-helix	trans	-55.7	-54.2	175.8	168.5	-114.7	0	0	0	111.9	F232 S233 T238 V239 S240 T247 F250 S251 D254	F232-F236 WeakPolarHBondContact O-CB 3.45Å; F232-F236 PolarHBondContact O-N 2.63Å; S233-F236 PolarHBondContact O-N 2.89Å; F236-T238 PolarHBondContact O-N 3.44Å; F236-V239 CarbonylContact O-C 3.32Å; F236-V239 PolarHBondContact O-N 2.88Å; F236-S240 WeakPolarHBondContact O-CA 3.43Å; F236-S240 WeakPolarHBondContact O-CB 3.16Å; F236-S240 PolarHBondContact O-N 3.38Å; F236-T247 HydrophobicContact CE2-CG2 4.01Å; F236-F250 HydrophobicContact CB-CB 3.98Å; F236-F250 VanDerWaalsContact CD2-C 3.47Å; F236-F250 HydrophobicContact CD2-CB 3.76Å; F236-F250 HydrophobicContact CG-CB 4.36Å; F236-S251 VanDerWaalsContact CD2-N 3.28Å; F236-D254 HydrophobicContact CB-CB 3.99Å; F236-D254 HydrophobicContact CD1-CB 4.14Å; F236-D254 HydrophobicContact CG-CB 4.14Å
237	H	98.4	Very high	97.4	Very high	1 Å²	1	26 Å²	26	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-63.6	-25.4	179.5	-73.2	-77.8	0	0	0	112.6	R163 E182 N185 I186 S233 S240 H383 H387	R163-H237 PolarHBondContact NH1-O 3.29Å; R163-H237 PolarHBondContact NH2-O 3.41Å; E182-H237 IonicContact OE2-CE1 3.17Å; E182-H237 IonicContact OE2-CG 3.13Å; E182-H237 IonicContact OE2-ND1 2.73Å; E182-H237 PolarHBondContact OE2-ND1 3.49Å; N185-H237 HydrophobicContact CB-CB 4.22Å; I186-H237 HydrophobicContact CG1-CB 3.7Å; S233-H237 PolarHBondContact O-CD2 2.67Å; S233-H237 PolarHBondContact O-N 3.46Å; H237-S240 PolarHBondContact O-OG 2.93Å; H237-H383 AromaticContact CE1-CE1 3.7Å; H237-H383 AromaticContact CE1-NE2 3.67Å; H237-H383 AromaticContact NE2-NE2 3.64Å; H237-H387 AromaticContact CD2-CE1 3.45Å; H237-H387 PolarHBondContact CD2-CE1 3Å; H237-H387 VanDerWaalsContact CD2-CE1 3.45Å; H237-H387 AromaticContact CD2-NE2 4Å; H237-H387 AromaticContact NE2-CE1 3.31Å; H237-H387 PolarHBondContact NE2-CE1 2.85Å; H237-H387 VanDerWaalsContact NE2-CE1 3.31Å; H237-H387 AromaticContact NE2-NE2 3.39Å; H237-H387 PolarHBondContact NE2-NE2 3.15Å
238	T	98.2	Very high	97.2	Very high	7 Å²	7	28 Å²	28	4%	0.043	16%	0.159	C	C	.	.	H	α-helix	trans	-70.9	-49.2	173.6	-59.9	0	0	0	0	111.6	R163 L173 I176 S234 A235 F236	R163-T238 PolarHBondContact NH1-O 2.74Å; L173-T238 HydrophobicContact CD2-CG2 4.13Å; I176-T238 HydrophobicContact CD1-CG2 3.88Å; I176-T238 HydrophobicContact CG1-CG2 3.88Å; S234-T238 WeakPolarHBondContact O-CB 3.34Å; S234-T238 PolarHBondContact O-N 2.93Å; S234-T238 PolarHBondContact O-OG1 3.35Å; A235-T238 WeakPolarHBondContact O-CB 3.29Å; A235-T238 PolarHBondContact O-N 3.4Å; A235-T238 VanDerWaalsContact O-N 3.13Å; F236-T238 PolarHBondContact O-N 3.44Å
239	V	97.6	Very high	97	Very high	10 Å²	10	29.9 Å²	29.9	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-96.6	6	-174.2	-53.8	0	0	0	0	114.1	Y169 C172 A235 F236 C241 H242 V246 F250	Y169-V239 HydrophobicContact CD1-CG1 3.99Å; Y169-V239 HydrophobicContact CE1-CG1 4.22Å; C172-V239 HydrophobicContact CB-CG1 4.4Å; A235-V239 WeakPolarHBondContact O-CG2 3.47Å; A235-V239 PolarHBondContact O-N 3.4Å; F236-V239 CarbonylContact O-C 3.32Å; F236-V239 PolarHBondContact O-N 2.88Å; V239-C241 PolarHBondContact O-N 3.03Å; V239-H242 VanDerWaalsContact O-CB 3.23Å; V239-H242 WeakPolarHBondContact O-CB 3.43Å; V239-H242 PolarHBondContact O-N 3.26Å; V239-V246 HydrophobicContact CB-CG1 3.91Å; V239-V246 HydrophobicContact CG2-CG1 3.58Å; V239-F250 HydrophobicContact CG2-CB 4.06Å; V239-F250 HydrophobicContact CG2-CD1 3.83Å; V239-F250 HydrophobicContact CG2-CD2 3.62Å; V239-F250 HydrophobicContact CG2-CE1 4.15Å; V239-F250 HydrophobicContact CG2-CE2 3.95Å; V239-F250 HydrophobicContact CG2-CG 3.55Å; V239-F250 HydrophobicContact CG2-CZ 4.2Å
240	S	96.6	Very high	96.9	Very high	9 Å²	9	31.8 Å²	31.8	6%	0.063	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.7	-175.1	62.9	0	0	0	0	113.6	W151 L152 R163 F236 H237 T247	W151-S240 VanDerWaalsContact CZ3-O 3.23Å; W151-S240 WeakPolarHBondContact CZ3-O 3.27Å; L152-S240 WeakPolarHBondContact CD2-O 3.49Å; R163-S240 PolarHBondContact NH2-OG 3.29Å; F236-S240 WeakPolarHBondContact O-CA 3.43Å; F236-S240 WeakPolarHBondContact O-CB 3.16Å; F236-S240 PolarHBondContact O-N 3.38Å; H237-S240 PolarHBondContact O-OG 2.93Å; S240-T247 PolarHBondContact O-OG1 2.99Å
241	C	96.4	Very high	96.8	Very high	2 Å²	2	32 Å²	32	1%	0.014	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	4.4	174.7	60.9	0	0	0	0	114.7	R163 P165 L166 C172 V239	R163-C241 HydrophobicContact CB-CB 3.95Å; R163-C241 VanDerWaalsContact CZ-SG 3.58Å; P165-C241 CarbonylContact C-O 3.55Å; P165-C241 WeakPolarHBondContact CA-O 3.13Å; L166-C241 PolarHBondContact N-O 2.88Å; C172-C241 VanDerWaalsContact SG-SG 3.69Å; V239-C241 PolarHBondContact O-N 3.03Å
242	H	97.3	Very high	96.7	Very high	23 Å²	23	33.1 Å²	33.1	11%	0.106	18%	0.176	C	C	.	.	S	Bend	trans	-71.8	-69	-171.7	-175.5	-68.5	0	0	0	113.7	L166 P167 Y169 V239 V246	L166-H242 VanDerWaalsContact O-CA 3.32Å; L166-H242 WeakPolarHBondContact O-CA 3.23Å; P167-H242 WeakPolarHBondContact CA-O 3.37Å; Y169-H242 AromaticContact CD1-CD2 3.88Å; Y169-H242 AromaticContact CD2-NE2 3.63Å; Y169-H242 AromaticContact CE1-CD2 3.98Å; Y169-H242 AromaticContact CE2-NE2 3.64Å; Y169-H242 AromaticContact CG-CD2 3.93Å; Y169-H242 AromaticContact CG-NE2 3.96Å; Y169-H242 AromaticContact CZ-NE2 3.96Å; V239-H242 VanDerWaalsContact O-CB 3.23Å; V239-H242 WeakPolarHBondContact O-CB 3.43Å; V239-H242 PolarHBondContact O-N 3.26Å; H242-V246 HydrophobicContact CB-CB 3.99Å; H242-V246 HydrophobicContact CB-CG1 3.84Å; H242-V246 HydrophobicContact CB-CG2 4.37Å; H242-V246 WeakPolarHBondContact ND1-CG2 3.28Å
243	S	95.8	Very high	96.6	Very high	26 Å²	26	33.1 Å²	33.1	18%	0.182	18%	0.178	C	C	.	.			trans	-162	162.9	179.1	67.1	0	0	0	0	109.6	N245 V246 T247	S243-N245 PolarHBondContact O-N 2.97Å; S243-N245 VanDerWaalsContact O-N 3.17Å; S243-V246 PolarHBondContact O-N 3.47Å; S243-V246 VanDerWaalsContact O-N 3.12Å; S243-V246 WeakPolarHBondContact OG-CG2 3.38Å; S243-T247 PolarHBondContact O-N 3.31Å; S243-T247 PolarHBondContact O-OG1 3.49Å; S243-T247 VanDerWaalsContact O-OG1 3.12Å
244	V	95.3	Very high	96.6	Very high	51 Å²	51	33.5 Å²	33.5	31%	0.309	18%	0.18	S	C	.	.	H	α-helix	trans	-52	-43.2	-178.3	-177	0	0	0	0	112.2	W151 K248	W151-V244 HydrophobicContact CB-CG2 4.39Å; W151-V244 HydrophobicContact CD2-CG2 4.01Å; W151-V244 HydrophobicContact CG-CG2 3.77Å; V244-K248 HydrophobicContact CG1-CD 4.3Å; V244-K248 WeakPolarHBondContact O-CB 3.44Å; V244-K248 VanDerWaalsContact O-CG 3.29Å; V244-K248 WeakPolarHBondContact O-CG 3.4Å; V244-K248 PolarHBondContact O-N 3.26Å
245	N	94.3	Very high	96.5	Very high	127 Å²	127	33.7 Å²	33.7	68%	0.679	18%	0.179	S	C	*	.	H	α-helix	trans	-68.6	-42.9	-178.1	-68.9	-18	0	0	0	112.1	S243 K248 L249	S243-N245 PolarHBondContact O-N 2.97Å; S243-N245 VanDerWaalsContact O-N 3.17Å; N245-K248 PolarHBondContact O-N 2.88Å; N245-L249 PolarHBondContact O-N 3.03Å
246	V	96	Very high	96.5	Very high	13 Å²	13	33.2 Å²	33.2	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-65.4	-46	178.4	174.7	0	0	0	0	110.1	Y169 V239 H242 S243 K248 L249 F250	Y169-V246 HydrophobicContact CE1-CG1 4.16Å; Y169-V246 VanDerWaalsContact OH-CG2 3.31Å; Y169-V246 WeakPolarHBondContact OH-CG2 3.47Å; V239-V246 HydrophobicContact CB-CG1 3.91Å; V239-V246 HydrophobicContact CG2-CG1 3.58Å; H242-V246 HydrophobicContact CB-CB 3.99Å; H242-V246 HydrophobicContact CB-CG1 3.84Å; H242-V246 HydrophobicContact CB-CG2 4.37Å; H242-V246 WeakPolarHBondContact ND1-CG2 3.28Å; S243-V246 PolarHBondContact O-N 3.47Å; S243-V246 VanDerWaalsContact O-N 3.12Å; S243-V246 WeakPolarHBondContact OG-CG2 3.38Å; V246-K248 VanDerWaalsContact C-N 3.34Å; V246-K248 PolarHBondContact O-N 3.34Å; V246-L249 PolarHBondContact O-N 3.49Å; V246-F250 HydrophobicContact CG1-CD2 3.81Å; V246-F250 HydrophobicContact CG1-CE2 4.07Å; V246-F250 WeakPolarHBondContact O-CD2 3.34Å; V246-F250 PolarHBondContact O-N 3.27Å
247	T	94.3	Very high	96.5	Very high	19 Å²	19	32 Å²	32	12%	0.117	17%	0.167	C	C	.	.	H	α-helix	trans	-61.8	-40.9	177.5	-56.7	0	0	0	0	111.9	W151 F236 S240 S243 S251	W151-T247 HydrophobicContact CE3-CG2 4.17Å; W151-T247 HydrophobicContact CZ3-CG2 4.43Å; W151-T247 WeakPolarHBondContact CZ3-OG1 3.27Å; F236-T247 HydrophobicContact CE2-CG2 4.01Å; S240-T247 PolarHBondContact O-OG1 2.99Å; S243-T247 PolarHBondContact O-N 3.31Å; S243-T247 PolarHBondContact O-OG1 3.49Å; S243-T247 VanDerWaalsContact O-OG1 3.12Å; T247-S251 WeakPolarHBondContact O-CB 3.19Å; T247-S251 PolarHBondContact O-N 3.2Å; T247-S251 PolarHBondContact O-OG 3.31Å
248	K	93.6	Very high	96.5	Very high	84 Å²	84	33.3 Å²	33.3	37%	0.365	17%	0.174	S	C	.	.	H	α-helix	trans	-62.8	-42.6	174.3	-79.2	-177.9	176	-164.4	0	112.8	V244 N245 V246 S251 K252 D302	V244-K248 HydrophobicContact CG1-CD 4.3Å; V244-K248 WeakPolarHBondContact O-CB 3.44Å; V244-K248 VanDerWaalsContact O-CG 3.29Å; V244-K248 WeakPolarHBondContact O-CG 3.4Å; V244-K248 PolarHBondContact O-N 3.26Å; N245-K248 PolarHBondContact O-N 2.88Å; V246-K248 VanDerWaalsContact C-N 3.34Å; V246-K248 PolarHBondContact O-N 3.34Å; K248-S251 PolarHBondContact O-OG 3.12Å; K248-S251 VanDerWaalsContact O-OG 3.08Å; K248-K252 VanDerWaalsContact O-CG 3.3Å; K248-K252 WeakPolarHBondContact O-CG 3.37Å; K248-K252 PolarHBondContact O-N 3.24Å; K248-D302 IonicContact NZ-OD2 3.33Å; K248-D302 PolarHBondContact NZ-OD2 3.13Å
249	L	95.4	Very high	96.5	Very high	100 Å²	100	33 Å²	33	52%	0.524	17%	0.172	S	C	.	.	H	α-helix	trans	-66.2	-52.5	179	175.5	61.2	0	0	0	111.2	N245 V246 K252 L253	N245-L249 PolarHBondContact O-N 3.03Å; V246-L249 PolarHBondContact O-N 3.49Å; L249-K252 WeakPolarHBondContact O-CB 3.32Å; L249-K252 PolarHBondContact O-N 3.46Å; L249-L253 PolarHBondContact O-N 2.83Å; L249-L253 VanDerWaalsContact O-N 3.15Å
250	F	96.9	Very high	96.6	Very high	43 Å²	43	34.9 Å²	34.9	19%	0.189	18%	0.182	C	C	.	.	H	α-helix	trans	-73	-29.8	-174.5	-81.3	-97.5	0	0	0	112.9	A235 F236 V239 V246 K252 L253 D254	A235-F250 HydrophobicContact CB-CD1 3.94Å; A235-F250 HydrophobicContact CB-CE1 3.81Å; F236-F250 HydrophobicContact CB-CB 3.98Å; F236-F250 VanDerWaalsContact CD2-C 3.47Å; F236-F250 HydrophobicContact CD2-CB 3.76Å; F236-F250 HydrophobicContact CG-CB 4.36Å; V239-F250 HydrophobicContact CG2-CB 4.06Å; V239-F250 HydrophobicContact CG2-CD1 3.83Å; V239-F250 HydrophobicContact CG2-CD2 3.62Å; V239-F250 HydrophobicContact CG2-CE1 4.15Å; V239-F250 HydrophobicContact CG2-CE2 3.95Å; V239-F250 HydrophobicContact CG2-CG 3.55Å; V239-F250 HydrophobicContact CG2-CZ 4.2Å; V246-F250 HydrophobicContact CG1-CD2 3.81Å; V246-F250 HydrophobicContact CG1-CE2 4.07Å; V246-F250 WeakPolarHBondContact O-CD2 3.34Å; V246-F250 PolarHBondContact O-N 3.27Å; F250-K252 VanDerWaalsContact C-N 3.31Å; F250-K252 PolarHBondContact O-N 2.87Å; F250-L253 HydrophobicContact CD1-CD1 4.41Å; F250-L253 PolarHBondContact O-N 2.94Å; F250-D254 WeakPolarHBondContact O-CB 3.29Å; F250-D254 PolarHBondContact O-N 3.4Å
251	S	96	Very high	96.7	Very high	5 Å²	5	34.7 Å²	34.7	4%	0.035	18%	0.18	C	C	.	.	H	α-helix	trans	-63.7	-36.7	171.2	53.6	0	0	0	0	112.1	F236 T247 K248 D254 Y255	F236-S251 VanDerWaalsContact CD2-N 3.28Å; T247-S251 WeakPolarHBondContact O-CB 3.19Å; T247-S251 PolarHBondContact O-N 3.2Å; T247-S251 PolarHBondContact O-OG 3.31Å; K248-S251 PolarHBondContact O-OG 3.12Å; K248-S251 VanDerWaalsContact O-OG 3.08Å; S251-D254 PolarHBondContact O-N 3.32Å; S251-Y255 VanDerWaalsContact O-CD2 3.26Å; S251-Y255 WeakPolarHBondContact O-CD2 3.25Å; S251-Y255 PolarHBondContact O-N 2.75Å; S251-Y255 VanDerWaalsContact O-N 3.1Å
252	K	96.5	Very high	96.7	Very high	49 Å²	49	35.5 Å²	35.5	21%	0.213	18%	0.184	C	C	.	.	H	α-helix	trans	-65.2	-43.3	173.3	-70.8	176.4	-171.5	-163.1	0	111.5	K248 L249 F250 D254 Y255 V256 L300 D302	K248-K252 VanDerWaalsContact O-CG 3.3Å; K248-K252 WeakPolarHBondContact O-CG 3.37Å; K248-K252 PolarHBondContact O-N 3.24Å; L249-K252 WeakPolarHBondContact O-CB 3.32Å; L249-K252 PolarHBondContact O-N 3.46Å; F250-K252 VanDerWaalsContact C-N 3.31Å; F250-K252 PolarHBondContact O-N 2.87Å; K252-D254 VanDerWaalsContact C-N 3.35Å; K252-Y255 PolarHBondContact O-N 3.31Å; K252-V256 WeakPolarHBondContact O-CB 3.38Å; K252-V256 VanDerWaalsContact O-CG2 3.25Å; K252-V256 WeakPolarHBondContact O-CG2 3.25Å; K252-V256 PolarHBondContact O-N 3.13Å; K252-L300 HydrophobicContact CB-CD2 4.1Å; K252-L300 HydrophobicContact CD-CD2 4.26Å; K252-L300 VanDerWaalsContact CE-O 3.24Å; K252-L300 WeakPolarHBondContact CE-O 3.34Å; K252-L300 HydrophobicContact CG-CD2 4.45Å; K252-L300 PolarHBondContact NZ-O 3.3Å; K252-D302 VanDerWaalsContact CE-OD1 3.26Å; K252-D302 WeakPolarHBondContact CE-OD1 3.36Å; K252-D302 IonicContact NZ-OD1 2.77Å; K252-D302 PolarHBondContact NZ-OD1 3.04Å
253	L	97.2	Very high	96.8	Very high	53 Å²	53	35.9 Å²	35.9	28%	0.277	19%	0.188	S	C	.	.	H	α-helix	trans	-62.7	-41.1	176.6	-67.6	175.9	0	0	0	112	F232 L249 F250 V256 G257	F232-L253 HydrophobicContact CB-CB 4.23Å; F232-L253 HydrophobicContact CD1-CB 4.4Å; F232-L253 HydrophobicContact CD2-CB 4.29Å; F232-L253 VanDerWaalsContact CD2-O 3.32Å; F232-L253 WeakPolarHBondContact CD2-O 3.47Å; F232-L253 HydrophobicContact CG-CB 4.07Å; L249-L253 PolarHBondContact O-N 2.83Å; L249-L253 VanDerWaalsContact O-N 3.15Å; F250-L253 HydrophobicContact CD1-CD1 4.41Å; F250-L253 PolarHBondContact O-N 2.94Å; L253-V256 PolarHBondContact O-N 3.38Å; L253-G257 PolarHBondContact O-N 3.38Å
254	D	98	Very high	96.9	Very high	10 Å²	10	34.7 Å²	34.7	5%	0.053	18%	0.18	C	C	.	.	H	α-helix	trans	-57.4	-49.2	174.4	179.9	45	0	0	0	111.3	S233 F236 F250 S251 K252 V256 G257 I258	S233-D254 WeakPolarHBondContact CA-OD1 3.34Å; S233-D254 WeakPolarHBondContact CB-OD1 3.42Å; S233-D254 PolarHBondContact OG-OD1 2.69Å; S233-D254 VanDerWaalsContact OG-OD1 3.05Å; F236-D254 HydrophobicContact CB-CB 3.99Å; F236-D254 HydrophobicContact CD1-CB 4.14Å; F236-D254 HydrophobicContact CG-CB 4.14Å; F250-D254 WeakPolarHBondContact O-CB 3.29Å; F250-D254 PolarHBondContact O-N 3.4Å; S251-D254 PolarHBondContact O-N 3.32Å; K252-D254 VanDerWaalsContact C-N 3.35Å; D254-V256 PolarHBondContact O-N 2.86Å; D254-G257 WeakPolarHBondContact O-CA 3.42Å; D254-G257 PolarHBondContact O-N 3.31Å; D254-G257 VanDerWaalsContact O-N 3.12Å; D254-I258 PolarHBondContact O-N 3.37Å
255	Y	97	Very high	97	Very high	17 Å²	17	32.6 Å²	32.6	7%	0.067	17%	0.168	C	C	.	.	H	α-helix	trans	-66	-37.9	177	-60.3	-20.5	0	0	0	113.9	S251 K252 G257 I258 S259 F304 R313	S251-Y255 VanDerWaalsContact O-CD2 3.26Å; S251-Y255 WeakPolarHBondContact O-CD2 3.25Å; S251-Y255 PolarHBondContact O-N 2.75Å; S251-Y255 VanDerWaalsContact O-N 3.1Å; K252-Y255 PolarHBondContact O-N 3.31Å; Y255-G257 VanDerWaalsContact C-N 3.27Å; Y255-G257 PolarHBondContact O-N 3.4Å; Y255-I258 PolarHBondContact O-N 3.24Å; Y255-S259 PolarHBondContact O-N 2.92Å; Y255-F304 AromaticContact CD2-CD1 3.72Å; Y255-F304 HydrophobicContact CD2-CD1 3.72Å; Y255-F304 HydrophobicContact CD2-CE1 4.08Å; Y255-F304 AromaticContact CE2-CD1 3.96Å; Y255-F304 HydrophobicContact CE2-CD1 3.96Å; Y255-F304 HydrophobicContact CG-CD1 4.43Å; Y255-F304 HydrophobicContact CG-CE1 4.35Å; Y255-R313 VanDerWaalsContact CZ-CD 3.47Å; Y255-R313 PolarHBondContact OH-NE 3.24Å
256	V	98	Very high	97.2	Very high	22 Å²	22	27.4 Å²	27.4	13%	0.133	14%	0.139	C	C	.	.	H	α-helix	trans	-60.6	-41.6	171.6	167.2	0	0	0	0	110.1	K252 L253 D254 I258 S259 L260 I296 L300	K252-V256 WeakPolarHBondContact O-CB 3.38Å; K252-V256 VanDerWaalsContact O-CG2 3.25Å; K252-V256 WeakPolarHBondContact O-CG2 3.25Å; K252-V256 PolarHBondContact O-N 3.13Å; L253-V256 PolarHBondContact O-N 3.38Å; D254-V256 PolarHBondContact O-N 2.86Å; V256-I258 VanDerWaalsContact C-N 3.35Å; V256-I258 PolarHBondContact O-N 2.9Å; V256-S259 PolarHBondContact O-N 3.2Å; V256-S259 VanDerWaalsContact O-N 3.13Å; V256-L260 HydrophobicContact CG1-CD1 3.87Å; V256-L260 HydrophobicContact CG1-CG 4.1Å; V256-L260 WeakPolarHBondContact O-CG 3.38Å; V256-L260 PolarHBondContact O-N 3.38Å; V256-I296 HydrophobicContact CG1-CD1 4.48Å; V256-I296 HydrophobicContact CG1-CG1 4.41Å; V256-I296 HydrophobicContact CG2-CG1 4.48Å; V256-I296 HydrophobicContact CG2-CG2 4.11Å; V256-L300 HydrophobicContact CG2-CD2 4.13Å
257	G	98.3	Very high	97.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-51.6	-49.2	175.3	0	0	0	0	0	113	C229 L253 D254 Y255 S259 L260 L261	C229-G257 VanDerWaalsContact CB-O 3.31Å; C229-G257 WeakPolarHBondContact CB-O 3.39Å; C229-G257 PolarHBondContact SG-O 3.38Å; L253-G257 PolarHBondContact O-N 3.38Å; D254-G257 WeakPolarHBondContact O-CA 3.42Å; D254-G257 PolarHBondContact O-N 3.31Å; D254-G257 VanDerWaalsContact O-N 3.12Å; Y255-G257 VanDerWaalsContact C-N 3.27Å; Y255-G257 PolarHBondContact O-N 3.4Å; G257-S259 VanDerWaalsContact C-N 3.32Å; G257-S259 PolarHBondContact O-N 3.44Å; G257-L260 PolarHBondContact O-N 2.81Å; G257-L261 PolarHBondContact O-N 2.56Å
258	I	98.3	Very high	97.4	Very high	30 Å²	30	27.3 Å²	27.3	15%	0.154	14%	0.138	C	C	.	.	H	α-helix	trans	-58.6	-45.2	178.2	-59.9	170.7	0	0	0	111	D254 Y255 V256 L261 I262 F317	D254-I258 PolarHBondContact O-N 3.37Å; Y255-I258 PolarHBondContact O-N 3.24Å; V256-I258 VanDerWaalsContact C-N 3.35Å; V256-I258 PolarHBondContact O-N 2.9Å; I258-L261 PolarHBondContact O-N 3.38Å; I258-I262 HydrophobicContact CG2-CD1 3.94Å; I258-I262 WeakPolarHBondContact O-CG1 3.38Å; I258-I262 PolarHBondContact O-N 2.8Å; I258-F317 HydrophobicContact CB-CD1 4.2Å; I258-F317 HydrophobicContact CB-CE1 4.18Å; I258-F317 HydrophobicContact CB-CG 4.4Å; I258-F317 HydrophobicContact CB-CZ 4.33Å; I258-F317 HydrophobicContact CD1-CD2 3.99Å; I258-F317 HydrophobicContact CD1-CE2 3.79Å; I258-F317 HydrophobicContact CD1-CZ 4.29Å; I258-F317 HydrophobicContact CG2-CB 3.93Å; I258-F317 HydrophobicContact CG2-CD1 3.65Å; I258-F317 HydrophobicContact CG2-CD2 4.01Å; I258-F317 HydrophobicContact CG2-CE1 4.14Å; I258-F317 HydrophobicContact CG2-CE2 4.45Å; I258-F317 HydrophobicContact CG2-CG 3.59Å
259	S	98.1	Very high	97.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.9	-42.5	178.8	-59.1	0	0	0	0	111.7	Y255 V256 G257 I262 V263 S295 F317	Y255-S259 PolarHBondContact O-N 2.92Å; V256-S259 PolarHBondContact O-N 3.2Å; V256-S259 VanDerWaalsContact O-N 3.13Å; G257-S259 VanDerWaalsContact C-N 3.32Å; G257-S259 PolarHBondContact O-N 3.44Å; S259-I262 PolarHBondContact O-N 3.48Å; S259-V263 VanDerWaalsContact O-CG2 3.28Å; S259-V263 WeakPolarHBondContact O-CG2 3.15Å; S259-V263 PolarHBondContact O-N 3.4Å; S259-S295 PolarHBondContact OG-OG 2.83Å; S259-F317 WeakPolarHBondContact OG-CE1 3.25Å
260	L	98.5	Very high	97.6	Very high	49 Å²	49	19.7 Å²	19.7	26%	0.257	10%	0.1	S	C	.	.	H	α-helix	trans	-61.5	-47.3	176.6	-69	175.6	0	0	0	111.1	S225 L228 F232 V256 G257 I262 V263 G264 I296	S225-L260 VanDerWaalsContact CB-O 3.28Å; S225-L260 WeakPolarHBondContact CB-O 3.44Å; S225-L260 PolarHBondContact OG-O 3.49Å; L228-L260 HydrophobicContact CB-CD1 4.44Å; L228-L260 HydrophobicContact CD1-CD1 4.1Å; F232-L260 HydrophobicContact CE2-CD1 4.47Å; V256-L260 HydrophobicContact CG1-CD1 3.87Å; V256-L260 HydrophobicContact CG1-CG 4.1Å; V256-L260 WeakPolarHBondContact O-CG 3.38Å; V256-L260 PolarHBondContact O-N 3.38Å; G257-L260 PolarHBondContact O-N 2.81Å; L260-I262 PolarHBondContact O-N 2.9Å; L260-V263 PolarHBondContact O-N 2.88Å; L260-G264 PolarHBondContact O-N 3.27Å; L260-I296 HydrophobicContact CD2-CD1 4.24Å
261	L	98.6	Very high	97.5	Very high	5 Å²	5	18.5 Å²	18.5	3%	0.026	10%	0.095	C	C	.	.	H	α-helix	trans	-57.6	-46.9	177.4	172.4	57.5	0	0	0	111.7	F222 A226 C229 G257 I258 G264 S265 V390	F222-L261 HydrophobicContact CD2-CD1 4.46Å; F222-L261 HydrophobicContact CE2-CD1 4.01Å; A226-L261 HydrophobicContact CB-CD1 3.98Å; C229-L261 HydrophobicContact CB-CB 3.76Å; C229-L261 HydrophobicContact CB-CD2 4.22Å; G257-L261 PolarHBondContact O-N 2.56Å; I258-L261 PolarHBondContact O-N 3.38Å; L261-G264 PolarHBondContact O-N 2.68Å; L261-S265 VanDerWaalsContact O-CB 3.29Å; L261-S265 WeakPolarHBondContact O-CB 3.45Å; L261-S265 PolarHBondContact O-N 3.36Å; L261-S265 PolarHBondContact O-OG 3.18Å; L261-V390 HydrophobicContact CD2-CG1 4.08Å
262	I	98.3	Very high	97.4	Very high	20 Å²	20	18.4 Å²	18.4	10%	0.103	9%	0.094	C	C	.	.	H	α-helix	trans	-61.9	-51.7	179.3	-64.3	164.9	0	0	0	110.3	I258 S259 L260 G264 S265 F266 F317 L320	I258-I262 HydrophobicContact CG2-CD1 3.94Å; I258-I262 WeakPolarHBondContact O-CG1 3.38Å; I258-I262 PolarHBondContact O-N 2.8Å; S259-I262 PolarHBondContact O-N 3.48Å; L260-I262 PolarHBondContact O-N 2.9Å; I262-G264 VanDerWaalsContact C-N 3.35Å; I262-G264 PolarHBondContact O-N 2.95Å; I262-S265 PolarHBondContact O-N 3.1Å; I262-S265 PolarHBondContact O-OG 3.14Å; I262-F266 HydrophobicContact CG2-CD2 4.36Å; I262-F266 HydrophobicContact CG2-CE2 4.03Å; I262-F266 VanDerWaalsContact O-CD2 3.25Å; I262-F266 WeakPolarHBondContact O-CD2 3.45Å; I262-F266 PolarHBondContact O-N 3.38Å; I262-F317 HydrophobicContact CD1-CB 4.26Å; I262-L320 HydrophobicContact CB-CD2 4.06Å; I262-L320 HydrophobicContact CB-CG 4.36Å; I262-L320 HydrophobicContact CD1-CB 4.33Å; I262-L320 HydrophobicContact CD1-CD2 3.97Å; I262-L320 HydrophobicContact CD1-CG 4.33Å; I262-L320 HydrophobicContact CG2-CD2 4.03Å; I262-L320 HydrophobicContact CG2-CG 3.77Å
263	V	98.4	Very high	97.2	Very high	30 Å²	30	16.5 Å²	16.5	18%	0.182	9%	0.088	C	C	.	.	H	α-helix	trans	-60.3	-46	179.1	175.8	0	0	0	0	111.2	S259 L260 S265 F266 V267 I288	S259-V263 VanDerWaalsContact O-CG2 3.28Å; S259-V263 WeakPolarHBondContact O-CG2 3.15Å; S259-V263 PolarHBondContact O-N 3.4Å; L260-V263 PolarHBondContact O-N 2.88Å; V263-S265 VanDerWaalsContact C-N 3.3Å; V263-S265 PolarHBondContact O-N 3.49Å; V263-F266 PolarHBondContact O-N 3.19Å; V263-F266 VanDerWaalsContact O-N 3.14Å; V263-V267 PolarHBondContact O-N 2.95Å; V263-I288 HydrophobicContact CG2-CG1 4.32Å
264	G	98.3	Very high	97.1	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.01	8%	0.076	C	C	.	.	H	α-helix	trans	-64.6	-32.5	-178.8	0	0	0	0	0	113.5	L260 L261 I262 P268	L260-G264 PolarHBondContact O-N 3.27Å; L261-G264 PolarHBondContact O-N 2.68Å; I262-G264 VanDerWaalsContact C-N 3.35Å; I262-G264 PolarHBondContact O-N 2.95Å; G264-P268 WeakPolarHBondContact O-CD 3.28Å
265	S	97.9	Very high	96.8	Very high	8 Å²	8	16.5 Å²	16.5	6%	0.056	8%	0.084	C	C	.	.	H	α-helix	trans	-69.4	-30.7	174.1	73.2	0	0	0	0	113	L261 I262 V263 V267 H397	L261-S265 VanDerWaalsContact O-CB 3.29Å; L261-S265 WeakPolarHBondContact O-CB 3.45Å; L261-S265 PolarHBondContact O-N 3.36Å; L261-S265 PolarHBondContact O-OG 3.18Å; I262-S265 PolarHBondContact O-N 3.1Å; I262-S265 PolarHBondContact O-OG 3.14Å; V263-S265 VanDerWaalsContact C-N 3.3Å; V263-S265 PolarHBondContact O-N 3.49Å; S265-V267 VanDerWaalsContact C-N 3.34Å; S265-V267 PolarHBondContact O-N 3.32Å; S265-H397 WeakPolarHBondContact CA-NE2 3.47Å; S265-H397 WeakPolarHBondContact CB-NE2 3.06Å; S265-H397 PolarHBondContact O-CE1 2.82Å; S265-H397 PolarHBondContact O-NE2 2.82Å
266	F	97.9	Very high	96.4	Very high	18 Å²	18	19.1 Å²	19.1	8%	0.079	11%	0.105	C	C	.	.	H	α-helix	trans	-71	-30.1	178	-87.3	-127.2	0	0	0	112.5	I262 V263 W269 L270 I288	I262-F266 HydrophobicContact CG2-CD2 4.36Å; I262-F266 HydrophobicContact CG2-CE2 4.03Å; I262-F266 VanDerWaalsContact O-CD2 3.25Å; I262-F266 WeakPolarHBondContact O-CD2 3.45Å; I262-F266 PolarHBondContact O-N 3.38Å; V263-F266 PolarHBondContact O-N 3.19Å; V263-F266 VanDerWaalsContact O-N 3.14Å; F266-W269 HydrophobicContact CD1-CE3 4.27Å; F266-W269 HydrophobicContact CD1-CZ3 4.19Å; F266-W269 HydrophobicContact CE1-CZ3 4.14Å; F266-W269 HydrophobicContact CG-CE3 4.44Å; F266-W269 PolarHBondContact O-N 3.13Å; F266-L270 HydrophobicContact CB-CD1 4.16Å; F266-L270 HydrophobicContact CB-CG 4.49Å; F266-L270 HydrophobicContact CD1-CD1 4.16Å; F266-L270 VanDerWaalsContact O-CB 3.26Å; F266-L270 WeakPolarHBondContact O-CB 3.48Å; F266-L270 VanDerWaalsContact O-CG 3.23Å; F266-L270 WeakPolarHBondContact O-CG 3.46Å; F266-L270 PolarHBondContact O-N 3.49Å; F266-I288 HydrophobicContact CB-CB 4.44Å; F266-I288 HydrophobicContact CB-CG1 4.07Å; F266-I288 HydrophobicContact CB-CG2 3.91Å; F266-I288 HydrophobicContact CD1-CB 3.91Å; F266-I288 HydrophobicContact CD1-CD1 3.99Å; F266-I288 HydrophobicContact CD1-CG1 3.67Å; F266-I288 HydrophobicContact CD1-CG2 4.17Å; F266-I288 HydrophobicContact CD2-CG1 4.29Å; F266-I288 HydrophobicContact CE1-CB 4.48Å; F266-I288 HydrophobicContact CE1-CD1 3.88Å; F266-I288 HydrophobicContact CE1-CG1 4.1Å; F266-I288 HydrophobicContact CE2-CD1 4.41Å; F266-I288 HydrophobicContact CG-CB 4.34Å; F266-I288 HydrophobicContact CG-CD1 4.3Å; F266-I288 HydrophobicContact CG-CG1 3.76Å; F266-I288 HydrophobicContact CG-CG2 4.34Å; F266-I288 HydrophobicContact CZ-CD1 4.09Å
267	V	97.6	Very high	96.2	Very high	29 Å²	29	21.2 Å²	21.2	18%	0.176	11%	0.11	C	C	.	.	H	α-helix	trans	-59	-57.7	-175	176.7	0	0	0	0	113	V221 V263 S265 W269 F271 T285	V221-V267 HydrophobicContact CB-CB 4.38Å; V221-V267 HydrophobicContact CB-CG1 4.25Å; V221-V267 HydrophobicContact CG1-CB 4.04Å; V221-V267 HydrophobicContact CG1-CG1 4.28Å; V221-V267 HydrophobicContact CG1-CG2 3.87Å; V221-V267 HydrophobicContact CG2-CG1 4.35Å; V263-V267 PolarHBondContact O-N 2.95Å; S265-V267 VanDerWaalsContact C-N 3.34Å; S265-V267 PolarHBondContact O-N 3.32Å; V267-W269 PolarHBondContact O-N 3.2Å; V267-F271 WeakPolarHBondContact O-CB 3.35Å; V267-F271 PolarHBondContact O-N 2.94Å; V267-T285 HydrophobicContact CG2-CG2 4.4Å
268	P	96.4	Very high	96	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.7	-41.6	175.9	24.1	-32.8	0	0	0	112.5	V218 F222 G264 L270 F271 Y272 I401	V218-P268 VanDerWaalsContact CG1-CA 3.41Å; V218-P268 HydrophobicContact CG1-CB 3.71Å; F222-P268 HydrophobicContact CB-CG 3.95Å; G264-P268 WeakPolarHBondContact O-CD 3.28Å; P268-L270 PolarHBondContact O-N 3.27Å; P268-F271 WeakPolarHBondContact O-CB 3.37Å; P268-F271 PolarHBondContact O-N 3.49Å; P268-Y272 HydrophobicContact CB-CE2 4.44Å; P268-Y272 WeakPolarHBondContact O-CD2 3.36Å; P268-Y272 PolarHBondContact O-N 2.8Å; P268-I401 HydrophobicContact CB-CB 4.29Å; P268-I401 HydrophobicContact CB-CD1 3.85Å; P268-I401 HydrophobicContact CB-CG2 4.24Å; P268-I401 HydrophobicContact CG-CD1 3.65Å; P268-I401 HydrophobicContact CG-CG2 4.23Å
269	W	96.4	Very high	95.9	Very high	23 Å²	23	36.3 Å²	36.3	9%	0.087	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-46.9	-178.8	177.9	64.4	0	0	0	112.6	F266 V267 F271 G273 P327 C328 L349 I401 M404	F266-W269 HydrophobicContact CD1-CE3 4.27Å; F266-W269 HydrophobicContact CD1-CZ3 4.19Å; F266-W269 HydrophobicContact CE1-CZ3 4.14Å; F266-W269 HydrophobicContact CG-CE3 4.44Å; F266-W269 PolarHBondContact O-N 3.13Å; V267-W269 PolarHBondContact O-N 3.2Å; W269-F271 VanDerWaalsContact C-N 3.34Å; W269-G273 WeakPolarHBondContact O-CA 3.33Å; W269-G273 PolarHBondContact O-N 3.34Å; W269-P327 HydrophobicContact CH2-CB 4.25Å; W269-P327 HydrophobicContact CH2-CG 3.87Å; W269-P327 HydrophobicContact CZ3-CB 4.34Å; W269-P327 HydrophobicContact CZ3-CG 3.76Å; W269-C328 HydrophobicContact CH2-CB 4.38Å; W269-L349 HydrophobicContact CD2-CD1 4.44Å; W269-L349 HydrophobicContact CH2-CD2 4.36Å; W269-L349 HydrophobicContact CZ2-CD1 4.11Å; W269-L349 HydrophobicContact CZ2-CD2 3.64Å; W269-I401 HydrophobicContact CB-CG2 4.18Å; W269-M404 VanDerWaalsContact CD1-SD 3.52Å; W269-M404 WeakPolarHBondContact O-CE 3.11Å
270	L	96.6	Very high	95.8	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-69.5	-32.7	175.3	-67.9	175.2	0	0	0	112.1	F266 P268 F274 I288 P327	F266-L270 HydrophobicContact CB-CD1 4.16Å; F266-L270 HydrophobicContact CB-CG 4.49Å; F266-L270 HydrophobicContact CD1-CD1 4.16Å; F266-L270 VanDerWaalsContact O-CB 3.26Å; F266-L270 WeakPolarHBondContact O-CB 3.48Å; F266-L270 VanDerWaalsContact O-CG 3.23Å; F266-L270 WeakPolarHBondContact O-CG 3.46Å; F266-L270 PolarHBondContact O-N 3.49Å; P268-L270 PolarHBondContact O-N 3.27Å; L270-F274 HydrophobicContact CD2-CD2 4.03Å; L270-F274 HydrophobicContact CD2-CE2 3.93Å; L270-F274 PolarHBondContact O-N 3.33Å; L270-I288 HydrophobicContact CD1-CG2 4.39Å; L270-P327 HydrophobicContact CD2-CB 3.78Å; L270-P327 HydrophobicContact CD2-CG 4.09Å
271	F	95.4	Very high	95.6	Very high	19 Å²	19	35.7 Å²	35.7	8%	0.083	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-49.4	177.5	177.4	-93.6	0	0	0	111.9	Q214 V218 V267 P268 W269 Y275 K281	Q214-F271 HydrophobicContact CG-CE2 4.44Å; Q214-F271 HydrophobicContact CG-CZ 4.02Å; Q214-F271 VanDerWaalsContact NE2-CE2 3.27Å; V218-F271 HydrophobicContact CG1-CB 3.93Å; V218-F271 HydrophobicContact CG1-CD1 3.99Å; V218-F271 HydrophobicContact CG1-CG 3.97Å; V218-F271 HydrophobicContact CG2-CD1 4.11Å; V218-F271 HydrophobicContact CG2-CD2 3.89Å; V218-F271 HydrophobicContact CG2-CE1 4.29Å; V218-F271 HydrophobicContact CG2-CE2 4.12Å; V218-F271 HydrophobicContact CG2-CG 3.91Å; V218-F271 HydrophobicContact CG2-CZ 4.32Å; V267-F271 WeakPolarHBondContact O-CB 3.35Å; V267-F271 PolarHBondContact O-N 2.94Å; P268-F271 WeakPolarHBondContact O-CB 3.37Å; P268-F271 PolarHBondContact O-N 3.49Å; W269-F271 VanDerWaalsContact C-N 3.34Å; F271-Y275 HydrophobicContact CD1-CD2 4.32Å; F271-Y275 AromaticContact CE1-CD2 3.84Å; F271-Y275 HydrophobicContact CE1-CD2 3.84Å; F271-Y275 AromaticContact CE1-CE2 3.6Å; F271-Y275 HydrophobicContact CE1-CE2 3.6Å; F271-Y275 HydrophobicContact CZ-CD2 4.15Å; F271-Y275 AromaticContact CZ-CE2 3.75Å; F271-Y275 HydrophobicContact CZ-CE2 3.75Å; F271-Y275 WeakPolarHBondContact O-CA 3.29Å; F271-Y275 PolarHBondContact O-N 3.42Å; F271-K281 HydrophobicContact CB-CD 4.42Å; F271-K281 HydrophobicContact CD2-CD 3.86Å; F271-K281 HydrophobicContact CG-CD 4.43Å
272	Y	93.6	Very high	95.6	Very high	2 Å²	2	40 Å²	40	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-81.3	-33.6	178.8	-65.1	-67.4	0	0	0	113.1	E215 V218 F219 P268 Y275 M404 A405 R408	E215-Y272 WeakPolarHBondContact CG-OH 3.28Å; V218-Y272 HydrophobicContact CG1-CE2 4.32Å; F219-Y272 HydrophobicContact CD2-CE2 4.29Å; F219-Y272 AromaticContact CE2-CE2 3.59Å; F219-Y272 HydrophobicContact CE2-CE2 3.59Å; F219-Y272 AromaticContact CE2-CZ 3.9Å; F219-Y272 WeakPolarHBondContact CE2-OH 3.4Å; F219-Y272 HydrophobicContact CZ-CE2 4.37Å; P268-Y272 HydrophobicContact CB-CE2 4.44Å; P268-Y272 WeakPolarHBondContact O-CD2 3.36Å; P268-Y272 PolarHBondContact O-N 2.8Å; Y272-Y275 HydrophobicContact CD1-CD2 4.23Å; Y272-M404 HydrophobicContact CG-CB 4.32Å; Y272-A405 HydrophobicContact CD1-CB 4.32Å; Y272-A405 HydrophobicContact CD2-CB 4.38Å; Y272-A405 HydrophobicContact CE1-CB 3.77Å; Y272-A405 HydrophobicContact CE2-CB 3.88Å; Y272-R408 HydrophobicContact CD1-CB 4.17Å; Y272-R408 HydrophobicContact CD1-CG 4.24Å
273	G	93.3	Very high	95.6	Very high	9 Å²	9	43.8 Å²	43.8	9%	0.093	20%	0.198	C	C	.	.	H	α-helix	trans	-64.1	-45.5	176.7	0	0	0	0	0	111.8	W269 Y331	W269-G273 WeakPolarHBondContact O-CA 3.33Å; W269-G273 PolarHBondContact O-N 3.34Å; G273-Y331 WeakPolarHBondContact O-CD2 3.43Å; G273-Y331 WeakPolarHBondContact O-CE2 3.27Å
274	F	93.7	Very high	95.6	Very high	6 Å²	6	43.3 Å²	43.3	3%	0.026	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	38.6	177.4	-63.5	-78.4	0	0	0	112	L270 C276 R277 A280 K281 Y284 P327 H330 Y331	L270-F274 HydrophobicContact CD2-CD2 4.03Å; L270-F274 HydrophobicContact CD2-CE2 3.93Å; L270-F274 PolarHBondContact O-N 3.33Å; F274-C276 VanDerWaalsContact C-N 3.3Å; F274-C276 PolarHBondContact O-N 2.96Å; F274-R277 HydrophobicContact CB-CB 4.46Å; F274-R277 HydrophobicContact CD1-CB 4.38Å; F274-R277 CarbonylContact O-C 3.57Å; F274-R277 PolarHBondContact O-N 2.88Å; F274-R277 VanDerWaalsContact O-N 3.08Å; F274-A280 HydrophobicContact CB-CB 4.17Å; F274-A280 HydrophobicContact CD1-CB 3.44Å; F274-A280 VanDerWaalsContact CD1-CB 3.44Å; F274-A280 HydrophobicContact CD2-CB 4.45Å; F274-A280 HydrophobicContact CE1-CB 3.86Å; F274-A280 HydrophobicContact CG-CB 3.77Å; F274-K281 HydrophobicContact CB-CB 3.89Å; F274-Y284 HydrophobicContact CD2-CD2 4.35Å; F274-Y284 AromaticContact CE2-CD2 3.83Å; F274-Y284 HydrophobicContact CE2-CD2 3.83Å; F274-Y284 HydrophobicContact CE2-CE2 4.16Å; F274-Y284 HydrophobicContact CZ-CD2 4.07Å; F274-Y284 AromaticContact CZ-CE2 3.92Å; F274-Y284 HydrophobicContact CZ-CE2 3.92Å; F274-P327 HydrophobicContact CE2-CB 3.81Å; F274-P327 HydrophobicContact CZ-CB 4.19Å; F274-P327 WeakPolarHBondContact CZ-O 3.43Å; F274-H330 HydrophobicContact CE1-CB 4.48Å; F274-H330 AromaticContact CE1-CD2 3.81Å; F274-H330 HydrophobicContact CZ-CB 4.18Å; F274-Y331 HydrophobicContact CE1-CD2 4.41Å
275	Y	91.4	Very high	95.6	Very high	57 Å²	57	45.1 Å²	45.1	22%	0.224	21%	0.205	C	C	.	.	S	Bend	trans	-50.2	-51.1	-173.9	-165.7	-95.8	0	0	0	111.9	F271 Y272 K281	F271-Y275 HydrophobicContact CD1-CD2 4.32Å; F271-Y275 AromaticContact CE1-CD2 3.84Å; F271-Y275 HydrophobicContact CE1-CD2 3.84Å; F271-Y275 AromaticContact CE1-CE2 3.6Å; F271-Y275 HydrophobicContact CE1-CE2 3.6Å; F271-Y275 HydrophobicContact CZ-CD2 4.15Å; F271-Y275 AromaticContact CZ-CE2 3.75Å; F271-Y275 HydrophobicContact CZ-CE2 3.75Å; F271-Y275 WeakPolarHBondContact O-CA 3.29Å; F271-Y275 PolarHBondContact O-N 3.42Å; Y272-Y275 HydrophobicContact CD1-CD2 4.23Å; Y275-K281 PolarHBondContact O-NZ 2.88Å
276	C	90.1	Very high	95.6	Very high	73 Å²	73	48.7 Å²	48.7	49%	0.493	23%	0.226	S	C	.	.	S	Bend	trans	-84.1	-16.6	-179.8	-56.4	0	0	0	0	115.1	F274 C414	F274-C276 VanDerWaalsContact C-N 3.3Å; F274-C276 PolarHBondContact O-N 2.96Å; C276-C414 WeakPolarHBondContact CA-SG 3.44Å; C276-C414 HydrophobicContact CB-CB 3.68Å; C276-C414 WeakPolarHBondContact CB-SG 3.42Å; C276-C414 VanDerWaalsContact SG-CA 3.55Å; C276-C414 WeakPolarHBondContact SG-CB 3.39Å; C276-C414 CovalentContact SG-SG 2.03Å; C276-C414 PolarHBondContact SG-SG 3.48Å
277	R	93	Very high	95.6	Very high	66 Å²	66	51 Å²	51	25%	0.249	24%	0.236	C	C	.	.			trans	-104.6	81	-178.8	-60.3	-157.1	-165.2	92.8	13.6	110.9	F274 W279 A280 K281 T334 D335	F274-R277 HydrophobicContact CB-CB 4.46Å; F274-R277 HydrophobicContact CD1-CB 4.38Å; F274-R277 CarbonylContact O-C 3.57Å; F274-R277 PolarHBondContact O-N 2.88Å; F274-R277 VanDerWaalsContact O-N 3.08Å; R277-W279 VanDerWaalsContact C-N 3.29Å; R277-W279 PolarHBondContact O-N 2.99Å; R277-A280 HydrophobicContact CB-CB 4.21Å; R277-A280 PolarHBondContact O-N 3.35Å; R277-A280 VanDerWaalsContact O-N 3.09Å; R277-K281 PolarHBondContact O-N 3.44Å; R277-K281 VanDerWaalsContact O-N 3.12Å; R277-T334 VanDerWaalsContact CZ-CB 3.41Å; R277-T334 PolarHBondContact NH1-OG1 3.34Å; R277-T334 PolarHBondContact NH2-O 3.25Å; R277-D335 IonicContact CZ-OD1 2.65Å; R277-D335 IonicContact CZ-OD2 3.66Å; R277-D335 VanDerWaalsContact CZ-OD2 3.31Å; R277-D335 IonicContact NH1-OD1 3.96Å; R277-D335 IonicContact NH1-OD2 3.52Å; R277-D335 PolarHBondContact NH1-OD2 3.1Å; R277-D335 IonicContact NH2-OD1 3.14Å; R277-D335 PolarHBondContact NH2-OD1 3.43Å; R277-D335 IonicContact NH2-OD2 2.65Å; R277-D335 PolarHBondContact NH2-OD2 2.96Å
278	R	94.2	Very high	95.6	Very high	190 Å²	190	49.7 Å²	49.7	72%	0.717	23%	0.228	S	C	*	.	H	α-helix	trans	-52.2	-42.4	-176.9	176.2	170.6	-83.6	144.2	-3.2	113.5	A280 I282	R278-A280 PolarHBondContact O-N 3.01Å; R278-I282 HydrophobicContact CG-CD1 3.69Å; R278-I282 HydrophobicContact CG-CG1 4.41Å; R278-I282 WeakPolarHBondContact O-CG1 3.37Å; R278-I282 PolarHBondContact O-N 2.87Å
279	W	96.1	Very high	95.7	Very high	157 Å²	157	51.7 Å²	51.7	60%	0.595	24%	0.244	S	C	*	.	H	α-helix	trans	-57.9	-49.9	178.2	175	99.8	0	0	0	111.5	R277 K281 I282 F283	R277-W279 VanDerWaalsContact C-N 3.29Å; R277-W279 PolarHBondContact O-N 2.99Å; W279-K281 PolarHBondContact O-N 3.44Å; W279-I282 PolarHBondContact O-N 2.68Å; W279-F283 HydrophobicContact CD2-CB 4.34Å; W279-F283 HydrophobicContact CE3-CB 4.33Å; W279-F283 HydrophobicContact CH2-CB 3.65Å; W279-F283 AromaticContact CH2-CD1 3.54Å; W279-F283 HydrophobicContact CH2-CD1 3.54Å; W279-F283 AromaticContact CH2-CD2 3.88Å; W279-F283 HydrophobicContact CH2-CD2 3.88Å; W279-F283 HydrophobicContact CH2-CE1 4.15Å; W279-F283 HydrophobicContact CH2-CE2 4.44Å; W279-F283 AromaticContact CH2-CG 3.39Å; W279-F283 HydrophobicContact CH2-CG 3.39Å; W279-F283 HydrophobicContact CZ2-CB 3.77Å; W279-F283 HydrophobicContact CZ2-CD1 4.18Å; W279-F283 AromaticContact CZ2-CD2 3.64Å; W279-F283 HydrophobicContact CZ2-CD2 3.64Å; W279-F283 HydrophobicContact CZ2-CE2 4.27Å; W279-F283 AromaticContact CZ2-CG 3.58Å; W279-F283 HydrophobicContact CZ2-CG 3.58Å; W279-F283 HydrophobicContact CZ3-CB 3.96Å; W279-F283 HydrophobicContact CZ3-CD1 4.19Å; W279-F283 HydrophobicContact CZ3-CG 4.13Å; W279-F283 VanDerWaalsContact O-CB 3.32Å; W279-F283 WeakPolarHBondContact O-CB 3.46Å; W279-F283 PolarHBondContact O-N 3.06Å
280	A	96.3	Very high	95.8	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.008	26%	0.263	C	S	.	.	H	α-helix	trans	-67.7	-42.2	-174.3	0	0	0	0	0	111	F274 R277 R278 I282 F283 Y284	F274-A280 HydrophobicContact CB-CB 4.17Å; F274-A280 HydrophobicContact CD1-CB 3.44Å; F274-A280 VanDerWaalsContact CD1-CB 3.44Å; F274-A280 HydrophobicContact CD2-CB 4.45Å; F274-A280 HydrophobicContact CE1-CB 3.86Å; F274-A280 HydrophobicContact CG-CB 3.77Å; R277-A280 HydrophobicContact CB-CB 4.21Å; R277-A280 PolarHBondContact O-N 3.35Å; R277-A280 VanDerWaalsContact O-N 3.09Å; R278-A280 PolarHBondContact O-N 3.01Å; A280-I282 PolarHBondContact O-N 3.47Å; A280-F283 PolarHBondContact O-N 3.5Å; A280-Y284 HydrophobicContact CB-CD2 4.29Å; A280-Y284 HydrophobicContact CB-CE2 4.29Å; A280-Y284 WeakPolarHBondContact O-CB 3.31Å; A280-Y284 WeakPolarHBondContact O-CD2 3.29Å; A280-Y284 PolarHBondContact O-N 2.93Å
281	K	95.1	Very high	95.9	Very high	34 Å²	34	56.7 Å²	56.7	15%	0.148	28%	0.275	C	S	.	.	H	α-helix	trans	-54.2	-50.7	173	-178.5	163.7	60.2	-163.6	0	111.9	F271 F274 Y275 R277 W279 T285	F271-K281 HydrophobicContact CB-CD 4.42Å; F271-K281 HydrophobicContact CD2-CD 3.86Å; F271-K281 HydrophobicContact CG-CD 4.43Å; F274-K281 HydrophobicContact CB-CB 3.89Å; Y275-K281 PolarHBondContact O-NZ 2.88Å; R277-K281 PolarHBondContact O-N 3.44Å; R277-K281 VanDerWaalsContact O-N 3.12Å; W279-K281 PolarHBondContact O-N 3.44Å; K281-T285 VanDerWaalsContact O-CB 3.22Å; K281-T285 WeakPolarHBondContact O-CB 3.35Å; K281-T285 PolarHBondContact O-N 3.44Å; K281-T285 VanDerWaalsContact O-N 3.14Å; K281-T285 PolarHBondContact O-OG1 3.21Å
282	I	97.4	Very high	96	Very high	97 Å²	97	55.9 Å²	55.9	50%	0.497	27%	0.272	S	S	.	.	H	α-helix	trans	-66.4	-50.6	-180	-67.7	170.3	0	0	0	110.4	R278 W279 A280 Y284 T285 T286	R278-I282 HydrophobicContact CG-CD1 3.69Å; R278-I282 HydrophobicContact CG-CG1 4.41Å; R278-I282 WeakPolarHBondContact O-CG1 3.37Å; R278-I282 PolarHBondContact O-N 2.87Å; W279-I282 PolarHBondContact O-N 2.68Å; A280-I282 PolarHBondContact O-N 3.47Å; I282-Y284 PolarHBondContact O-N 3.41Å; I282-T285 PolarHBondContact O-N 3Å; I282-T286 PolarHBondContact O-N 3.44Å; I282-T286 PolarHBondContact O-OG1 3.37Å; I282-T286 VanDerWaalsContact O-OG1 3.11Å
283	F	98.2	Very high	96.3	Very high	98 Å²	98	59.7 Å²	59.7	43%	0.43	30%	0.296	S	S	.	.	H	α-helix	trans	-56.5	-52.2	-176.8	178.3	-94.6	0	0	0	112	W279 A280 T285 T286 F287	W279-F283 HydrophobicContact CD2-CB 4.34Å; W279-F283 HydrophobicContact CE3-CB 4.33Å; W279-F283 HydrophobicContact CH2-CB 3.65Å; W279-F283 AromaticContact CH2-CD1 3.54Å; W279-F283 HydrophobicContact CH2-CD1 3.54Å; W279-F283 AromaticContact CH2-CD2 3.88Å; W279-F283 HydrophobicContact CH2-CD2 3.88Å; W279-F283 HydrophobicContact CH2-CE1 4.15Å; W279-F283 HydrophobicContact CH2-CE2 4.44Å; W279-F283 AromaticContact CH2-CG 3.39Å; W279-F283 HydrophobicContact CH2-CG 3.39Å; W279-F283 HydrophobicContact CZ2-CB 3.77Å; W279-F283 HydrophobicContact CZ2-CD1 4.18Å; W279-F283 AromaticContact CZ2-CD2 3.64Å; W279-F283 HydrophobicContact CZ2-CD2 3.64Å; W279-F283 HydrophobicContact CZ2-CE2 4.27Å; W279-F283 AromaticContact CZ2-CG 3.58Å; W279-F283 HydrophobicContact CZ2-CG 3.58Å; W279-F283 HydrophobicContact CZ3-CB 3.96Å; W279-F283 HydrophobicContact CZ3-CD1 4.19Å; W279-F283 HydrophobicContact CZ3-CG 4.13Å; W279-F283 VanDerWaalsContact O-CB 3.32Å; W279-F283 WeakPolarHBondContact O-CB 3.46Å; W279-F283 PolarHBondContact O-N 3.06Å; A280-F283 PolarHBondContact O-N 3.5Å; F283-T285 PolarHBondContact O-N 2.81Å; F283-T286 PolarHBondContact O-N 3.23Å; F283-F287 VanDerWaalsContact O-CB 3.31Å; F283-F287 WeakPolarHBondContact O-CB 3.38Å; F283-F287 PolarHBondContact O-N 2.93Å
284	Y	98.3	Very high	96.5	Very high	20 Å²	20	63.5 Å²	63.5	8%	0.078	31%	0.313	C	S	.	.	H	α-helix	trans	-71.1	-31.7	-178.2	-69.4	-56.8	0	0	0	113	F274 A280 I282 F287 I288 I326 P327 H330	F274-Y284 HydrophobicContact CD2-CD2 4.35Å; F274-Y284 AromaticContact CE2-CD2 3.83Å; F274-Y284 HydrophobicContact CE2-CD2 3.83Å; F274-Y284 HydrophobicContact CE2-CE2 4.16Å; F274-Y284 HydrophobicContact CZ-CD2 4.07Å; F274-Y284 AromaticContact CZ-CE2 3.92Å; F274-Y284 HydrophobicContact CZ-CE2 3.92Å; A280-Y284 HydrophobicContact CB-CD2 4.29Å; A280-Y284 HydrophobicContact CB-CE2 4.29Å; A280-Y284 WeakPolarHBondContact O-CB 3.31Å; A280-Y284 WeakPolarHBondContact O-CD2 3.29Å; A280-Y284 PolarHBondContact O-N 2.93Å; I282-Y284 PolarHBondContact O-N 3.41Å; Y284-F287 PolarHBondContact O-N 2.92Å; Y284-I288 WeakPolarHBondContact O-CG2 3.28Å; Y284-I288 PolarHBondContact O-N 2.97Å; Y284-I326 HydrophobicContact CE1-CG2 3.85Å; Y284-P327 HydrophobicContact CD1-CB 4.08Å; Y284-P327 HydrophobicContact CD1-CG 4.37Å; Y284-P327 HydrophobicContact CD2-CB 3.81Å; Y284-P327 HydrophobicContact CE1-CB 4.28Å; Y284-P327 HydrophobicContact CE2-CB 4.01Å; Y284-P327 HydrophobicContact CG-CB 3.86Å; Y284-P327 HydrophobicContact CG-CG 4.44Å; Y284-H330 HydrophobicContact CE2-CB 4.16Å; Y284-H330 AromaticContact CE2-ND1 3.4Å; Y284-H330 WeakPolarHBondContact CE2-ND1 3.04Å; Y284-H330 AromaticContact CZ-ND1 3.59Å; Y284-H330 WeakPolarHBondContact OH-CB 3.41Å; Y284-H330 PolarHBondContact OH-ND1 3.17Å
285	T	98.1	Very high	96.7	Very high	40 Å²	40	63.5 Å²	63.5	25%	0.245	31%	0.314	C	S	.	.	H	α-helix	trans	-67.3	-42.4	174.7	-57.7	0	0	0	0	110.9	V267 K281 I282 F283 I288 A289	V267-T285 HydrophobicContact CG2-CG2 4.4Å; K281-T285 VanDerWaalsContact O-CB 3.22Å; K281-T285 WeakPolarHBondContact O-CB 3.35Å; K281-T285 PolarHBondContact O-N 3.44Å; K281-T285 VanDerWaalsContact O-N 3.14Å; K281-T285 PolarHBondContact O-OG1 3.21Å; I282-T285 PolarHBondContact O-N 3Å; F283-T285 PolarHBondContact O-N 2.81Å; T285-I288 VanDerWaalsContact O-CG2 3.29Å; T285-I288 WeakPolarHBondContact O-CG2 3.09Å; T285-A289 WeakPolarHBondContact O-CB 3.41Å; T285-A289 PolarHBondContact O-N 2.96Å; T285-A289 VanDerWaalsContact O-N 3.1Å
286	T	98.2	Very high	96.9	Very high	82 Å²	82	62.6 Å²	62.6	50%	0.503	31%	0.312	S	S	.	.	H	α-helix	trans	-65.9	-41.8	173.7	-58.9	0	0	0	0	111.4	I282 F283 A289 V290	I282-T286 PolarHBondContact O-N 3.44Å; I282-T286 PolarHBondContact O-OG1 3.37Å; I282-T286 VanDerWaalsContact O-OG1 3.11Å; F283-T286 PolarHBondContact O-N 3.23Å; T286-A289 PolarHBondContact O-N 3.32Å; T286-V290 HydrophobicContact CG2-CG2 4.46Å; T286-V290 WeakPolarHBondContact O-CG2 3.45Å; T286-V290 PolarHBondContact O-N 2.72Å
287	F	98.2	Very high	97.3	Very high	68 Å²	68	63.4 Å²	63.4	30%	0.298	31%	0.311	S	S	.	.	H	α-helix	trans	-58.3	-51.2	178.1	175.8	-108.4	0	0	0	112.1	F283 Y284 A289 V290 L291 I326	F283-F287 VanDerWaalsContact O-CB 3.31Å; F283-F287 WeakPolarHBondContact O-CB 3.38Å; F283-F287 PolarHBondContact O-N 2.93Å; Y284-F287 PolarHBondContact O-N 2.92Å; F287-A289 VanDerWaalsContact C-N 3.32Å; F287-A289 PolarHBondContact O-N 3.04Å; F287-V290 PolarHBondContact O-N 2.9Å; F287-L291 HydrophobicContact CD1-CD1 4.15Å; F287-L291 HydrophobicContact CE1-CD1 3.54Å; F287-L291 HydrophobicContact CE1-CG 4.43Å; F287-L291 HydrophobicContact CE2-CD1 4.09Å; F287-L291 HydrophobicContact CE2-CG 4.29Å; F287-L291 HydrophobicContact CZ-CD1 3.51Å; F287-L291 HydrophobicContact CZ-CG 4.21Å; F287-L291 WeakPolarHBondContact O-CG 3.31Å; F287-L291 PolarHBondContact O-N 3.4Å; F287-I326 HydrophobicContact CE1-CD1 4.22Å; F287-I326 HydrophobicContact CZ-CD1 4.19Å
288	I	98.4	Very high	97.4	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-66.1	-35.2	178.6	-169.8	63.8	0	0	0	111.9	V263 F266 L270 Y284 T285 L291 G292 L320 S323	V263-I288 HydrophobicContact CG2-CG1 4.32Å; F266-I288 HydrophobicContact CB-CB 4.44Å; F266-I288 HydrophobicContact CB-CG1 4.07Å; F266-I288 HydrophobicContact CB-CG2 3.91Å; F266-I288 HydrophobicContact CD1-CB 3.91Å; F266-I288 HydrophobicContact CD1-CD1 3.99Å; F266-I288 HydrophobicContact CD1-CG1 3.67Å; F266-I288 HydrophobicContact CD1-CG2 4.17Å; F266-I288 HydrophobicContact CD2-CG1 4.29Å; F266-I288 HydrophobicContact CE1-CB 4.48Å; F266-I288 HydrophobicContact CE1-CD1 3.88Å; F266-I288 HydrophobicContact CE1-CG1 4.1Å; F266-I288 HydrophobicContact CE2-CD1 4.41Å; F266-I288 HydrophobicContact CG-CB 4.34Å; F266-I288 HydrophobicContact CG-CD1 4.3Å; F266-I288 HydrophobicContact CG-CG1 3.76Å; F266-I288 HydrophobicContact CG-CG2 4.34Å; F266-I288 HydrophobicContact CZ-CD1 4.09Å; L270-I288 HydrophobicContact CD1-CG2 4.39Å; Y284-I288 WeakPolarHBondContact O-CG2 3.28Å; Y284-I288 PolarHBondContact O-N 2.97Å; T285-I288 VanDerWaalsContact O-CG2 3.29Å; T285-I288 WeakPolarHBondContact O-CG2 3.09Å; I288-L291 PolarHBondContact O-N 3.31Å; I288-G292 PolarHBondContact O-N 3.5Å; I288-L320 HydrophobicContact CD1-CD1 3.73Å; I288-L320 HydrophobicContact CD1-CG 4.3Å; I288-S323 WeakPolarHBondContact CD1-OG 3.47Å
289	A	98.3	Very high	97.4	Very high	41 Å²	41	53.5 Å²	53.5	34%	0.339	28%	0.279	S	S	.	.	H	α-helix	trans	-62.2	-43.7	175.3	0	0	0	0	0	111.7	T285 T286 F287 G292 V293	T285-A289 WeakPolarHBondContact O-CB 3.41Å; T285-A289 PolarHBondContact O-N 2.96Å; T285-A289 VanDerWaalsContact O-N 3.1Å; T286-A289 PolarHBondContact O-N 3.32Å; F287-A289 VanDerWaalsContact C-N 3.32Å; F287-A289 PolarHBondContact O-N 3.04Å; A289-G292 PolarHBondContact O-N 2.9Å; A289-V293 WeakPolarHBondContact O-CG2 3.31Å; A289-V293 PolarHBondContact O-N 3.49Å
290	V	98.4	Very high	97.3	Very high	79 Å²	79	49.8 Å²	49.8	48%	0.479	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-47.2	176.1	171.1	0	0	0	0	111.2	T286 F287 G292 V293 I294	T286-V290 HydrophobicContact CG2-CG2 4.46Å; T286-V290 WeakPolarHBondContact O-CG2 3.45Å; T286-V290 PolarHBondContact O-N 2.72Å; F287-V290 PolarHBondContact O-N 2.9Å; V290-G292 VanDerWaalsContact C-N 3.28Å; V290-G292 PolarHBondContact O-N 2.76Å; V290-V293 PolarHBondContact O-N 2.97Å; V290-I294 HydrophobicContact CG1-CD1 4.07Å; V290-I294 WeakPolarHBondContact O-CG1 3.42Å; V290-I294 PolarHBondContact O-N 2.64Å
291	L	98.4	Very high	97.2	Very high	50 Å²	50	55.9 Å²	55.9	26%	0.262	30%	0.296	S	S	.	.	H	α-helix	trans	-61.1	-38.6	176	-68.2	-175.5	0	0	0	112.1	F287 I288 I294 S295 L320	F287-L291 HydrophobicContact CD1-CD1 4.15Å; F287-L291 HydrophobicContact CE1-CD1 3.54Å; F287-L291 HydrophobicContact CE1-CG 4.43Å; F287-L291 HydrophobicContact CE2-CD1 4.09Å; F287-L291 HydrophobicContact CE2-CG 4.29Å; F287-L291 HydrophobicContact CZ-CD1 3.51Å; F287-L291 HydrophobicContact CZ-CG 4.21Å; F287-L291 WeakPolarHBondContact O-CG 3.31Å; F287-L291 PolarHBondContact O-N 3.4Å; I288-L291 PolarHBondContact O-N 3.31Å; L291-I294 PolarHBondContact O-N 2.88Å; L291-S295 WeakPolarHBondContact O-CB 3.49Å; L291-S295 PolarHBondContact O-N 3.08Å; L291-L320 HydrophobicContact CB-CD1 3.51Å
292	G	98.3	Very high	96.9	Very high	2 Å²	2	57.6 Å²	57.6	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-62.4	-44	175.2	0	0	0	0	0	113	I288 A289 V290 I294 S295 I296	I288-G292 PolarHBondContact O-N 3.5Å; A289-G292 PolarHBondContact O-N 2.9Å; V290-G292 VanDerWaalsContact C-N 3.28Å; V290-G292 PolarHBondContact O-N 2.76Å; G292-I294 VanDerWaalsContact C-N 3.35Å; G292-I294 PolarHBondContact O-N 3.12Å; G292-S295 WeakPolarHBondContact O-CB 3.14Å; G292-S295 PolarHBondContact O-N 3.5Å; G292-I296 WeakPolarHBondContact O-CG1 3.42Å; G292-I296 PolarHBondContact O-N 3.43Å
293	V	98.1	Very high	96.7	Very high	82 Å²	82	62.2 Å²	62.2	50%	0.497	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-43	174.6	170.4	0	0	0	0	111	A289 V290 S295 I296 I297	A289-V293 WeakPolarHBondContact O-CG2 3.31Å; A289-V293 PolarHBondContact O-N 3.49Å; V290-V293 PolarHBondContact O-N 2.97Å; V293-S295 PolarHBondContact O-N 3.41Å; V293-I296 PolarHBondContact O-N 3.4Å; V293-I297 HydrophobicContact CG1-CD1 3.91Å; V293-I297 VanDerWaalsContact O-CG1 3.3Å; V293-I297 WeakPolarHBondContact O-CG1 3.44Å; V293-I297 PolarHBondContact O-N 2.95Å
294	I	97.9	Very high	96.4	Very high	90 Å²	90	58 Å²	58	46%	0.462	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-45.8	175.3	-66.2	166.2	0	0	0	110.5	V290 L291 G292 I296 I297 V298	V290-I294 HydrophobicContact CG1-CD1 4.07Å; V290-I294 WeakPolarHBondContact O-CG1 3.42Å; V290-I294 PolarHBondContact O-N 2.64Å; L291-I294 PolarHBondContact O-N 2.88Å; G292-I294 VanDerWaalsContact C-N 3.35Å; G292-I294 PolarHBondContact O-N 3.12Å; I294-I296 VanDerWaalsContact C-N 3.33Å; I294-I296 PolarHBondContact O-N 3.48Å; I294-I297 PolarHBondContact O-N 2.97Å; I294-V298 WeakPolarHBondContact O-CG2 3.39Å; I294-V298 PolarHBondContact O-N 3.28Å
295	S	97.6	Very high	95.9	Very high	5 Å²	5	58.7 Å²	58.7	4%	0.035	31%	0.308	C	S	.	.	H	α-helix	trans	-59.3	-41.9	176.4	-179.6	0	0	0	0	112.4	S259 L291 G292 V293 V298 S299	S259-S295 PolarHBondContact OG-OG 2.83Å; L291-S295 WeakPolarHBondContact O-CB 3.49Å; L291-S295 PolarHBondContact O-N 3.08Å; G292-S295 WeakPolarHBondContact O-CB 3.14Å; G292-S295 PolarHBondContact O-N 3.5Å; V293-S295 PolarHBondContact O-N 3.41Å; S295-V298 PolarHBondContact O-N 3.3Å; S295-S299 WeakPolarHBondContact O-CB 3.23Å; S295-S299 PolarHBondContact O-N 3.24Å; S295-S299 PolarHBondContact O-OG 3.44Å
296	I	97.3	Very high	95.5	Very high	39 Å²	39	61.3 Å²	61.3	20%	0.2	32%	0.317	C	S	.	.	H	α-helix	trans	-60.9	-50.7	174.1	-74.5	168.2	0	0	0	110.3	V256 L260 G292 V293 I294 V298 S299 L300	V256-I296 HydrophobicContact CG1-CD1 4.48Å; V256-I296 HydrophobicContact CG1-CG1 4.41Å; V256-I296 HydrophobicContact CG2-CG1 4.48Å; V256-I296 HydrophobicContact CG2-CG2 4.11Å; L260-I296 HydrophobicContact CD2-CD1 4.24Å; G292-I296 WeakPolarHBondContact O-CG1 3.42Å; G292-I296 PolarHBondContact O-N 3.43Å; V293-I296 PolarHBondContact O-N 3.4Å; I294-I296 VanDerWaalsContact C-N 3.33Å; I294-I296 PolarHBondContact O-N 3.48Å; I296-V298 VanDerWaalsContact C-N 3.29Å; I296-V298 PolarHBondContact O-N 2.94Å; I296-S299 WeakPolarHBondContact O-CA 3.4Å; I296-S299 WeakPolarHBondContact O-CB 3.17Å; I296-S299 PolarHBondContact O-N 2.93Å; I296-L300 HydrophobicContact CG2-CD1 4.23Å; I296-L300 WeakPolarHBondContact O-CG 3.26Å; I296-L300 PolarHBondContact O-N 3.26Å; I296-L300 VanDerWaalsContact O-N 3.07Å
297	I	96.8	Very high	95.1	Very high	90 Å²	90	60.1 Å²	60.1	46%	0.462	31%	0.311	S	S	.	.	H	α-helix	trans	-57.2	-44.7	179.2	-67.9	164.8	0	0	0	110.8	V293 I294 S299 L300 F301	V293-I297 HydrophobicContact CG1-CD1 3.91Å; V293-I297 VanDerWaalsContact O-CG1 3.3Å; V293-I297 WeakPolarHBondContact O-CG1 3.44Å; V293-I297 PolarHBondContact O-N 2.95Å; I294-I297 PolarHBondContact O-N 2.97Å; I297-S299 VanDerWaalsContact C-N 3.3Å; I297-S299 PolarHBondContact O-N 2.93Å; I297-L300 PolarHBondContact O-N 2.89Å; I297-F301 HydrophobicContact CG2-CE2 4.49Å
298	V	95.9	Very high	94.8	Very high	46 Å²	46	64 Å²	64	28%	0.279	33%	0.327	S	S	.	.	H	α-helix	trans	-60.6	-41.8	176.2	171.4	0	0	0	0	111.3	I294 S295 I296 L300 F301 F304	I294-V298 WeakPolarHBondContact O-CG2 3.39Å; I294-V298 PolarHBondContact O-N 3.28Å; S295-V298 PolarHBondContact O-N 3.3Å; I296-V298 VanDerWaalsContact C-N 3.29Å; I296-V298 PolarHBondContact O-N 2.94Å; V298-L300 PolarHBondContact O-N 3.32Å; V298-F301 WeakPolarHBondContact O-CD2 3.17Å; V298-F301 PolarHBondContact O-N 3.41Å; V298-F304 HydrophobicContact CG1-CD2 3.99Å; V298-F304 HydrophobicContact CG1-CE2 3.84Å; V298-F304 HydrophobicContact CG1-CZ 4.34Å
299	S	93.3	Very high	94.5	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.007	34%	0.339	C	S	.	.	H	α-helix	trans	-66.5	-22	180	-61.8	0	0	0	0	113.8	S295 I296 I297	S295-S299 WeakPolarHBondContact O-CB 3.23Å; S295-S299 PolarHBondContact O-N 3.24Å; S295-S299 PolarHBondContact O-OG 3.44Å; I296-S299 WeakPolarHBondContact O-CA 3.4Å; I296-S299 WeakPolarHBondContact O-CB 3.17Å; I296-S299 PolarHBondContact O-N 2.93Å; I297-S299 VanDerWaalsContact C-N 3.3Å; I297-S299 PolarHBondContact O-N 2.93Å
300	L	94.4	Very high	94.3	Very high	80 Å²	80	64.9 Å²	64.9	42%	0.419	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.9	178.9	-66.4	176.6	0	0	0	113.8	K252 V256 I296 I297 V298	K252-L300 HydrophobicContact CB-CD2 4.1Å; K252-L300 HydrophobicContact CD-CD2 4.26Å; K252-L300 VanDerWaalsContact CE-O 3.24Å; K252-L300 WeakPolarHBondContact CE-O 3.34Å; K252-L300 HydrophobicContact CG-CD2 4.45Å; K252-L300 PolarHBondContact NZ-O 3.3Å; V256-L300 HydrophobicContact CG2-CD2 4.13Å; I296-L300 HydrophobicContact CG2-CD1 4.23Å; I296-L300 WeakPolarHBondContact O-CG 3.26Å; I296-L300 PolarHBondContact O-N 3.26Å; I296-L300 VanDerWaalsContact O-N 3.07Å; I297-L300 PolarHBondContact O-N 2.89Å; V298-L300 PolarHBondContact O-N 3.32Å
301	F	94.1	Very high	94.1	Very high	128 Å²	128	64.1 Å²	64.1	56%	0.561	32%	0.321	S	S	*	.	S	Bend	trans	-71.1	127.8	175.3	-70.9	-60.1	0	0	0	111.7	I297 V298 R303 F304	I297-F301 HydrophobicContact CG2-CE2 4.49Å; V298-F301 WeakPolarHBondContact O-CD2 3.17Å; V298-F301 PolarHBondContact O-N 3.41Å; F301-R303 PolarHBondContact O-N 2.94Å; F301-F304 VanDerWaalsContact O-CB 3.24Å; F301-F304 WeakPolarHBondContact O-CB 3.19Å; F301-F304 PolarHBondContact O-N 3.14Å
302	D	90.4	Very high	93.9	Very high	70 Å²	70	64.7 Å²	64.7	37%	0.374	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-53.6	-33.8	177.8	-81.7	22	0	0	0	113	K248 K252 F304 S305 H306	K248-D302 IonicContact NZ-OD2 3.33Å; K248-D302 PolarHBondContact NZ-OD2 3.13Å; K252-D302 VanDerWaalsContact CE-OD1 3.26Å; K252-D302 WeakPolarHBondContact CE-OD1 3.36Å; K252-D302 IonicContact NZ-OD1 2.77Å; K252-D302 PolarHBondContact NZ-OD1 3.04Å; D302-F304 PolarHBondContact O-N 2.77Å; D302-S305 PolarHBondContact O-N 3.03Å; D302-S305 PolarHBondContact O-OG 2.92Å; D302-H306 PolarHBondContact O-CD2 3.07Å
303	R	91.6	Very high	93.8	Very high	194 Å²	194	64.8 Å²	64.8	73%	0.732	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-63.8	-30	178.9	-68.4	-175.1	-178.8	175.3	1.8	112.5	F301 S305 H306 H309	F301-R303 PolarHBondContact O-N 2.94Å; R303-S305 VanDerWaalsContact C-N 3.27Å; R303-S305 PolarHBondContact O-N 2.94Å; R303-H306 PolarHBondContact O-N 3.42Å; R303-H309 PolarHBondContact O-CD2 2.65Å
304	F	91.8	Very high	93.7	Very high	11 Å²	11	61.4 Å²	61.4	5%	0.048	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-66.8	-28	-175	-166.9	-111.9	0	0	0	112.8	Y255 V298 F301 D302 R313 V316 F317	Y255-F304 AromaticContact CD2-CD1 3.72Å; Y255-F304 HydrophobicContact CD2-CD1 3.72Å; Y255-F304 HydrophobicContact CD2-CE1 4.08Å; Y255-F304 AromaticContact CE2-CD1 3.96Å; Y255-F304 HydrophobicContact CE2-CD1 3.96Å; Y255-F304 HydrophobicContact CG-CD1 4.43Å; Y255-F304 HydrophobicContact CG-CE1 4.35Å; V298-F304 HydrophobicContact CG1-CD2 3.99Å; V298-F304 HydrophobicContact CG1-CE2 3.84Å; V298-F304 HydrophobicContact CG1-CZ 4.34Å; F301-F304 VanDerWaalsContact O-CB 3.24Å; F301-F304 WeakPolarHBondContact O-CB 3.19Å; F301-F304 PolarHBondContact O-N 3.14Å; D302-F304 PolarHBondContact O-N 2.77Å; F304-R313 HydrophobicContact CD1-CG 3.87Å; F304-R313 HydrophobicContact CD2-CG 4.12Å; F304-R313 HydrophobicContact CE1-CB 4.12Å; F304-R313 HydrophobicContact CE1-CG 3.54Å; F304-R313 HydrophobicContact CE2-CB 4.3Å; F304-R313 HydrophobicContact CE2-CG 3.79Å; F304-R313 HydrophobicContact CG-CG 4.17Å; F304-R313 HydrophobicContact CZ-CB 3.82Å; F304-R313 HydrophobicContact CZ-CG 3.52Å; F304-R313 WeakPolarHBondContact O-CD 3.33Å; F304-R313 PolarHBondContact O-NH1 3.34Å; F304-V316 HydrophobicContact CE2-CG2 4.13Å; F304-V316 HydrophobicContact CZ-CB 4.3Å; F304-V316 HydrophobicContact CZ-CG1 4.47Å; F304-V316 HydrophobicContact CZ-CG2 4.4Å; F304-F317 HydrophobicContact CE1-CE2 4.17Å; F304-F317 AromaticContact CE1-CZ 3.97Å; F304-F317 HydrophobicContact CE1-CZ 3.97Å; F304-F317 HydrophobicContact CZ-CE2 4.32Å; F304-F317 HydrophobicContact CZ-CZ 4.26Å
305	S	89.2	Confident	93.6	Very high	33 Å²	33	62.3 Å²	62.3	23%	0.231	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-78.4	-16.5	178.2	66.1	0	0	0	0	113.9	D302 R303 R313	D302-S305 PolarHBondContact O-N 3.03Å; D302-S305 PolarHBondContact O-OG 2.92Å; R303-S305 VanDerWaalsContact C-N 3.27Å; R303-S305 PolarHBondContact O-N 2.94Å; S305-R313 PolarHBondContact O-NH1 3.47Å
306	H	89.7	Confident	93.6	Very high	96 Å²	96	63.9 Å²	63.9	44%	0.444	32%	0.321	S	S	.	.	S	Bend	trans	-60.1	141.8	179.7	-78.7	-105.3	0	0	0	111.4	D302 R303 K308 H309 R313	D302-H306 PolarHBondContact O-CD2 3.07Å; R303-H306 PolarHBondContact O-N 3.42Å; H306-K308 HydrophobicContact CB-CG 3.99Å; H306-K308 PolarHBondContact O-N 2.65Å; H306-K308 VanDerWaalsContact O-N 3.1Å; H306-H309 PolarHBondContact O-N 3.09Å; H306-R313 PolarHBondContact O-NH1 3.32Å; H306-R313 VanDerWaalsContact O-NH1 3.14Å
307	P	88.2	Confident	93.6	Very high	57 Å²	57	63 Å²	63	37%	0.37	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-55.4	-34	-177.8	-29.4	36.2	0	0	0	114	H309 R310	P307-H309 PolarHBondContact O-N 2.85Å; P307-H309 VanDerWaalsContact O-N 3.13Å; P307-R310 VanDerWaalsContact O-CB 3.24Å; P307-R310 WeakPolarHBondContact O-CB 3.39Å; P307-R310 PolarHBondContact O-N 3.14Å
308	K	92.1	Very high	93.6	Very high	148 Å²	148	60.4 Å²	60.4	64%	0.643	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-57.3	-25.9	176.1	68.3	179	174.3	169.5	0	114.2	H306	H306-K308 HydrophobicContact CB-CG 3.99Å; H306-K308 PolarHBondContact O-N 2.65Å; H306-K308 VanDerWaalsContact O-N 3.1Å
309	H	93.4	Very high	93.7	Very high	54 Å²	54	61.4 Å²	61.4	25%	0.25	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-94.9	7.9	-179.1	-72	-63.9	0	0	0	112.9	R303 H306 P307 T312 R313	R303-H309 PolarHBondContact O-CD2 2.65Å; H306-H309 PolarHBondContact O-N 3.09Å; P307-H309 PolarHBondContact O-N 2.85Å; P307-H309 VanDerWaalsContact O-N 3.13Å; H309-T312 CarbonylContact O-C 3.51Å; H309-T312 WeakPolarHBondContact O-CA 3.43Å; H309-T312 VanDerWaalsContact O-CB 3.25Å; H309-T312 WeakPolarHBondContact O-CB 3.37Å; H309-T312 PolarHBondContact O-N 3.12Å; H309-R313 WeakPolarHBondContact O-CG 3.38Å; H309-R313 PolarHBondContact O-N 3.33Å
310	R	92.8	Very high	94	Very high	7 Å²	7	61.8 Å²	61.8	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-50.5	-47.6	176.5	-175.3	-170.3	-57.5	-138.3	-2.1	113.6	D154 P307 T312 R313 A314 Y363	D154-R310 PolarHBondContact O-NH2 3.46Å; D154-R310 IonicContact OD1-NH2 3.56Å; D154-R310 PolarHBondContact OD1-NH2 3.1Å; D154-R310 VanDerWaalsContact OD1-NH2 3.14Å; D154-R310 IonicContact OD2-CZ 3.59Å; D154-R310 IonicContact OD2-NH1 2.7Å; D154-R310 IonicContact OD2-NH2 2.84Å; D154-R310 PolarHBondContact OD2-NH2 3.36Å; P307-R310 VanDerWaalsContact O-CB 3.24Å; P307-R310 WeakPolarHBondContact O-CB 3.39Å; P307-R310 PolarHBondContact O-N 3.14Å; R310-T312 VanDerWaalsContact C-N 3.33Å; R310-T312 PolarHBondContact O-N 3.48Å; R310-R313 PolarHBondContact O-N 2.85Å; R310-A314 PolarHBondContact O-N 3.16Å; R310-Y363 WeakPolarHBondContact CD-O 3.46Å; R310-Y363 HydrophobicContact CG-CD1 4.04Å; R310-Y363 HydrophobicContact CG-CE1 3.39Å; R310-Y363 HydrophobicContact CG-CE2 4.48Å
311	P	94.2	Very high	94.1	Very high	64 Å²	64	59.5 Å²	59.5	42%	0.416	31%	0.311	S	S	.	.	H	α-helix	trans	-66.2	-36	175.5	-19.7	33.9	0	0	0	112.4	R313 A314 I315	P311-R313 VanDerWaalsContact C-N 3.33Å; P311-R313 PolarHBondContact O-N 2.9Å; P311-A314 PolarHBondContact O-N 3.31Å; P311-I315 VanDerWaalsContact O-CG1 3.29Å; P311-I315 WeakPolarHBondContact O-CG1 3.19Å; P311-I315 PolarHBondContact O-N 2.84Å
312	T	95.3	Very high	94.2	Very high	62 Å²	62	57.2 Å²	57.2	38%	0.38	30%	0.304	S	S	.	.	H	α-helix	trans	-60.6	-43	175.5	-48.5	0	0	0	0	111.2	H309 R310 I315 V316	H309-T312 CarbonylContact O-C 3.51Å; H309-T312 WeakPolarHBondContact O-CA 3.43Å; H309-T312 VanDerWaalsContact O-CB 3.25Å; H309-T312 WeakPolarHBondContact O-CB 3.37Å; H309-T312 PolarHBondContact O-N 3.12Å; R310-T312 VanDerWaalsContact C-N 3.33Å; R310-T312 PolarHBondContact O-N 3.48Å; T312-I315 PolarHBondContact O-N 3.48Å; T312-V316 WeakPolarHBondContact O-CG2 3.36Å; T312-V316 PolarHBondContact O-N 2.85Å
313	R	96	Very high	94.5	Very high	3 Å²	3	54.6 Å²	54.6	1%	0.011	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-49.1	175.6	-60.7	-163.8	-71.6	-89.7	5.6	111.6	Y255 F304 S305 H306 H309 R310 P311 I315 V316 F317 Y363	Y255-R313 VanDerWaalsContact CZ-CD 3.47Å; Y255-R313 PolarHBondContact OH-NE 3.24Å; F304-R313 HydrophobicContact CD1-CG 3.87Å; F304-R313 HydrophobicContact CD2-CG 4.12Å; F304-R313 HydrophobicContact CE1-CB 4.12Å; F304-R313 HydrophobicContact CE1-CG 3.54Å; F304-R313 HydrophobicContact CE2-CB 4.3Å; F304-R313 HydrophobicContact CE2-CG 3.79Å; F304-R313 HydrophobicContact CG-CG 4.17Å; F304-R313 HydrophobicContact CZ-CB 3.82Å; F304-R313 HydrophobicContact CZ-CG 3.52Å; F304-R313 WeakPolarHBondContact O-CD 3.33Å; F304-R313 PolarHBondContact O-NH1 3.34Å; S305-R313 PolarHBondContact O-NH1 3.47Å; H306-R313 PolarHBondContact O-NH1 3.32Å; H306-R313 VanDerWaalsContact O-NH1 3.14Å; H309-R313 WeakPolarHBondContact O-CG 3.38Å; H309-R313 PolarHBondContact O-N 3.33Å; R310-R313 PolarHBondContact O-N 2.85Å; P311-R313 VanDerWaalsContact C-N 3.33Å; P311-R313 PolarHBondContact O-N 2.9Å; R313-I315 VanDerWaalsContact C-N 3.33Å; R313-I315 PolarHBondContact O-N 3.43Å; R313-V316 PolarHBondContact O-N 3.24Å; R313-F317 HydrophobicContact CB-CE2 4.29Å; R313-F317 WeakPolarHBondContact O-CD2 3.27Å; R313-F317 PolarHBondContact O-N 2.99Å; R313-F317 VanDerWaalsContact O-N 3.12Å; R313-Y363 PolarHBondContact NE-OH 2.95Å; R313-Y363 VanDerWaalsContact NE-OH 3.16Å; R313-Y363 PolarHBondContact NH2-OH 3.39Å
314	A	95.3	Very high	94.7	Very high	12 Å²	12	45.7 Å²	45.7	10%	0.099	26%	0.26	C	S	.	.	H	α-helix	trans	-57.8	-45.5	177.3	0	0	0	0	0	111.5	R310 P311 V316 F317 V318 Y363 A364	R310-A314 PolarHBondContact O-N 3.16Å; P311-A314 PolarHBondContact O-N 3.31Å; A314-V316 PolarHBondContact O-N 3.05Å; A314-F317 PolarHBondContact O-N 3.02Å; A314-V318 WeakPolarHBondContact O-CB 3.23Å; A314-V318 WeakPolarHBondContact O-CG2 3.42Å; A314-V318 PolarHBondContact O-N 3.34Å; A314-Y363 HydrophobicContact CB-CD1 4.48Å; A314-A364 HydrophobicContact CB-CB 3.92Å
315	I	96.5	Very high	94.9	Very high	108 Å²	108	48.8 Å²	48.8	55%	0.554	28%	0.28	S	S	*	.	H	α-helix	trans	-60.5	-44.9	177.9	-69.4	164.2	0	0	0	111.5	P311 T312 R313 S319	P311-I315 VanDerWaalsContact O-CG1 3.29Å; P311-I315 WeakPolarHBondContact O-CG1 3.19Å; P311-I315 PolarHBondContact O-N 2.84Å; T312-I315 PolarHBondContact O-N 3.48Å; R313-I315 VanDerWaalsContact C-N 3.33Å; R313-I315 PolarHBondContact O-N 3.43Å; I315-S319 WeakPolarHBondContact O-CB 3.36Å; I315-S319 PolarHBondContact O-N 2.79Å; I315-S319 PolarHBondContact O-OG 3.46Å
316	V	97.2	Very high	95.3	Very high	38 Å²	38	51.3 Å²	51.3	23%	0.23	29%	0.29	C	S	.	.	H	α-helix	trans	-60.1	-51.6	-180	169	0	0	0	0	111	F304 T312 R313 A314 S319 L320	F304-V316 HydrophobicContact CE2-CG2 4.13Å; F304-V316 HydrophobicContact CZ-CB 4.3Å; F304-V316 HydrophobicContact CZ-CG1 4.47Å; F304-V316 HydrophobicContact CZ-CG2 4.4Å; T312-V316 WeakPolarHBondContact O-CG2 3.36Å; T312-V316 PolarHBondContact O-N 2.85Å; R313-V316 PolarHBondContact O-N 3.24Å; A314-V316 PolarHBondContact O-N 3.05Å; V316-S319 PolarHBondContact O-N 2.75Å; V316-L320 PolarHBondContact O-N 2.96Å
317	F	97.8	Very high	95.6	Very high	20 Å²	20	46.9 Å²	46.9	9%	0.088	27%	0.269	C	S	.	.	H	α-helix	trans	-72.3	-38.2	-176.9	-60.8	-51.2	0	0	0	113.1	I258 S259 I262 F304 R313 A314 S319 L320 G321	I258-F317 HydrophobicContact CB-CD1 4.2Å; I258-F317 HydrophobicContact CB-CE1 4.18Å; I258-F317 HydrophobicContact CB-CG 4.4Å; I258-F317 HydrophobicContact CB-CZ 4.33Å; I258-F317 HydrophobicContact CD1-CD2 3.99Å; I258-F317 HydrophobicContact CD1-CE2 3.79Å; I258-F317 HydrophobicContact CD1-CZ 4.29Å; I258-F317 HydrophobicContact CG2-CB 3.93Å; I258-F317 HydrophobicContact CG2-CD1 3.65Å; I258-F317 HydrophobicContact CG2-CD2 4.01Å; I258-F317 HydrophobicContact CG2-CE1 4.14Å; I258-F317 HydrophobicContact CG2-CE2 4.45Å; I258-F317 HydrophobicContact CG2-CG 3.59Å; S259-F317 WeakPolarHBondContact OG-CE1 3.25Å; I262-F317 HydrophobicContact CD1-CB 4.26Å; F304-F317 HydrophobicContact CE1-CE2 4.17Å; F304-F317 AromaticContact CE1-CZ 3.97Å; F304-F317 HydrophobicContact CE1-CZ 3.97Å; F304-F317 HydrophobicContact CZ-CE2 4.32Å; F304-F317 HydrophobicContact CZ-CZ 4.26Å; R313-F317 HydrophobicContact CB-CE2 4.29Å; R313-F317 WeakPolarHBondContact O-CD2 3.27Å; R313-F317 PolarHBondContact O-N 2.99Å; R313-F317 VanDerWaalsContact O-N 3.12Å; A314-F317 PolarHBondContact O-N 3.02Å; F317-S319 VanDerWaalsContact C-N 3.33Å; F317-L320 PolarHBondContact O-N 3.41Å; F317-G321 PolarHBondContact O-N 3.35Å
318	V	97.6	Very high	95.9	Very high	37 Å²	37	44.8 Å²	44.8	22%	0.224	26%	0.256	C	S	.	.	H	α-helix	trans	-64	-40.7	173.8	171	0	0	0	0	110.5	A314 L320 G321 L322 I357 A360	A314-V318 WeakPolarHBondContact O-CB 3.23Å; A314-V318 WeakPolarHBondContact O-CG2 3.42Å; A314-V318 PolarHBondContact O-N 3.34Å; V318-L320 VanDerWaalsContact C-N 3.34Å; V318-L320 PolarHBondContact O-N 3.09Å; V318-G321 PolarHBondContact O-N 3.3Å; V318-L322 HydrophobicContact CG1-CD1 3.7Å; V318-L322 HydrophobicContact CG1-CG 4.07Å; V318-L322 WeakPolarHBondContact O-CB 3.3Å; V318-L322 VanDerWaalsContact O-CG 3.31Å; V318-L322 WeakPolarHBondContact O-CG 3.24Å; V318-L322 PolarHBondContact O-N 3.18Å; V318-I357 HydrophobicContact CG1-CG1 4.34Å; V318-A360 HydrophobicContact CG2-CB 3.51Å
319	S	97.6	Very high	96.1	Very high	67 Å²	67	42.3 Å²	42.3	47%	0.469	25%	0.249	S	C	.	.	H	α-helix	trans	-64.7	-39	176.4	-58.6	0	0	0	0	112	I315 V316 F317 L322 S323	I315-S319 WeakPolarHBondContact O-CB 3.36Å; I315-S319 PolarHBondContact O-N 2.79Å; I315-S319 PolarHBondContact O-OG 3.46Å; V316-S319 PolarHBondContact O-N 2.75Å; F317-S319 VanDerWaalsContact C-N 3.33Å; S319-L322 PolarHBondContact O-N 3.45Å; S319-S323 PolarHBondContact O-N 3.43Å
320	L	98	Very high	96.2	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.042	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-47.4	174.5	-175.8	63.9	0	0	0	110.9	I262 I288 L291 V316 F317 V318 S323	I262-L320 HydrophobicContact CB-CD2 4.06Å; I262-L320 HydrophobicContact CB-CG 4.36Å; I262-L320 HydrophobicContact CD1-CB 4.33Å; I262-L320 HydrophobicContact CD1-CD2 3.97Å; I262-L320 HydrophobicContact CD1-CG 4.33Å; I262-L320 HydrophobicContact CG2-CD2 4.03Å; I262-L320 HydrophobicContact CG2-CG 3.77Å; I288-L320 HydrophobicContact CD1-CD1 3.73Å; I288-L320 HydrophobicContact CD1-CG 4.3Å; L291-L320 HydrophobicContact CB-CD1 3.51Å; V316-L320 PolarHBondContact O-N 2.96Å; F317-L320 PolarHBondContact O-N 3.41Å; V318-L320 VanDerWaalsContact C-N 3.34Å; V318-L320 PolarHBondContact O-N 3.09Å; L320-S323 WeakPolarHBondContact O-CB 3.41Å; L320-S323 PolarHBondContact O-N 3.17Å; L320-S323 PolarHBondContact O-OG 3.47Å
321	G	97.1	Very high	96.3	Very high	32 Å²	32	42.1 Å²	42.1	33%	0.33	25%	0.248	S	C	.	.	H	α-helix	trans	-62.4	-45.4	174.4	0	0	0	0	0	113.4	F317 V318 S323 G324	F317-G321 PolarHBondContact O-N 3.35Å; V318-G321 PolarHBondContact O-N 3.3Å; G321-S323 PolarHBondContact O-N 3.45Å; G321-G324 PolarHBondContact O-N 2.83Å; G321-G324 VanDerWaalsContact O-N 3.13Å
322	L	96.6	Very high	96.4	Very high	81 Å²	81	41.6 Å²	41.6	42%	0.424	24%	0.239	S	C	.	.	H	α-helix	trans	-68.3	-14.7	179.7	-74.6	179.4	0	0	0	113.9	V318 S319 G324 V325 I357	V318-L322 HydrophobicContact CG1-CD1 3.7Å; V318-L322 HydrophobicContact CG1-CG 4.07Å; V318-L322 WeakPolarHBondContact O-CB 3.3Å; V318-L322 VanDerWaalsContact O-CG 3.31Å; V318-L322 WeakPolarHBondContact O-CG 3.24Å; V318-L322 PolarHBondContact O-N 3.18Å; S319-L322 PolarHBondContact O-N 3.45Å; L322-G324 PolarHBondContact O-N 3.46Å; L322-G324 VanDerWaalsContact O-N 3.09Å; L322-V325 HydrophobicContact CD2-CG2 4.32Å; L322-V325 VanDerWaalsContact O-CB 3.29Å; L322-V325 WeakPolarHBondContact O-CB 3.33Å; L322-V325 VanDerWaalsContact O-CG2 3.25Å; L322-V325 WeakPolarHBondContact O-CG2 3.26Å; L322-V325 PolarHBondContact O-N 3.41Å; L322-I357 HydrophobicContact CD2-CD1 3.96Å
323	S	97.3	Very high	96.4	Very high	14 Å²	14	44.4 Å²	44.4	10%	0.098	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.5	169.6	78.9	0	0	0	0	112.5	I288 S319 L320 G321 V325 I326 P327	I288-S323 WeakPolarHBondContact CD1-OG 3.47Å; S319-S323 PolarHBondContact O-N 3.43Å; L320-S323 WeakPolarHBondContact O-CB 3.41Å; L320-S323 PolarHBondContact O-N 3.17Å; L320-S323 PolarHBondContact O-OG 3.47Å; G321-S323 PolarHBondContact O-N 3.45Å; S323-V325 PolarHBondContact O-N 2.91Å; S323-I326 PolarHBondContact O-N 3Å; S323-P327 VanDerWaalsContact O-CD 3.29Å; S323-P327 WeakPolarHBondContact O-CD 3.43Å
324	G	95.6	Very high	96.2	Very high	8 Å²	8	47 Å²	47	8%	0.082	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-16	172.3	0	0	0	0	0	114.7	G321 L322 I326 P327 C328	G321-G324 PolarHBondContact O-N 2.83Å; G321-G324 VanDerWaalsContact O-N 3.13Å; L322-G324 PolarHBondContact O-N 3.46Å; L322-G324 VanDerWaalsContact O-N 3.09Å; G324-I326 PolarHBondContact O-N 3.44Å; G324-P327 VanDerWaalsContact O-CD 3.29Å; G324-P327 WeakPolarHBondContact O-CD 3.34Å; G324-P327 VanDerWaalsContact O-CG 3.32Å; G324-P327 WeakPolarHBondContact O-CG 3.37Å; G324-C328 VanDerWaalsContact O-CB 3.27Å; G324-C328 WeakPolarHBondContact O-CB 3.39Å; G324-C328 PolarHBondContact O-N 2.76Å; G324-C328 VanDerWaalsContact O-N 3.12Å
325	V	95.5	Very high	96.1	Very high	76 Å²	76	49.2 Å²	49.2	46%	0.461	28%	0.282	S	S	.	.	H	α-helix	trans	-60.8	-34.1	171.9	174.2	0	0	0	0	110.9	L322 S323 C328 I329	L322-V325 HydrophobicContact CD2-CG2 4.32Å; L322-V325 VanDerWaalsContact O-CB 3.29Å; L322-V325 WeakPolarHBondContact O-CB 3.33Å; L322-V325 VanDerWaalsContact O-CG2 3.25Å; L322-V325 WeakPolarHBondContact O-CG2 3.26Å; L322-V325 PolarHBondContact O-N 3.41Å; S323-V325 PolarHBondContact O-N 2.91Å; V325-C328 WeakPolarHBondContact O-CB 3.41Å; V325-C328 PolarHBondContact O-N 3.04Å; V325-I329 HydrophobicContact CG1-CD1 3.73Å; V325-I329 HydrophobicContact CG1-CG1 4.23Å; V325-I329 VanDerWaalsContact O-CG1 3.3Å; V325-I329 WeakPolarHBondContact O-CG1 3.32Å; V325-I329 PolarHBondContact O-N 3.41Å
326	I	96.8	Very high	95.9	Very high	86 Å²	86	45.4 Å²	45.4	44%	0.441	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-57.4	-179.7	-56.2	172.5	0	0	0	112	Y284 F287 S323 G324 C328 I329 H330	Y284-I326 HydrophobicContact CE1-CG2 3.85Å; F287-I326 HydrophobicContact CE1-CD1 4.22Å; F287-I326 HydrophobicContact CZ-CD1 4.19Å; S323-I326 PolarHBondContact O-N 3Å; G324-I326 PolarHBondContact O-N 3.44Å; I326-C328 PolarHBondContact O-N 3.17Å; I326-I329 PolarHBondContact O-N 2.94Å; I326-H330 PolarHBondContact O-N 2.92Å
327	P	96.2	Very high	95.6	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.019	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-30.5	174.8	19.6	-29.3	0	0	0	112.6	W269 L270 F274 Y284 S323 G324 H330 Y331	W269-P327 HydrophobicContact CH2-CB 4.25Å; W269-P327 HydrophobicContact CH2-CG 3.87Å; W269-P327 HydrophobicContact CZ3-CB 4.34Å; W269-P327 HydrophobicContact CZ3-CG 3.76Å; L270-P327 HydrophobicContact CD2-CB 3.78Å; L270-P327 HydrophobicContact CD2-CG 4.09Å; F274-P327 HydrophobicContact CE2-CB 3.81Å; F274-P327 HydrophobicContact CZ-CB 4.19Å; F274-P327 WeakPolarHBondContact CZ-O 3.43Å; Y284-P327 HydrophobicContact CD1-CB 4.08Å; Y284-P327 HydrophobicContact CD1-CG 4.37Å; Y284-P327 HydrophobicContact CD2-CB 3.81Å; Y284-P327 HydrophobicContact CE1-CB 4.28Å; Y284-P327 HydrophobicContact CE2-CB 4.01Å; Y284-P327 HydrophobicContact CG-CB 3.86Å; Y284-P327 HydrophobicContact CG-CG 4.44Å; S323-P327 VanDerWaalsContact O-CD 3.29Å; S323-P327 WeakPolarHBondContact O-CD 3.43Å; G324-P327 VanDerWaalsContact O-CD 3.29Å; G324-P327 WeakPolarHBondContact O-CD 3.34Å; G324-P327 VanDerWaalsContact O-CG 3.32Å; G324-P327 WeakPolarHBondContact O-CG 3.37Å; P327-H330 WeakPolarHBondContact O-CB 3.38Å; P327-H330 PolarHBondContact O-N 3.02Å; P327-Y331 WeakPolarHBondContact O-CB 3.15Å; P327-Y331 PolarHBondContact O-N 3.44Å
328	C	94.9	Very high	95.4	Very high	13 Å²	13	53.6 Å²	53.6	9%	0.088	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-46.3	175.1	-177.1	0	0	0	0	112.3	W269 G324 V325 I326 H330 Y331 F332 F346	W269-C328 HydrophobicContact CH2-CB 4.38Å; G324-C328 VanDerWaalsContact O-CB 3.27Å; G324-C328 WeakPolarHBondContact O-CB 3.39Å; G324-C328 PolarHBondContact O-N 2.76Å; G324-C328 VanDerWaalsContact O-N 3.12Å; V325-C328 WeakPolarHBondContact O-CB 3.41Å; V325-C328 PolarHBondContact O-N 3.04Å; I326-C328 PolarHBondContact O-N 3.17Å; C328-H330 VanDerWaalsContact C-N 3.31Å; C328-H330 PolarHBondContact O-N 2.94Å; C328-Y331 PolarHBondContact O-N 2.93Å; C328-F332 VanDerWaalsContact O-CD2 3.26Å; C328-F332 WeakPolarHBondContact O-CD2 3.13Å; C328-F332 WeakPolarHBondContact O-CG 3.31Å; C328-F332 PolarHBondContact O-N 2.92Å; C328-F332 WeakPolarHBondContact SG-CE2 3.25Å; C328-F346 WeakPolarHBondContact SG-CE2 3.47Å
329	I	95.6	Very high	95	Very high	95 Å²	95	52.5 Å²	52.5	49%	0.487	30%	0.3	S	S	.	.	H	α-helix	trans	-60	-43	173.7	-69.4	167.4	0	0	0	110.8	V325 I326 Y331 F332 V333	V325-I329 HydrophobicContact CG1-CD1 3.73Å; V325-I329 HydrophobicContact CG1-CG1 4.23Å; V325-I329 VanDerWaalsContact O-CG1 3.3Å; V325-I329 WeakPolarHBondContact O-CG1 3.32Å; V325-I329 PolarHBondContact O-N 3.41Å; I326-I329 PolarHBondContact O-N 2.94Å; I329-Y331 PolarHBondContact O-N 3.48Å; I329-F332 PolarHBondContact O-N 2.85Å; I329-V333 HydrophobicContact CG2-CG2 4.48Å; I329-V333 WeakPolarHBondContact O-CG2 3.22Å; I329-V333 PolarHBondContact O-N 2.87Å
330	H	96.6	Very high	94.7	Very high	46 Å²	46	49.4 Å²	49.4	21%	0.213	28%	0.279	C	S	.	.	H	α-helix	trans	-56	-53	175	-172.4	147.4	0	0	0	110.3	F274 Y284 I326 P327 C328 F332 V333 T334	F274-H330 HydrophobicContact CE1-CB 4.48Å; F274-H330 AromaticContact CE1-CD2 3.81Å; F274-H330 HydrophobicContact CZ-CB 4.18Å; Y284-H330 HydrophobicContact CE2-CB 4.16Å; Y284-H330 AromaticContact CE2-ND1 3.4Å; Y284-H330 WeakPolarHBondContact CE2-ND1 3.04Å; Y284-H330 AromaticContact CZ-ND1 3.59Å; Y284-H330 WeakPolarHBondContact OH-CB 3.41Å; Y284-H330 PolarHBondContact OH-ND1 3.17Å; I326-H330 PolarHBondContact O-N 2.92Å; P327-H330 WeakPolarHBondContact O-CB 3.38Å; P327-H330 PolarHBondContact O-N 3.02Å; C328-H330 VanDerWaalsContact C-N 3.31Å; C328-H330 PolarHBondContact O-N 2.94Å; H330-F332 VanDerWaalsContact C-N 3.31Å; H330-F332 PolarHBondContact O-N 3.35Å; H330-V333 PolarHBondContact O-N 2.88Å; H330-V333 VanDerWaalsContact O-N 3.11Å; H330-T334 VanDerWaalsContact CD2-CG2 3.48Å; H330-T334 WeakPolarHBondContact CD2-CG2 3.35Å; H330-T334 PolarHBondContact O-N 3.31Å; H330-T334 PolarHBondContact O-OG1 2.84Å
331	Y	95.2	Very high	94.4	Very high	11 Å²	11	52.5 Å²	52.5	4%	0.043	30%	0.295	C	S	.	.	H	α-helix	trans	-57.7	-42.3	-179.8	-169.2	-84.5	0	0	0	112.1	G273 F274 P327 C328 I329 V333 T334 D335 A339 A340 A344 R408	G273-Y331 WeakPolarHBondContact O-CD2 3.43Å; G273-Y331 WeakPolarHBondContact O-CE2 3.27Å; F274-Y331 HydrophobicContact CE1-CD2 4.41Å; P327-Y331 WeakPolarHBondContact O-CB 3.15Å; P327-Y331 PolarHBondContact O-N 3.44Å; C328-Y331 PolarHBondContact O-N 2.93Å; I329-Y331 PolarHBondContact O-N 3.48Å; Y331-V333 VanDerWaalsContact C-N 3.34Å; Y331-V333 PolarHBondContact O-N 3.03Å; Y331-T334 PolarHBondContact O-N 2.92Å; Y331-T334 PolarHBondContact O-OG1 3.07Å; Y331-D335 HydrophobicContact CD1-CB 4.27Å; Y331-D335 HydrophobicContact CE1-CB 3.8Å; Y331-D335 HydrophobicContact CE2-CB 4.22Å; Y331-D335 PolarHBondContact O-N 3.22Å; Y331-A339 HydrophobicContact CE1-CB 4.39Å; Y331-A340 HydrophobicContact CD1-CB 3.75Å; Y331-A340 VanDerWaalsContact CE1-CA 3.46Å; Y331-A340 HydrophobicContact CE1-CB 3.81Å; Y331-A344 HydrophobicContact CD1-CB 4.18Å; Y331-A344 HydrophobicContact CE1-CB 3.69Å; Y331-A344 HydrophobicContact CE2-CB 4.31Å; Y331-R408 PolarHBondContact OH-NH2 3.43Å
332	F	94.9	Very high	94	Very high	54 Å²	54	57.8 Å²	57.8	24%	0.237	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-41.5	175.7	-74.4	-46.5	0	0	0	113.6	C328 I329 H330 T334 G336 F337 A340 F346	C328-F332 VanDerWaalsContact O-CD2 3.26Å; C328-F332 WeakPolarHBondContact O-CD2 3.13Å; C328-F332 WeakPolarHBondContact O-CG 3.31Å; C328-F332 PolarHBondContact O-N 2.92Å; C328-F332 WeakPolarHBondContact SG-CE2 3.25Å; I329-F332 PolarHBondContact O-N 2.85Å; H330-F332 VanDerWaalsContact C-N 3.31Å; H330-F332 PolarHBondContact O-N 3.35Å; F332-T334 VanDerWaalsContact C-N 3.33Å; F332-G336 WeakPolarHBondContact O-CA 3.19Å; F332-G336 PolarHBondContact O-N 3.45Å; F332-G336 VanDerWaalsContact O-N 3.11Å; F332-F337 HydrophobicContact CD1-CD2 4.03Å; F332-F337 AromaticContact CE1-CD2 3.56Å; F332-F337 HydrophobicContact CE1-CD2 3.56Å; F332-F337 HydrophobicContact CE1-CE2 4.09Å; F332-F337 HydrophobicContact CE1-CG 4.49Å; F332-F337 HydrophobicContact CZ-CD2 4.16Å; F332-F337 HydrophobicContact CZ-CE2 4.32Å; F332-A340 HydrophobicContact CD1-CB 3.48Å; F332-A340 VanDerWaalsContact CD1-CB 3.48Å; F332-A340 HydrophobicContact CE1-CB 3.24Å; F332-A340 HydrophobicContact CZ-CB 4.31Å; F332-F346 HydrophobicContact CE1-CD1 4.33Å; F332-F346 HydrophobicContact CE1-CD2 4.42Å; F332-F346 HydrophobicContact CE1-CE1 4.47Å; F332-F346 HydrophobicContact CE1-CG 4.31Å; F332-F346 HydrophobicContact CE2-CD2 4.46Å; F332-F346 AromaticContact CE2-CE2 3.95Å; F332-F346 HydrophobicContact CE2-CE2 3.95Å; F332-F346 AromaticContact CE2-CZ 3.99Å; F332-F346 HydrophobicContact CE2-CZ 3.99Å; F332-F346 AromaticContact CZ-CD1 3.87Å; F332-F346 HydrophobicContact CZ-CD1 3.87Å; F332-F346 AromaticContact CZ-CD2 3.72Å; F332-F346 HydrophobicContact CZ-CD2 3.72Å; F332-F346 AromaticContact CZ-CE1 3.65Å; F332-F346 HydrophobicContact CZ-CE1 3.65Å; F332-F346 AromaticContact CZ-CE2 3.52Å; F332-F346 HydrophobicContact CZ-CE2 3.52Å; F332-F346 AromaticContact CZ-CG 3.91Å; F332-F346 HydrophobicContact CZ-CG 3.91Å; F332-F346 AromaticContact CZ-CZ 3.48Å; F332-F346 HydrophobicContact CZ-CZ 3.48Å; F332-F346 VanDerWaalsContact CZ-CZ 3.48Å
333	V	95.4	Very high	93.6	Very high	120 Å²	120	57 Å²	57	73%	0.727	31%	0.305	S	S	*	.	H	α-helix	trans	-69.5	-35.1	-179.5	171	0	0	0	0	111.1	I329 H330 Y331	I329-V333 HydrophobicContact CG2-CG2 4.48Å; I329-V333 WeakPolarHBondContact O-CG2 3.22Å; I329-V333 PolarHBondContact O-N 2.87Å; H330-V333 PolarHBondContact O-N 2.88Å; H330-V333 VanDerWaalsContact O-N 3.11Å; Y331-V333 VanDerWaalsContact C-N 3.34Å; Y331-V333 PolarHBondContact O-N 3.03Å
334	T	93.7	Very high	93.2	Very high	58 Å²	58	56.7 Å²	56.7	36%	0.356	30%	0.304	S	S	.	.	H	α-helix	trans	-93.1	-31.2	-171.3	51	0	0	0	0	115.1	R277 H330 Y331 F332	R277-T334 VanDerWaalsContact CZ-CB 3.41Å; R277-T334 PolarHBondContact NH1-OG1 3.34Å; R277-T334 PolarHBondContact NH2-O 3.25Å; H330-T334 VanDerWaalsContact CD2-CG2 3.48Å; H330-T334 WeakPolarHBondContact CD2-CG2 3.35Å; H330-T334 PolarHBondContact O-N 3.31Å; H330-T334 PolarHBondContact O-OG1 2.84Å; Y331-T334 PolarHBondContact O-N 2.92Å; Y331-T334 PolarHBondContact O-OG1 3.07Å; F332-T334 VanDerWaalsContact C-N 3.33Å
335	D	91.6	Very high	93	Very high	58 Å²	58	56.8 Å²	56.8	31%	0.31	30%	0.303	S	S	.	.	H	α-helix	trans	-118.7	-15.8	-174.3	-54.6	-95.2	0	0	0	111.8	R277 Y331 A339	R277-D335 IonicContact CZ-OD1 2.65Å; R277-D335 IonicContact CZ-OD2 3.66Å; R277-D335 VanDerWaalsContact CZ-OD2 3.31Å; R277-D335 IonicContact NH1-OD1 3.96Å; R277-D335 IonicContact NH1-OD2 3.52Å; R277-D335 PolarHBondContact NH1-OD2 3.1Å; R277-D335 IonicContact NH2-OD1 3.14Å; R277-D335 PolarHBondContact NH2-OD1 3.43Å; R277-D335 IonicContact NH2-OD2 2.65Å; R277-D335 PolarHBondContact NH2-OD2 2.96Å; Y331-D335 HydrophobicContact CD1-CB 4.27Å; Y331-D335 HydrophobicContact CE1-CB 3.8Å; Y331-D335 HydrophobicContact CE2-CB 4.22Å; Y331-D335 PolarHBondContact O-N 3.22Å; D335-A339 HydrophobicContact CB-CB 4Å; D335-A339 VanDerWaalsContact O-CB 3.31Å; D335-A339 WeakPolarHBondContact O-CB 3.25Å
336	G	92.7	Very high	92.8	Very high	28 Å²	28	55 Å²	55	29%	0.289	29%	0.289	S	S	.	.			trans	89.9	162.8	179.5	0	0	0	0	0	113.8	F332 M338 A340	F332-G336 WeakPolarHBondContact O-CA 3.19Å; F332-G336 PolarHBondContact O-N 3.45Å; F332-G336 VanDerWaalsContact O-N 3.11Å; G336-M338 PolarHBondContact O-N 2.96Å; G336-A340 PolarHBondContact O-N 3.08Å
337	F	91.8	Very high	92.7	Very high	110 Å²	110	53 Å²	53	48%	0.482	29%	0.29	S	S	.	.	H	α-helix	trans	-65.4	-38	-174.6	-177	-103.3	0	0	0	113.6	F332 A340 I341	F332-F337 HydrophobicContact CD1-CD2 4.03Å; F332-F337 AromaticContact CE1-CD2 3.56Å; F332-F337 HydrophobicContact CE1-CD2 3.56Å; F332-F337 HydrophobicContact CE1-CE2 4.09Å; F332-F337 HydrophobicContact CE1-CG 4.49Å; F332-F337 HydrophobicContact CZ-CD2 4.16Å; F332-F337 HydrophobicContact CZ-CE2 4.32Å; F337-A340 WeakPolarHBondContact O-CB 3.32Å; F337-A340 PolarHBondContact O-N 2.69Å; F337-I341 HydrophobicContact CD1-CD1 3.92Å; F337-I341 HydrophobicContact CE1-CD1 3.29Å; F337-I341 HydrophobicContact CE1-CG1 4.33Å; F337-I341 HydrophobicContact CE2-CD1 4.33Å; F337-I341 HydrophobicContact CZ-CD1 3.53Å; F337-I341 HydrophobicContact CZ-CG1 4.36Å; F337-I341 PolarHBondContact O-N 2.73Å
338	M	92.1	Very high	92.6	Very high	121 Å²	121	57.7 Å²	57.7	60%	0.596	31%	0.307	S	S	*	.	H	α-helix	trans	-70.3	-41.2	-179.2	-66.5	-58	161.1	0	0	112	G336 A340 I341 Q342	G336-M338 PolarHBondContact O-N 2.96Å; M338-A340 PolarHBondContact O-N 3.47Å; M338-I341 PolarHBondContact O-N 2.86Å; M338-Q342 WeakPolarHBondContact O-CB 3.17Å; M338-Q342 WeakPolarHBondContact O-CG 3.38Å; M338-Q342 PolarHBondContact O-N 2.99Å
339	A	90.8	Very high	92.6	Very high	14 Å²	14	58.4 Å²	58.4	12%	0.116	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-37.8	172.6	0	0	0	0	0	111.3	Y331 D335 I341 Q342 E343 A344	Y331-A339 HydrophobicContact CE1-CB 4.39Å; D335-A339 HydrophobicContact CB-CB 4Å; D335-A339 VanDerWaalsContact O-CB 3.31Å; D335-A339 WeakPolarHBondContact O-CB 3.25Å; A339-I341 PolarHBondContact O-N 2.9Å; A339-Q342 PolarHBondContact O-N 3.41Å; A339-E343 WeakPolarHBondContact O-CA 3.3Å; A339-E343 VanDerWaalsContact O-CB 3.28Å; A339-E343 WeakPolarHBondContact O-CB 3.47Å; A339-E343 PolarHBondContact O-N 3.46Å; A339-A344 PolarHBondContact O-N 3.25Å
340	A	91.5	Very high	92.6	Very high	2 Å²	2	58.7 Å²	58.7	2%	0.017	31%	0.311	C	S	.	.	H	α-helix	trans	-63.9	-41.3	177.5	0	0	0	0	0	112.9	Y331 F332 G336 F337 M338 A344 S345 F346	Y331-A340 HydrophobicContact CD1-CB 3.75Å; Y331-A340 VanDerWaalsContact CE1-CA 3.46Å; Y331-A340 HydrophobicContact CE1-CB 3.81Å; F332-A340 HydrophobicContact CD1-CB 3.48Å; F332-A340 VanDerWaalsContact CD1-CB 3.48Å; F332-A340 HydrophobicContact CE1-CB 3.24Å; F332-A340 HydrophobicContact CZ-CB 4.31Å; G336-A340 PolarHBondContact O-N 3.08Å; F337-A340 WeakPolarHBondContact O-CB 3.32Å; F337-A340 PolarHBondContact O-N 2.69Å; M338-A340 PolarHBondContact O-N 3.47Å; A340-A344 CarbonylContact O-C 3.33Å; A340-A344 WeakPolarHBondContact O-CA 3.41Å; A340-A344 WeakPolarHBondContact O-CB 3.2Å; A340-A344 PolarHBondContact O-N 2.93Å; A340-S345 PolarHBondContact O-N 3.15Å; A340-F346 HydrophobicContact CB-CB 4.22Å; A340-F346 WeakPolarHBondContact O-CB 3.27Å; A340-F346 PolarHBondContact O-N 3.26Å
341	I	90.7	Very high	92.6	Very high	73 Å²	73	60.1 Å²	60.1	37%	0.374	32%	0.32	S	S	.	.	H	α-helix	trans	-69.1	-48.2	176.9	-68	176.9	0	0	0	111.2	F337 M338 A339 F346	F337-I341 HydrophobicContact CD1-CD1 3.92Å; F337-I341 HydrophobicContact CE1-CD1 3.29Å; F337-I341 HydrophobicContact CE1-CG1 4.33Å; F337-I341 HydrophobicContact CE2-CD1 4.33Å; F337-I341 HydrophobicContact CZ-CD1 3.53Å; F337-I341 HydrophobicContact CZ-CG1 4.36Å; F337-I341 PolarHBondContact O-N 2.73Å; M338-I341 PolarHBondContact O-N 2.86Å; A339-I341 PolarHBondContact O-N 2.9Å; I341-F346 HydrophobicContact CG1-CB 4.46Å; I341-F346 HydrophobicContact CG1-CD1 4.32Å
342	Q	88	Confident	92.7	Very high	142 Å²	142	60.6 Å²	60.6	66%	0.664	32%	0.323	S	S	*	.	H	α-helix	trans	-83.1	-39.4	-169.9	-67.9	178.2	-25.7	0	0	113.3	M338 A339	M338-Q342 WeakPolarHBondContact O-CB 3.17Å; M338-Q342 WeakPolarHBondContact O-CG 3.38Å; M338-Q342 PolarHBondContact O-N 2.99Å; A339-Q342 PolarHBondContact O-N 3.41Å
343	E	88.5	Confident	92.8	Very high	64 Å²	64	59.4 Å²	59.4	30%	0.299	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-30.8	-173.1	-53.8	179	-153.5	0	0	113.4	A339 V407 R408	A339-E343 WeakPolarHBondContact O-CA 3.3Å; A339-E343 VanDerWaalsContact O-CB 3.28Å; A339-E343 WeakPolarHBondContact O-CB 3.47Å; A339-E343 PolarHBondContact O-N 3.46Å; E343-V407 HydrophobicContact CB-CG1 4.05Å; E343-V407 HydrophobicContact CG-CG1 4.08Å; E343-R408 IonicContact OE2-CZ 3.59Å; E343-R408 IonicContact OE2-NH1 2.68Å; E343-R408 PolarHBondContact OE2-NH1 2.86Å; E343-R408 IonicContact OE2-NH2 3.31Å; E343-R408 PolarHBondContact OE2-NH2 3.04Å
344	A	89	Confident	92.9	Very high	9 Å²	9	56.3 Å²	56.3	7%	0.074	31%	0.309	C	S	.	.	S	Bend	trans	-103.1	13.6	-177.4	0	0	0	0	0	113.9	Y331 A339 A340 F346 M404	Y331-A344 HydrophobicContact CD1-CB 4.18Å; Y331-A344 HydrophobicContact CE1-CB 3.69Å; Y331-A344 HydrophobicContact CE2-CB 4.31Å; A339-A344 PolarHBondContact O-N 3.25Å; A340-A344 CarbonylContact O-C 3.33Å; A340-A344 WeakPolarHBondContact O-CA 3.41Å; A340-A344 WeakPolarHBondContact O-CB 3.2Å; A340-A344 PolarHBondContact O-N 2.93Å; A344-F346 PolarHBondContact O-N 3.42Å; A344-F346 VanDerWaalsContact O-N 3.11Å; A344-M404 HydrophobicContact CB-CE 4.18Å
345	S	91.3	Very high	93.1	Very high	10 Å²	10	55.1 Å²	55.1	7%	0.07	30%	0.301	C	S	.	.			trans	51.8	35.2	177	-70.1	0	0	0	0	113.7	A340 G347 W348 L349 G400 E403 M404	A340-S345 PolarHBondContact O-N 3.15Å; S345-G347 PolarHBondContact O-N 3.42Å; S345-G347 VanDerWaalsContact O-N 3.15Å; S345-W348 WeakPolarHBondContact O-CB 3.3Å; S345-W348 PolarHBondContact O-N 2.96Å; S345-L349 PolarHBondContact O-N 3.43Å; S345-G400 WeakPolarHBondContact CB-O 3.26Å; S345-G400 PolarHBondContact OG-O 2.75Å; S345-E403 WeakPolarHBondContact OG-CB 3.44Å; S345-M404 WeakPolarHBondContact OG-CG 3.49Å
346	F	92.5	Very high	93.3	Very high	37 Å²	37	54.6 Å²	54.6	16%	0.162	30%	0.295	C	S	.	.	H	α-helix	trans	-58.7	-33.2	-172.9	-178.6	-107.2	0	0	0	113.2	C328 F332 A340 I341 A344 W348 L349 M350	C328-F346 WeakPolarHBondContact SG-CE2 3.47Å; F332-F346 HydrophobicContact CE1-CD1 4.33Å; F332-F346 HydrophobicContact CE1-CD2 4.42Å; F332-F346 HydrophobicContact CE1-CE1 4.47Å; F332-F346 HydrophobicContact CE1-CG 4.31Å; F332-F346 HydrophobicContact CE2-CD2 4.46Å; F332-F346 AromaticContact CE2-CE2 3.95Å; F332-F346 HydrophobicContact CE2-CE2 3.95Å; F332-F346 AromaticContact CE2-CZ 3.99Å; F332-F346 HydrophobicContact CE2-CZ 3.99Å; F332-F346 AromaticContact CZ-CD1 3.87Å; F332-F346 HydrophobicContact CZ-CD1 3.87Å; F332-F346 AromaticContact CZ-CD2 3.72Å; F332-F346 HydrophobicContact CZ-CD2 3.72Å; F332-F346 AromaticContact CZ-CE1 3.65Å; F332-F346 HydrophobicContact CZ-CE1 3.65Å; F332-F346 AromaticContact CZ-CE2 3.52Å; F332-F346 HydrophobicContact CZ-CE2 3.52Å; F332-F346 AromaticContact CZ-CG 3.91Å; F332-F346 HydrophobicContact CZ-CG 3.91Å; F332-F346 AromaticContact CZ-CZ 3.48Å; F332-F346 HydrophobicContact CZ-CZ 3.48Å; F332-F346 VanDerWaalsContact CZ-CZ 3.48Å; A340-F346 HydrophobicContact CB-CB 4.22Å; A340-F346 WeakPolarHBondContact O-CB 3.27Å; A340-F346 PolarHBondContact O-N 3.26Å; I341-F346 HydrophobicContact CG1-CB 4.46Å; I341-F346 HydrophobicContact CG1-CD1 4.32Å; A344-F346 PolarHBondContact O-N 3.42Å; A344-F346 VanDerWaalsContact O-N 3.11Å; F346-W348 PolarHBondContact O-N 3.35Å; F346-L349 HydrophobicContact CD2-CD2 3.89Å; F346-L349 HydrophobicContact CE2-CD2 4.11Å; F346-L349 WeakPolarHBondContact O-CB 3.23Å; F346-L349 PolarHBondContact O-N 2.67Å; F346-M350 HydrophobicContact CD1-CG 4.21Å; F346-M350 HydrophobicContact CE1-CG 3.66Å; F346-M350 HydrophobicContact CE1-SD 4.16Å; F346-M350 HydrophobicContact CE2-CG 4.05Å; F346-M350 HydrophobicContact CE2-SD 3.91Å; F346-M350 HydrophobicContact CZ-CG 3.56Å; F346-M350 HydrophobicContact CZ-SD 3.47Å; F346-M350 WeakPolarHBondContact CZ-SD 3.4Å; F346-M350 WeakPolarHBondContact O-CG 3.49Å; F346-M350 PolarHBondContact O-N 2.68Å
347	G	93.6	Very high	93.5	Very high	46 Å²	46	56.3 Å²	56.3	47%	0.474	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-43.6	173.8	0	0	0	0	0	113.1	S345 L349 M350 L351	S345-G347 PolarHBondContact O-N 3.42Å; S345-G347 VanDerWaalsContact O-N 3.15Å; G347-L349 VanDerWaalsContact C-N 3.34Å; G347-M350 PolarHBondContact O-N 2.8Å; G347-L351 PolarHBondContact O-N 3.42Å
348	W	95.6	Very high	93.8	Very high	100 Å²	100	53.2 Å²	53.2	38%	0.379	29%	0.289	S	S	.	.	H	α-helix	trans	-67.3	-36	175.5	-62.6	116.7	0	0	0	111.9	S345 F346 M350 L351 M352 V396 H399	S345-W348 WeakPolarHBondContact O-CB 3.3Å; S345-W348 PolarHBondContact O-N 2.96Å; F346-W348 PolarHBondContact O-N 3.35Å; W348-M350 VanDerWaalsContact C-N 3.35Å; W348-L351 HydrophobicContact CE3-CD2 4.06Å; W348-L351 HydrophobicContact CZ3-CD2 4.02Å; W348-L351 PolarHBondContact O-N 3.2Å; W348-M352 WeakPolarHBondContact O-CB 3.19Å; W348-M352 PolarHBondContact O-N 3.2Å; W348-V396 HydrophobicContact CB-CG1 4.48Å; W348-V396 HydrophobicContact CE3-CG1 4.05Å; W348-V396 WeakPolarHBondContact O-CG1 3.26Å; W348-H399 AromaticContact CD2-ND1 3.71Å; W348-H399 AromaticContact CE2-CE1 3.41Å; W348-H399 VanDerWaalsContact CE2-CE1 3.41Å; W348-H399 AromaticContact CE2-ND1 3.3Å; W348-H399 VanDerWaalsContact CE2-ND1 3.3Å; W348-H399 AromaticContact CH2-CE1 4Å; W348-H399 AromaticContact CZ2-CE1 3.26Å; W348-H399 WeakPolarHBondContact CZ2-CE1 3.47Å; W348-H399 AromaticContact CZ2-ND1 3.53Å; W348-H399 AromaticContact NE1-CE1 3.59Å; W348-H399 AromaticContact NE1-ND1 3.52Å
349	L	94.3	Very high	94.1	Very high	29 Å²	29	47.5 Å²	47.5	15%	0.152	26%	0.261	C	S	.	.	H	α-helix	trans	-59.6	-45.1	172.8	-172.4	77.4	0	0	0	111.3	W269 S345 F346 G347 M352 A353	W269-L349 HydrophobicContact CD2-CD1 4.44Å; W269-L349 HydrophobicContact CH2-CD2 4.36Å; W269-L349 HydrophobicContact CZ2-CD1 4.11Å; W269-L349 HydrophobicContact CZ2-CD2 3.64Å; S345-L349 PolarHBondContact O-N 3.43Å; F346-L349 HydrophobicContact CD2-CD2 3.89Å; F346-L349 HydrophobicContact CE2-CD2 4.11Å; F346-L349 WeakPolarHBondContact O-CB 3.23Å; F346-L349 PolarHBondContact O-N 2.67Å; G347-L349 VanDerWaalsContact C-N 3.34Å; L349-M352 HydrophobicContact CD1-CE 3.4Å; L349-M352 VanDerWaalsContact CD1-CE 3.4Å; L349-M352 HydrophobicContact CG-CE 4.31Å; L349-M352 PolarHBondContact O-N 3.13Å; L349-A353 WeakPolarHBondContact O-CB 3.42Å; L349-A353 PolarHBondContact O-N 3.02Å
350	M	95.2	Very high	94.3	Very high	101 Å²	101	47.3 Å²	47.3	50%	0.498	26%	0.259	S	S	.	.	H	α-helix	trans	-66.1	-40	178.2	-70.5	-55.2	-59.8	0	0	112.7	F346 G347 W348 A353 A354	F346-M350 HydrophobicContact CD1-CG 4.21Å; F346-M350 HydrophobicContact CE1-CG 3.66Å; F346-M350 HydrophobicContact CE1-SD 4.16Å; F346-M350 HydrophobicContact CE2-CG 4.05Å; F346-M350 HydrophobicContact CE2-SD 3.91Å; F346-M350 HydrophobicContact CZ-CG 3.56Å; F346-M350 HydrophobicContact CZ-SD 3.47Å; F346-M350 WeakPolarHBondContact CZ-SD 3.4Å; F346-M350 WeakPolarHBondContact O-CG 3.49Å; F346-M350 PolarHBondContact O-N 2.68Å; G347-M350 PolarHBondContact O-N 2.8Å; W348-M350 VanDerWaalsContact C-N 3.35Å; M350-A353 PolarHBondContact O-N 3.35Å; M350-A354 WeakPolarHBondContact O-CB 3.19Å; M350-A354 PolarHBondContact O-N 3.19Å
351	L	97.1	Very high	94.6	Very high	76 Å²	76	50.6 Å²	50.6	40%	0.398	28%	0.279	S	S	.	.	H	α-helix	trans	-63.8	-45.1	174.8	179	60.1	0	0	0	111.4	G347 W348 A353 A354 L355 V396	G347-L351 PolarHBondContact O-N 3.42Å; W348-L351 HydrophobicContact CE3-CD2 4.06Å; W348-L351 HydrophobicContact CZ3-CD2 4.02Å; W348-L351 PolarHBondContact O-N 3.2Å; L351-A353 PolarHBondContact O-N 2.68Å; L351-A354 PolarHBondContact O-N 2.94Å; L351-L355 HydrophobicContact CG-CD1 4.34Å; L351-L355 WeakPolarHBondContact O-CG 3.5Å; L351-L355 PolarHBondContact O-N 3.08Å; L351-V396 HydrophobicContact CB-CG1 4.11Å; L351-V396 HydrophobicContact CD2-CG1 3.97Å; L351-V396 HydrophobicContact CD2-CG2 3.99Å; L351-V396 HydrophobicContact CG-CG1 4.02Å; L351-V396 HydrophobicContact CG-CG2 4.33Å
352	M	96.7	Very high	94.9	Very high	21 Å²	21	49.2 Å²	49.2	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-59.8	-45.2	175.2	174.4	-89.6	-68.2	0	0	111.7	W348 L349 A354 L355 Y356 A393 V396 H397	W348-M352 WeakPolarHBondContact O-CB 3.19Å; W348-M352 PolarHBondContact O-N 3.2Å; L349-M352 HydrophobicContact CD1-CE 3.4Å; L349-M352 VanDerWaalsContact CD1-CE 3.4Å; L349-M352 HydrophobicContact CG-CE 4.31Å; L349-M352 PolarHBondContact O-N 3.13Å; M352-A354 PolarHBondContact O-N 3.18Å; M352-L355 PolarHBondContact O-N 2.99Å; M352-Y356 HydrophobicContact CG-CD2 3.81Å; M352-Y356 HydrophobicContact CG-CE2 3.63Å; M352-Y356 WeakPolarHBondContact O-CD2 3.4Å; M352-Y356 PolarHBondContact O-N 3.31Å; M352-Y356 HydrophobicContact SD-CD2 3.35Å; M352-Y356 WeakPolarHBondContact SD-CD2 3.43Å; M352-Y356 HydrophobicContact SD-CE2 3.43Å; M352-Y356 WeakPolarHBondContact SD-CE2 3.24Å; M352-A393 HydrophobicContact CG-CB 4.25Å; M352-V396 HydrophobicContact CB-CB 4.48Å; M352-V396 HydrophobicContact CB-CG1 3.93Å; M352-H397 HydrophobicContact CG-CB 4.18Å
353	A	96	Very high	95.3	Very high	28 Å²	28	43.3 Å²	43.3	23%	0.231	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-42.8	175.8	0	0	0	0	0	111.9	L349 M350 L351 L355 Y356 I357	L349-A353 WeakPolarHBondContact O-CB 3.42Å; L349-A353 PolarHBondContact O-N 3.02Å; M350-A353 PolarHBondContact O-N 3.35Å; L351-A353 PolarHBondContact O-N 2.68Å; A353-L355 PolarHBondContact O-N 3.48Å; A353-Y356 PolarHBondContact O-N 2.78Å; A353-I357 HydrophobicContact CB-CD1 4.47Å; A353-I357 VanDerWaalsContact O-CB 3.31Å; A353-I357 WeakPolarHBondContact O-CB 3.24Å; A353-I357 WeakPolarHBondContact O-CD1 3.19Å; A353-I357 WeakPolarHBondContact O-CG1 3.3Å; A353-I357 PolarHBondContact O-N 2.74Å
354	A	97.9	Very high	95.7	Very high	55 Å²	55	41.1 Å²	41.1	46%	0.455	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-44.3	176.8	0	0	0	0	0	111.7	M350 L351 M352 S358	M350-A354 WeakPolarHBondContact O-CB 3.19Å; M350-A354 PolarHBondContact O-N 3.19Å; L351-A354 PolarHBondContact O-N 2.94Å; M352-A354 PolarHBondContact O-N 3.18Å; A354-S358 WeakPolarHBondContact O-CB 3.25Å; A354-S358 PolarHBondContact O-N 2.86Å; A354-S358 PolarHBondContact O-OG 2.83Å
355	L	98.1	Very high	96.1	Very high	33 Å²	33	44.6 Å²	44.6	17%	0.173	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-50.4	176.3	-70.4	169.2	0	0	0	111.8	L351 M352 A353 S358 G359 F389 A392 A393 V396	L351-L355 HydrophobicContact CG-CD1 4.34Å; L351-L355 WeakPolarHBondContact O-CG 3.5Å; L351-L355 PolarHBondContact O-N 3.08Å; M352-L355 PolarHBondContact O-N 2.99Å; A353-L355 PolarHBondContact O-N 3.48Å; L355-S358 PolarHBondContact O-OG 3.44Å; L355-S358 VanDerWaalsContact O-OG 3.09Å; L355-G359 PolarHBondContact O-N 3.23Å; L355-F389 VanDerWaalsContact O-CD2 3.27Å; L355-F389 WeakPolarHBondContact O-CD2 3.31Å; L355-A392 HydrophobicContact CD1-CB 4.23Å; L355-A393 HydrophobicContact CB-CB 3.84Å; L355-A393 HydrophobicContact CD1-CB 4.27Å; L355-V396 HydrophobicContact CD1-CG2 3.88Å
356	Y	96.2	Very high	96.3	Very high	48 Å²	48	46.7 Å²	46.7	19%	0.188	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-45.6	179.7	-79.5	-53.2	0	0	0	113	M352 A353 G359 A360 V390 A393	M352-Y356 HydrophobicContact CG-CD2 3.81Å; M352-Y356 HydrophobicContact CG-CE2 3.63Å; M352-Y356 WeakPolarHBondContact O-CD2 3.4Å; M352-Y356 PolarHBondContact O-N 3.31Å; M352-Y356 HydrophobicContact SD-CD2 3.35Å; M352-Y356 WeakPolarHBondContact SD-CD2 3.43Å; M352-Y356 HydrophobicContact SD-CE2 3.43Å; M352-Y356 WeakPolarHBondContact SD-CE2 3.24Å; A353-Y356 PolarHBondContact O-N 2.78Å; Y356-G359 PolarHBondContact O-N 2.9Å; Y356-A360 WeakPolarHBondContact O-CB 3.46Å; Y356-A360 PolarHBondContact O-N 3Å; Y356-V390 HydrophobicContact CD1-CG2 4.38Å; Y356-V390 HydrophobicContact CE1-CB 4.33Å; Y356-V390 HydrophobicContact CE1-CG1 4.3Å; Y356-V390 HydrophobicContact CE1-CG2 4.18Å; Y356-A393 HydrophobicContact CD1-CB 3.85Å; Y356-A393 HydrophobicContact CD2-CB 3.77Å; Y356-A393 HydrophobicContact CE1-CB 3.64Å; Y356-A393 HydrophobicContact CE2-CB 3.56Å; Y356-A393 HydrophobicContact CG-CB 3.9Å; Y356-A393 VanDerWaalsContact CZ-CB 3.48Å
357	I	97	Very high	96.6	Very high	63 Å²	63	46.3 Å²	46.3	32%	0.323	26%	0.26	S	S	.	.	H	α-helix	trans	-66.6	-46.9	-177.5	-66.7	167.4	0	0	0	110.2	V318 L322 A353 G359 A360 V361	V318-I357 HydrophobicContact CG1-CG1 4.34Å; L322-I357 HydrophobicContact CD2-CD1 3.96Å; A353-I357 HydrophobicContact CB-CD1 4.47Å; A353-I357 VanDerWaalsContact O-CB 3.31Å; A353-I357 WeakPolarHBondContact O-CB 3.24Å; A353-I357 WeakPolarHBondContact O-CD1 3.19Å; A353-I357 WeakPolarHBondContact O-CG1 3.3Å; A353-I357 PolarHBondContact O-N 2.74Å; I357-G359 VanDerWaalsContact C-N 3.32Å; I357-G359 PolarHBondContact O-N 2.93Å; I357-A360 PolarHBondContact O-N 3.38Å; I357-V361 HydrophobicContact CG2-CG2 4.3Å; I357-V361 WeakPolarHBondContact O-CB 3.3Å; I357-V361 VanDerWaalsContact O-CG2 3.23Å; I357-V361 WeakPolarHBondContact O-CG2 3.37Å; I357-V361 PolarHBondContact O-N 2.97Å
358	S	97.8	Very high	96.8	Very high	46 Å²	46	45.3 Å²	45.3	32%	0.322	25%	0.246	S	C	.	.	H	α-helix	trans	-61.7	-41.9	177.9	57.7	0	0	0	0	111.5	A354 L355 V361 L362 F389	A354-S358 WeakPolarHBondContact O-CB 3.25Å; A354-S358 PolarHBondContact O-N 2.86Å; A354-S358 PolarHBondContact O-OG 2.83Å; L355-S358 PolarHBondContact O-OG 3.44Å; L355-S358 VanDerWaalsContact O-OG 3.09Å; S358-V361 PolarHBondContact O-N 3.05Å; S358-L362 VanDerWaalsContact O-CG 3.28Å; S358-L362 WeakPolarHBondContact O-CG 3.45Å; S358-L362 PolarHBondContact O-N 3.45Å; S358-F389 WeakPolarHBondContact OG-CD2 3.44Å; S358-F389 WeakPolarHBondContact OG-CE2 3.35Å
359	G	97.6	Very high	96.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-46.2	175.9	0	0	0	0	0	112.2	L355 Y356 I357 V361 L362 Y363	L355-G359 PolarHBondContact O-N 3.23Å; Y356-G359 PolarHBondContact O-N 2.9Å; I357-G359 VanDerWaalsContact C-N 3.32Å; I357-G359 PolarHBondContact O-N 2.93Å; G359-V361 VanDerWaalsContact C-N 3.34Å; G359-V361 PolarHBondContact O-N 3.25Å; G359-L362 PolarHBondContact O-N 3.27Å; G359-Y363 WeakPolarHBondContact O-CB 3.24Å; G359-Y363 PolarHBondContact O-N 3.33Å
360	A	96.6	Very high	97	Very high	10 Å²	10	44 Å²	44	8%	0.083	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-36.9	177.6	0	0	0	0	0	112.5	V318 Y356 I357 A364	V318-A360 HydrophobicContact CG2-CB 3.51Å; Y356-A360 WeakPolarHBondContact O-CB 3.46Å; Y356-A360 PolarHBondContact O-N 3Å; I357-A360 PolarHBondContact O-N 3.38Å; A360-A364 VanDerWaalsContact O-CB 3.28Å; A360-A364 WeakPolarHBondContact O-CB 3.41Å; A360-A364 PolarHBondContact O-N 2.92Å
361	V	97.4	Very high	97.1	Very high	71 Å²	71	45.4 Å²	45.4	43%	0.43	24%	0.242	S	C	.	.	H	α-helix	trans	-66	-47.4	174.8	168.7	0	0	0	0	110.6	I357 S358 G359 Y363 A364 L365	I357-V361 HydrophobicContact CG2-CG2 4.3Å; I357-V361 WeakPolarHBondContact O-CB 3.3Å; I357-V361 VanDerWaalsContact O-CG2 3.23Å; I357-V361 WeakPolarHBondContact O-CG2 3.37Å; I357-V361 PolarHBondContact O-N 2.97Å; S358-V361 PolarHBondContact O-N 3.05Å; G359-V361 VanDerWaalsContact C-N 3.34Å; G359-V361 PolarHBondContact O-N 3.25Å; V361-Y363 VanDerWaalsContact C-N 3.34Å; V361-Y363 PolarHBondContact O-N 2.86Å; V361-A364 PolarHBondContact O-N 2.88Å; V361-L365 HydrophobicContact CG1-CD1 3.76Å; V361-L365 HydrophobicContact CG1-CG 4.34Å; V361-L365 VanDerWaalsContact O-CB 3.31Å; V361-L365 WeakPolarHBondContact O-CB 3.41Å; V361-L365 VanDerWaalsContact O-CG 3.32Å; V361-L365 WeakPolarHBondContact O-CG 3.4Å; V361-L365 PolarHBondContact O-N 3Å
362	L	97.3	Very high	97.1	Very high	44 Å²	44	48.1 Å²	48.1	23%	0.23	25%	0.248	C	C	.	.	H	α-helix	trans	-58.9	-45.7	176.1	-69.8	174.1	0	0	0	111.1	S358 G359 L365 R366 V367 S382 I385 F389	S358-L362 VanDerWaalsContact O-CG 3.28Å; S358-L362 WeakPolarHBondContact O-CG 3.45Å; S358-L362 PolarHBondContact O-N 3.45Å; G359-L362 PolarHBondContact O-N 3.27Å; L362-L365 CarbonylContact O-C 3.52Å; L362-L365 PolarHBondContact O-N 3.19Å; L362-R366 WeakPolarHBondContact O-CA 3.43Å; L362-R366 PolarHBondContact O-N 2.7Å; L362-V367 HydrophobicContact CD2-CB 3.89Å; L362-V367 HydrophobicContact CD2-CG1 3.78Å; L362-V367 PolarHBondContact O-N 3.22Å; L362-S382 VanDerWaalsContact O-CB 3.28Å; L362-S382 WeakPolarHBondContact O-CB 3.42Å; L362-I385 HydrophobicContact CD1-CG2 3.67Å; L362-F389 HydrophobicContact CD1-CE2 4.22Å
363	Y	96.8	Very high	97	Very high	18 Å²	18	50 Å²	50	7%	0.071	26%	0.261	C	S	.	.	H	α-helix	trans	-57.6	-50.7	174.5	168.7	-96.9	0	0	0	112.9	R310 R313 A314 G359 V361 L365 R366 H383 F386	R310-Y363 WeakPolarHBondContact CD-O 3.46Å; R310-Y363 HydrophobicContact CG-CD1 4.04Å; R310-Y363 HydrophobicContact CG-CE1 3.39Å; R310-Y363 HydrophobicContact CG-CE2 4.48Å; R313-Y363 PolarHBondContact NE-OH 2.95Å; R313-Y363 VanDerWaalsContact NE-OH 3.16Å; R313-Y363 PolarHBondContact NH2-OH 3.39Å; A314-Y363 HydrophobicContact CB-CD1 4.48Å; G359-Y363 WeakPolarHBondContact O-CB 3.24Å; G359-Y363 PolarHBondContact O-N 3.33Å; V361-Y363 VanDerWaalsContact C-N 3.34Å; V361-Y363 PolarHBondContact O-N 2.86Å; Y363-L365 VanDerWaalsContact C-N 3.32Å; Y363-L365 PolarHBondContact O-N 3.42Å; Y363-R366 PolarHBondContact O-N 3.4Å; Y363-H383 AromaticContact CE2-CE1 3.67Å; Y363-H383 AromaticContact CE2-ND1 3.73Å; Y363-H383 AromaticContact CE2-NE2 3.93Å; Y363-F386 HydrophobicContact CD2-CD1 4.3Å
364	A	96	Very high	97	Very high	18 Å²	18	49.9 Å²	49.9	15%	0.149	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-38	-177.8	0	0	0	0	0	111.7	A314 A360 V361	A314-A364 HydrophobicContact CB-CB 3.92Å; A360-A364 VanDerWaalsContact O-CB 3.28Å; A360-A364 WeakPolarHBondContact O-CB 3.41Å; A360-A364 PolarHBondContact O-N 2.92Å; V361-A364 PolarHBondContact O-N 2.88Å
365	L	96.4	Very high	96.9	Very high	83 Å²	83	53.2 Å²	53.2	44%	0.435	27%	0.268	S	S	.	.	H	α-helix	trans	-85.4	-11.5	179.3	-61.7	-178.3	0	0	0	113.2	V361 L362 Y363 V367 R370	V361-L365 HydrophobicContact CG1-CD1 3.76Å; V361-L365 HydrophobicContact CG1-CG 4.34Å; V361-L365 VanDerWaalsContact O-CB 3.31Å; V361-L365 WeakPolarHBondContact O-CB 3.41Å; V361-L365 VanDerWaalsContact O-CG 3.32Å; V361-L365 WeakPolarHBondContact O-CG 3.4Å; V361-L365 PolarHBondContact O-N 3Å; L362-L365 CarbonylContact O-C 3.52Å; L362-L365 PolarHBondContact O-N 3.19Å; Y363-L365 VanDerWaalsContact C-N 3.32Å; Y363-L365 PolarHBondContact O-N 3.42Å; L365-V367 VanDerWaalsContact C-N 3.33Å; L365-V367 HydrophobicContact CB-CG2 3.89Å; L365-R370 PolarHBondContact O-NE 3.12Å; L365-R370 PolarHBondContact O-NH2 2.91Å
366	R	97.3	Very high	96.8	Very high	53 Å²	53	53.9 Å²	53.9	20%	0.2	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	42.6	-179.5	-49.9	-173.6	-79.1	157.8	-6.1	112.5	N155 D156 F157 L362 Y363 E369 R370 S382	N155-R366 WeakPolarHBondContact OD1-CD 3.23Å; N155-R366 PolarHBondContact OD1-NH1 2.98Å; N155-R366 VanDerWaalsContact OD1-NH1 3.09Å; D156-R366 IonicContact OD1-CZ 2.89Å; D156-R366 IonicContact OD1-NH1 3.98Å; D156-R366 PolarHBondContact OD1-NH1 3.37Å; D156-R366 IonicContact OD1-NH2 2.67Å; F157-R366 HydrophobicContact CD2-CB 3.88Å; F157-R366 HydrophobicContact CE2-CB 4.04Å; L362-R366 WeakPolarHBondContact O-CA 3.43Å; L362-R366 PolarHBondContact O-N 2.7Å; Y363-R366 PolarHBondContact O-N 3.4Å; R366-E369 VanDerWaalsContact C-CD 3.45Å; R366-E369 WeakPolarHBondContact CA-OE1 3.28Å; R366-E369 HydrophobicContact CB-CG 4.45Å; R366-E369 PolarHBondContact O-N 3.21Å; R366-R370 WeakPolarHBondContact O-CB 3.44Å; R366-R370 PolarHBondContact O-N 2.84Å; R366-S382 WeakPolarHBondContact CA-OG 3.2Å
367	V	97.7	Very high	96.8	Very high	29 Å²	29	52 Å²	52	18%	0.176	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	132.8	-179.3	170.9	0	0	0	0	108.9	L362 L365 F371 S382	L362-V367 HydrophobicContact CD2-CB 3.89Å; L362-V367 HydrophobicContact CD2-CG1 3.78Å; L362-V367 PolarHBondContact O-N 3.22Å; L365-V367 VanDerWaalsContact C-N 3.33Å; L365-V367 HydrophobicContact CB-CG2 3.89Å; V367-F371 HydrophobicContact CB-CE2 4.38Å; V367-F371 HydrophobicContact CG1-CD2 4.21Å; V367-F371 HydrophobicContact CG1-CE2 3.81Å; V367-F371 HydrophobicContact CG2-CD2 4.4Å; V367-F371 HydrophobicContact CG2-CE2 3.71Å; V367-F371 HydrophobicContact CG2-CZ 4.27Å; V367-S382 WeakPolarHBondContact O-CA 3.48Å; V367-S382 WeakPolarHBondContact O-CB 3.39Å
368	P	97.7	Very high	96.8	Very high	25 Å²	25	50.6 Å²	50.6	16%	0.162	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	cis	-93.1	-9.9	15.4	36.3	-37.2	0	0	0	116.4	R370 F371 F376 C380	P368-R370 PolarHBondContact O-N 3.14Å; P368-R370 VanDerWaalsContact O-N 3.08Å; P368-F371 PolarHBondContact O-N 3.36Å; P368-F376 HydrophobicContact CB-CD2 4.43Å; P368-F376 HydrophobicContact CB-CE1 4.39Å; P368-F376 HydrophobicContact CB-CE2 4.1Å; P368-F376 HydrophobicContact CB-CZ 4.08Å; P368-F376 HydrophobicContact CG-CD1 3.71Å; P368-F376 HydrophobicContact CG-CD2 4.12Å; P368-F376 HydrophobicContact CG-CE1 3.67Å; P368-F376 HydrophobicContact CG-CE2 4.08Å; P368-F376 HydrophobicContact CG-CG 3.95Å; P368-F376 HydrophobicContact CG-CZ 3.86Å; P368-C380 WeakPolarHBondContact CD-O 3.21Å; P368-C380 VanDerWaalsContact CG-O 3.27Å; P368-C380 WeakPolarHBondContact CG-O 3.33Å
369	E	97.8	Very high	96.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.9	-171.1	69.4	-85.7	-159.6	0	0	114	N155 F157 L158 R366 F371 Y372 P373 F376 Q381 S382	N155-E369 PolarHBondContact ND2-OE1 3.29Å; F157-E369 HydrophobicContact CB-CB 4.11Å; F157-E369 HydrophobicContact CB-CG 3.71Å; F157-E369 HydrophobicContact CD2-CG 4.25Å; F157-E369 HydrophobicContact CG-CG 4.45Å; L158-E369 HydrophobicContact CD2-CB 4.12Å; L158-E369 HydrophobicContact CD2-CG 4.11Å; R366-E369 VanDerWaalsContact C-CD 3.45Å; R366-E369 WeakPolarHBondContact CA-OE1 3.28Å; R366-E369 HydrophobicContact CB-CG 4.45Å; R366-E369 PolarHBondContact O-N 3.21Å; E369-F371 VanDerWaalsContact C-N 3.26Å; E369-F371 PolarHBondContact O-N 2.92Å; E369-Y372 CarbonylContact O-C 3.57Å; E369-Y372 PolarHBondContact O-N 3.12Å; E369-P373 WeakPolarHBondContact O-CA 3.29Å; E369-P373 VanDerWaalsContact O-N 3.16Å; E369-F376 HydrophobicContact CB-CB 3.95Å; E369-Q381 HydrophobicContact CB-CB 4.46Å; E369-Q381 HydrophobicContact CG-CB 4.49Å; E369-S382 VanDerWaalsContact OE1-CB 3.29Å; E369-S382 WeakPolarHBondContact OE1-CB 3.19Å; E369-S382 PolarHBondContact OE1-N 3.32Å; E369-S382 PolarHBondContact OE1-OG 3.14Å; E369-S382 WeakPolarHBondContact OE2-CB 3.34Å; E369-S382 PolarHBondContact OE2-N 3.1Å
370	R	97.1	Very high	96.6	Very high	101 Å²	101	53.6 Å²	53.6	38%	0.381	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-40.9	169.8	175.4	-174.6	-66.1	-141.6	2.1	112.4	F157 L365 R366 P368	F157-R370 HydrophobicContact CD2-CB 3.96Å; F157-R370 HydrophobicContact CE2-CB 3.61Å; F157-R370 HydrophobicContact CE2-CG 3.82Å; F157-R370 HydrophobicContact CZ-CB 4.12Å; F157-R370 HydrophobicContact CZ-CG 3.88Å; L365-R370 PolarHBondContact O-NE 3.12Å; L365-R370 PolarHBondContact O-NH2 2.91Å; R366-R370 WeakPolarHBondContact O-CB 3.44Å; R366-R370 PolarHBondContact O-N 2.84Å; P368-R370 PolarHBondContact O-N 3.14Å; P368-R370 VanDerWaalsContact O-N 3.08Å
371	F	97.1	Very high	96.6	Very high	131 Å²	131	53.3 Å²	53.3	58%	0.575	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-28.5	-175	-60.5	-59.4	0	0	0	112.3	V367 P368 E369	V367-F371 HydrophobicContact CB-CE2 4.38Å; V367-F371 HydrophobicContact CG1-CD2 4.21Å; V367-F371 HydrophobicContact CG1-CE2 3.81Å; V367-F371 HydrophobicContact CG2-CD2 4.4Å; V367-F371 HydrophobicContact CG2-CE2 3.71Å; V367-F371 HydrophobicContact CG2-CZ 4.27Å; P368-F371 PolarHBondContact O-N 3.36Å; E369-F371 VanDerWaalsContact C-N 3.26Å; E369-F371 PolarHBondContact O-N 2.92Å
372	Y	96.3	Very high	96.7	Very high	134 Å²	134	50 Å²	50	53%	0.525	24%	0.244	S	C	.	.	S	Bend	trans	-133.4	71.8	179.8	-49.4	-85.5	0	0	0	110.9	E369 G374 K375 F376	E369-Y372 CarbonylContact O-C 3.57Å; E369-Y372 PolarHBondContact O-N 3.12Å; Y372-G374 PolarHBondContact O-N 2.62Å; Y372-K375 PolarHBondContact O-N 3.13Å; Y372-K375 VanDerWaalsContact O-N 3.14Å; Y372-F376 AromaticContact CD2-CE2 3.67Å; Y372-F376 HydrophobicContact CD2-CE2 3.67Å; Y372-F376 HydrophobicContact CD2-CZ 4.45Å; Y372-F376 HydrophobicContact CG-CE2 4.03Å
373	P	96.2	Very high	96.7	Very high	59 Å²	59	48.8 Å²	48.8	38%	0.383	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	134	-179.4	-22.7	33.9	0	0	0	111.3	F157 E369 K375	F157-P373 HydrophobicContact CB-CB 4.49Å; F157-P373 HydrophobicContact CD1-CB 4.32Å; F157-P373 HydrophobicContact CD1-CG 4Å; F157-P373 WeakPolarHBondContact O-CA 3.43Å; E369-P373 WeakPolarHBondContact O-CA 3.29Å; E369-P373 VanDerWaalsContact O-N 3.16Å; P373-K375 VanDerWaalsContact C-N 3.3Å; P373-K375 PolarHBondContact O-N 3.05Å
374	G	95.1	Very high	96.7	Very high	27 Å²	27	48.4 Å²	48.4	28%	0.278	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	-17.9	-177.8	0	0	0	0	0	115.5	F157 Y372 D377	F157-G374 PolarHBondContact O-N 3.02Å; Y372-G374 PolarHBondContact O-N 2.62Å; G374-D377 VanDerWaalsContact CA-OD1 3.25Å; G374-D377 WeakPolarHBondContact CA-OD1 3.26Å
375	K	95.6	Very high	96.8	Very high	124 Å²	124	49.2 Å²	49.2	54%	0.539	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-23.2	-179.3	-64.2	-68.1	-174.4	176.5	0	113.2	L95 Y372 P373	L95-K375 PolarHBondContact O-NZ 3.02Å; Y372-K375 PolarHBondContact O-N 3.13Å; Y372-K375 VanDerWaalsContact O-N 3.14Å; P373-K375 VanDerWaalsContact C-N 3.3Å; P373-K375 PolarHBondContact O-N 3.05Å
376	F	96.3	Very high	96.9	Very high	47 Å²	47	46.8 Å²	46.8	21%	0.206	22%	0.223	C	C	.	.	S	Bend	trans	-110.4	25.7	-178.2	-66.1	-85.4	0	0	0	112.5	P368 E369 Y372 I378 W379 C380 Q381	P368-F376 HydrophobicContact CB-CD2 4.43Å; P368-F376 HydrophobicContact CB-CE1 4.39Å; P368-F376 HydrophobicContact CB-CE2 4.1Å; P368-F376 HydrophobicContact CB-CZ 4.08Å; P368-F376 HydrophobicContact CG-CD1 3.71Å; P368-F376 HydrophobicContact CG-CD2 4.12Å; P368-F376 HydrophobicContact CG-CE1 3.67Å; P368-F376 HydrophobicContact CG-CE2 4.08Å; P368-F376 HydrophobicContact CG-CG 3.95Å; P368-F376 HydrophobicContact CG-CZ 3.86Å; E369-F376 HydrophobicContact CB-CB 3.95Å; Y372-F376 AromaticContact CD2-CE2 3.67Å; Y372-F376 HydrophobicContact CD2-CE2 3.67Å; Y372-F376 HydrophobicContact CD2-CZ 4.45Å; Y372-F376 HydrophobicContact CG-CE2 4.03Å; F376-I378 VanDerWaalsContact C-N 3.34Å; F376-I378 PolarHBondContact O-N 2.93Å; F376-W379 WeakPolarHBondContact CD1-O 2.97Å; F376-C380 HydrophobicContact CD1-CB 3.87Å; F376-C380 HydrophobicContact CE1-CB 4.13Å; F376-Q381 HydrophobicContact CB-CB 4.34Å; F376-Q381 WeakPolarHBondContact O-CB 3.23Å
377	D	96.2	Very high	97	Very high	8 Å²	8	44.3 Å²	44.3	4%	0.043	21%	0.214	C	C	.	.	S	Bend	trans	-58.9	-42.8	-174.4	-75.3	-7.1	0	0	0	112.9	L158 K159 S160 T181 G374	L158-D377 WeakPolarHBondContact CA-OD1 3.39Å; K159-D377 PolarHBondContact N-OD1 2.86Å; K159-D377 PolarHBondContact N-OD2 3.22Å; S160-D377 WeakPolarHBondContact CA-OD2 3.2Å; S160-D377 WeakPolarHBondContact CB-OD2 3.17Å; S160-D377 PolarHBondContact N-OD2 2.83Å; S160-D377 PolarHBondContact OG-OD2 3.43Å; T181-D377 WeakPolarHBondContact CA-O 3.29Å; T181-D377 VanDerWaalsContact CG2-O 3.3Å; T181-D377 WeakPolarHBondContact CG2-O 3.4Å; G374-D377 VanDerWaalsContact CA-OD1 3.25Å; G374-D377 WeakPolarHBondContact CA-OD1 3.26Å
378	I	95.9	Very high	97	Very high	35 Å²	35	47.4 Å²	47.4	18%	0.179	23%	0.229	C	C	.	.	S	Bend	trans	-102.9	-37.8	-174.8	-53.6	-57.8	0	0	0	112.4	I179 F376 Q384	I179-I378 HydrophobicContact CG2-CD1 4.4Å; I179-I378 HydrophobicContact CG2-CG1 4.45Å; I179-I378 HydrophobicContact CG2-CG2 3.57Å; F376-I378 VanDerWaalsContact C-N 3.34Å; F376-I378 PolarHBondContact O-N 2.93Å; I378-Q384 PolarHBondContact O-NE2 2.58Å; I378-Q384 PolarHBondContact O-OE1 3.49Å
379	W	96.9	Very high	97	Very high	58 Å²	58	48.9 Å²	48.9	22%	0.22	23%	0.233	C	C	.	.	S	Bend	trans	-127.1	145	-171.4	-60.4	118.4	0	0	0	111.6	L103 A109 L113 T183 F376 Q381	L103-W379 HydrophobicContact CD1-CB 3.85Å; L103-W379 HydrophobicContact CD1-CG 4.48Å; L103-W379 HydrophobicContact CD2-CB 4.2Å; A109-W379 HydrophobicContact CB-CZ2 4.41Å; L113-W379 HydrophobicContact CD1-CH2 3.63Å; L113-W379 HydrophobicContact CD1-CZ2 3.97Å; T183-W379 HydrophobicContact CG2-CH2 4.32Å; F376-W379 WeakPolarHBondContact CD1-O 2.97Å; W379-Q381 PolarHBondContact O-N 2.86Å
380	C	95.6	Very high	97.1	Very high	51 Å²	51	49.3 Å²	49.3	35%	0.345	24%	0.235	S	C	.	.	S	Bend	trans	61.5	21.9	169.7	-61.1	0	0	0	0	115.5	P368 F376 I385	P368-C380 WeakPolarHBondContact CD-O 3.21Å; P368-C380 VanDerWaalsContact CG-O 3.27Å; P368-C380 WeakPolarHBondContact CG-O 3.33Å; F376-C380 HydrophobicContact CD1-CB 3.87Å; F376-C380 HydrophobicContact CE1-CB 4.13Å; C380-I385 WeakPolarHBondContact O-CD1 3.29Å
381	Q	96.9	Very high	97.1	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.019	22%	0.224	C	C	.	.			trans	-71.5	156.5	166.5	59	85.8	7.3	0	0	111.9	L158 N185 E369 F376 W379 H383 Q384 I385	L158-Q381 HydrophobicContact CD1-CG 4.39Å; L158-Q381 HydrophobicContact CD2-CB 3.8Å; L158-Q381 HydrophobicContact CD2-CG 4.11Å; N185-Q381 PolarHBondContact ND2-NE2 3.2Å; N185-Q381 PolarHBondContact OD1-NE2 2.85Å; N185-Q381 VanDerWaalsContact OD1-NE2 3.09Å; E369-Q381 HydrophobicContact CB-CB 4.46Å; E369-Q381 HydrophobicContact CG-CB 4.49Å; F376-Q381 HydrophobicContact CB-CB 4.34Å; F376-Q381 WeakPolarHBondContact O-CB 3.23Å; W379-Q381 PolarHBondContact O-N 2.86Å; Q381-H383 VanDerWaalsContact C-N 3.26Å; Q381-H383 PolarHBondContact O-N 3.25Å; Q381-H383 VanDerWaalsContact O-N 3.1Å; Q381-Q384 HydrophobicContact CG-CG 4.28Å; Q381-Q384 WeakPolarHBondContact O-CB 3.23Å; Q381-Q384 PolarHBondContact O-N 3.34Å; Q381-I385 PolarHBondContact O-N 3.49Å; Q381-I385 VanDerWaalsContact O-N 3.13Å
382	S	97.8	Very high	97.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-49.7	-39.7	-171.5	65.1	0	0	0	0	115.5	L362 R366 V367 E369 I385 F386	L362-S382 VanDerWaalsContact O-CB 3.28Å; L362-S382 WeakPolarHBondContact O-CB 3.42Å; R366-S382 WeakPolarHBondContact CA-OG 3.2Å; V367-S382 WeakPolarHBondContact O-CA 3.48Å; V367-S382 WeakPolarHBondContact O-CB 3.39Å; E369-S382 VanDerWaalsContact OE1-CB 3.29Å; E369-S382 WeakPolarHBondContact OE1-CB 3.19Å; E369-S382 PolarHBondContact OE1-N 3.32Å; E369-S382 PolarHBondContact OE1-OG 3.14Å; E369-S382 WeakPolarHBondContact OE2-CB 3.34Å; E369-S382 PolarHBondContact OE2-N 3.1Å; S382-I385 PolarHBondContact O-N 2.85Å; S382-F386 WeakPolarHBondContact O-CB 3.41Å; S382-F386 PolarHBondContact O-N 3.21Å
383	H	97.8	Very high	97.3	Very high	19 Å²	19	34.8 Å²	34.8	9%	0.088	19%	0.187	C	C	.	.	H	α-helix	trans	-69.7	-37.4	-179.6	-148.8	147.4	0	0	0	111.1	H237 Y363 Q381 F386 H387	H237-H383 AromaticContact CE1-CE1 3.7Å; H237-H383 AromaticContact CE1-NE2 3.67Å; H237-H383 AromaticContact NE2-NE2 3.64Å; Y363-H383 AromaticContact CE2-CE1 3.67Å; Y363-H383 AromaticContact CE2-ND1 3.73Å; Y363-H383 AromaticContact CE2-NE2 3.93Å; Q381-H383 VanDerWaalsContact C-N 3.26Å; Q381-H383 PolarHBondContact O-N 3.25Å; Q381-H383 VanDerWaalsContact O-N 3.1Å; H383-F386 WeakPolarHBondContact O-CB 3.46Å; H383-F386 PolarHBondContact O-N 3.17Å; H383-H387 AromaticContact CD2-CD2 3.52Å; H383-H387 AromaticContact CD2-NE2 3.32Å; H383-H387 PolarHBondContact CD2-NE2 2.87Å; H383-H387 VanDerWaalsContact CD2-NE2 3.32Å; H383-H387 AromaticContact NE2-NE2 3.47Å; H383-H387 PolarHBondContact NE2-NE2 3.27Å; H383-H387 PolarHBondContact O-CD2 3.2Å; H383-H387 PolarHBondContact O-N 3.17Å
384	Q	98	Very high	97.4	Very high	10 Å²	10	32 Å²	32	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-65.9	-42.4	173.3	-77.1	177.1	1.9	0	0	111.3	N185 I378 Q381 F386 H387 L388	N185-Q384 WeakPolarHBondContact OD1-CA 3.49Å; N185-Q384 WeakPolarHBondContact OD1-CG 3.37Å; N185-Q384 PolarHBondContact OD1-N 3.44Å; I378-Q384 PolarHBondContact O-NE2 2.58Å; I378-Q384 PolarHBondContact O-OE1 3.49Å; Q381-Q384 HydrophobicContact CG-CG 4.28Å; Q381-Q384 WeakPolarHBondContact O-CB 3.23Å; Q381-Q384 PolarHBondContact O-N 3.34Å; Q384-F386 VanDerWaalsContact C-N 3.31Å; Q384-F386 PolarHBondContact O-N 2.89Å; Q384-H387 PolarHBondContact O-N 2.93Å; Q384-L388 WeakPolarHBondContact O-CG 3.26Å; Q384-L388 PolarHBondContact O-N 3.49Å
385	I	97.8	Very high	97.5	Very high	36 Å²	36	34.1 Å²	34.1	19%	0.185	17%	0.171	C	C	.	.	H	α-helix	trans	-63.4	-42.4	176.8	-59.6	170.2	0	0	0	110	L362 C380 Q381 S382 H387 L388 F389	L362-I385 HydrophobicContact CD1-CG2 3.67Å; C380-I385 WeakPolarHBondContact O-CD1 3.29Å; Q381-I385 PolarHBondContact O-N 3.49Å; Q381-I385 VanDerWaalsContact O-N 3.13Å; S382-I385 PolarHBondContact O-N 2.85Å; I385-H387 PolarHBondContact O-N 3.25Å; I385-L388 PolarHBondContact O-N 3.28Å; I385-F389 HydrophobicContact CG2-CD1 4.08Å; I385-F389 HydrophobicContact CG2-CE1 3.79Å; I385-F389 HydrophobicContact CG2-CE2 4.4Å; I385-F389 HydrophobicContact CG2-CZ 3.97Å; I385-F389 WeakPolarHBondContact O-CD1 3.46Å; I385-F389 PolarHBondContact O-N 3.33Å
386	F	98.2	Very high	97.7	Very high	31 Å²	31	29.3 Å²	29.3	14%	0.136	15%	0.152	C	C	.	.	H	α-helix	trans	-57.5	-46.4	173.8	170.8	-113.3	0	0	0	112	Y363 S382 H383 Q384 L388 F389 V390	Y363-F386 HydrophobicContact CD2-CD1 4.3Å; S382-F386 WeakPolarHBondContact O-CB 3.41Å; S382-F386 PolarHBondContact O-N 3.21Å; H383-F386 WeakPolarHBondContact O-CB 3.46Å; H383-F386 PolarHBondContact O-N 3.17Å; Q384-F386 VanDerWaalsContact C-N 3.31Å; Q384-F386 PolarHBondContact O-N 2.89Å; F386-L388 PolarHBondContact O-N 3.03Å; F386-F389 PolarHBondContact O-N 3.37Å; F386-F389 VanDerWaalsContact O-N 3.14Å; F386-V390 HydrophobicContact CD2-CG2 4.08Å; F386-V390 HydrophobicContact CE1-CG2 4.14Å; F386-V390 HydrophobicContact CE2-CG2 3.6Å; F386-V390 HydrophobicContact CZ-CG2 3.62Å; F386-V390 WeakPolarHBondContact O-CG2 3.47Å; F386-V390 PolarHBondContact O-N 3.12Å
387	H	98.5	Very high	97.7	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-58.5	-45.6	176.2	-79.5	-146.9	0	0	0	112.4	N185 T188 H189 S233 H237 H383 Q384 I385 F389 V390 V391	N185-H387 PolarHBondContact O-CE1 3.32Å; N185-H387 PolarHBondContact O-ND1 2.8Å; T188-H387 VanDerWaalsContact OG1-CB 3.31Å; T188-H387 WeakPolarHBondContact OG1-CB 3.41Å; T188-H387 PolarHBondContact OG1-ND1 3.38Å; H189-H387 AromaticContact CD2-CG 3.73Å; H189-H387 AromaticContact CD2-ND1 3.66Å; H189-H387 AromaticContact CE1-CD2 3.49Å; H189-H387 PolarHBondContact CE1-CD2 3.34Å; H189-H387 VanDerWaalsContact CE1-CD2 3.49Å; H189-H387 AromaticContact CE1-CE1 3.59Å; H189-H387 AromaticContact CE1-CG 3.42Å; H189-H387 VanDerWaalsContact CE1-CG 3.42Å; H189-H387 AromaticContact CE1-ND1 3.49Å; H189-H387 PolarHBondContact CE1-ND1 2.9Å; H189-H387 AromaticContact CE1-NE2 3.6Å; H189-H387 AromaticContact CG-CE1 3.89Å; H189-H387 AromaticContact CG-CG 3.97Å; H189-H387 AromaticContact CG-ND1 3.45Å; H189-H387 AromaticContact ND1-CE1 3.34Å; H189-H387 PolarHBondContact ND1-CE1 3.09Å; H189-H387 VanDerWaalsContact ND1-CE1 3.34Å; H189-H387 AromaticContact ND1-CG 3.77Å; H189-H387 AromaticContact ND1-ND1 3.33Å; H189-H387 PolarHBondContact ND1-ND1 3.27Å; H189-H387 AromaticContact ND1-NE2 3.79Å; H189-H387 VanDerWaalsContact NE2-CA 3.31Å; H189-H387 WeakPolarHBondContact NE2-CA 3.38Å; H189-H387 WeakPolarHBondContact NE2-CB 3.46Å; H189-H387 AromaticContact NE2-CD2 3.83Å; H189-H387 AromaticContact NE2-CG 3.41Å; H189-H387 AromaticContact NE2-ND1 3.72Å; H189-H387 PolarHBondContact NE2-O 3.12Å; S233-H387 PolarHBondContact OG-CE1 2.73Å; H237-H387 AromaticContact CD2-CE1 3.45Å; H237-H387 PolarHBondContact CD2-CE1 3Å; H237-H387 VanDerWaalsContact CD2-CE1 3.45Å; H237-H387 AromaticContact CD2-NE2 4Å; H237-H387 AromaticContact NE2-CE1 3.31Å; H237-H387 PolarHBondContact NE2-CE1 2.85Å; H237-H387 VanDerWaalsContact NE2-CE1 3.31Å; H237-H387 AromaticContact NE2-NE2 3.39Å; H237-H387 PolarHBondContact NE2-NE2 3.15Å; H383-H387 AromaticContact CD2-CD2 3.52Å; H383-H387 AromaticContact CD2-NE2 3.32Å; H383-H387 PolarHBondContact CD2-NE2 2.87Å; H383-H387 VanDerWaalsContact CD2-NE2 3.32Å; H383-H387 AromaticContact NE2-NE2 3.47Å; H383-H387 PolarHBondContact NE2-NE2 3.27Å; H383-H387 PolarHBondContact O-CD2 3.2Å; H383-H387 PolarHBondContact O-N 3.17Å; Q384-H387 PolarHBondContact O-N 2.93Å; I385-H387 PolarHBondContact O-N 3.25Å; H387-F389 VanDerWaalsContact C-N 3.29Å; H387-F389 PolarHBondContact O-N 2.74Å; H387-V390 PolarHBondContact O-N 2.74Å; H387-V391 WeakPolarHBondContact O-CG2 3.48Å; H387-V391 PolarHBondContact O-N 3.15Å; H387-V391 VanDerWaalsContact O-N 3.09Å
388	L	98.1	Very high	97.8	Very high	94 Å²	94	29.3 Å²	29.3	49%	0.492	15%	0.15	S	C	.	.	H	α-helix	trans	-59.7	-41.7	176	-70.7	171	0	0	0	111.6	T188 Q384 I385 F386 V391 A392	T188-L388 HydrophobicContact CG2-CD2 3.57Å; T188-L388 HydrophobicContact CG2-CG 3.96Å; Q384-L388 WeakPolarHBondContact O-CG 3.26Å; Q384-L388 PolarHBondContact O-N 3.49Å; I385-L388 PolarHBondContact O-N 3.28Å; F386-L388 PolarHBondContact O-N 3.03Å; L388-V391 PolarHBondContact O-N 3.19Å; L388-A392 WeakPolarHBondContact O-CB 3.34Å; L388-A392 PolarHBondContact O-N 3.35Å
389	F	98.4	Very high	97.8	Very high	56 Å²	56	31.2 Å²	31.2	25%	0.246	16%	0.159	C	C	.	.	H	α-helix	trans	-69.5	-36	179.9	-79.1	22.6	0	0	0	111.9	L355 S358 L362 I385 F386 H387 A392 A393	L355-F389 VanDerWaalsContact O-CD2 3.27Å; L355-F389 WeakPolarHBondContact O-CD2 3.31Å; S358-F389 WeakPolarHBondContact OG-CD2 3.44Å; S358-F389 WeakPolarHBondContact OG-CE2 3.35Å; L362-F389 HydrophobicContact CD1-CE2 4.22Å; I385-F389 HydrophobicContact CG2-CD1 4.08Å; I385-F389 HydrophobicContact CG2-CE1 3.79Å; I385-F389 HydrophobicContact CG2-CE2 4.4Å; I385-F389 HydrophobicContact CG2-CZ 3.97Å; I385-F389 WeakPolarHBondContact O-CD1 3.46Å; I385-F389 PolarHBondContact O-N 3.33Å; F386-F389 PolarHBondContact O-N 3.37Å; F386-F389 VanDerWaalsContact O-N 3.14Å; H387-F389 VanDerWaalsContact C-N 3.29Å; H387-F389 PolarHBondContact O-N 2.74Å; F389-A392 PolarHBondContact O-N 3.1Å; F389-A393 WeakPolarHBondContact O-CB 3.39Å; F389-A393 PolarHBondContact O-N 2.95Å
390	V	98.5	Very high	97.8	Very high	9 Å²	9	28.8 Å²	28.8	6%	0.055	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-48.1	173.3	169.9	0	0	0	0	110.7	L230 L261 Y356 F386 H387 A393 A394	L230-V390 HydrophobicContact CD2-CG1 4.23Å; L261-V390 HydrophobicContact CD2-CG1 4.08Å; Y356-V390 HydrophobicContact CD1-CG2 4.38Å; Y356-V390 HydrophobicContact CE1-CB 4.33Å; Y356-V390 HydrophobicContact CE1-CG1 4.3Å; Y356-V390 HydrophobicContact CE1-CG2 4.18Å; F386-V390 HydrophobicContact CD2-CG2 4.08Å; F386-V390 HydrophobicContact CE1-CG2 4.14Å; F386-V390 HydrophobicContact CE2-CG2 3.6Å; F386-V390 HydrophobicContact CZ-CG2 3.62Å; F386-V390 WeakPolarHBondContact O-CG2 3.47Å; F386-V390 PolarHBondContact O-N 3.12Å; H387-V390 PolarHBondContact O-N 2.74Å; V390-A393 PolarHBondContact O-N 3.47Å; V390-A394 WeakPolarHBondContact O-CB 3.35Å; V390-A394 PolarHBondContact O-N 3.18Å
391	V	98.5	Very high	97.8	Very high	22 Å²	22	26.4 Å²	26.4	13%	0.133	14%	0.135	C	C	.	.	H	α-helix	trans	-62.8	-47.7	178	175.5	0	0	0	0	111	L230 H387 L388 A393 A394 F395	L230-V391 HydrophobicContact CD2-CG2 3.95Å; H387-V391 WeakPolarHBondContact O-CG2 3.48Å; H387-V391 PolarHBondContact O-N 3.15Å; H387-V391 VanDerWaalsContact O-N 3.09Å; L388-V391 PolarHBondContact O-N 3.19Å; V391-A393 PolarHBondContact O-N 3.28Å; V391-A394 PolarHBondContact O-N 3.39Å; V391-F395 HydrophobicContact CG1-CD2 3.91Å; V391-F395 HydrophobicContact CG1-CE2 3.65Å; V391-F395 VanDerWaalsContact O-CD2 3.23Å; V391-F395 WeakPolarHBondContact O-CD2 3.32Å; V391-F395 PolarHBondContact O-N 3.43Å; V391-F395 VanDerWaalsContact O-N 3.09Å
392	A	98.3	Very high	97.7	Very high	40 Å²	40	27.9 Å²	27.9	33%	0.331	14%	0.144	S	C	.	.	H	α-helix	trans	-60.9	-45.7	178.2	0	0	0	0	0	112	L355 L388 F389 A394 F395 V396	L355-A392 HydrophobicContact CD1-CB 4.23Å; L388-A392 WeakPolarHBondContact O-CB 3.34Å; L388-A392 PolarHBondContact O-N 3.35Å; F389-A392 PolarHBondContact O-N 3.1Å; A392-A394 VanDerWaalsContact C-N 3.32Å; A392-A394 PolarHBondContact O-N 3.46Å; A392-F395 PolarHBondContact O-N 3.31Å; A392-V396 WeakPolarHBondContact O-CG2 3.39Å; A392-V396 PolarHBondContact O-N 3.27Å
393	A	98.4	Very high	97.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.2	-37.1	178.2	0	0	0	0	0	112	M352 L355 Y356 F389 V390 V391 V396 H397	M352-A393 HydrophobicContact CG-CB 4.25Å; L355-A393 HydrophobicContact CB-CB 3.84Å; L355-A393 HydrophobicContact CD1-CB 4.27Å; Y356-A393 HydrophobicContact CD1-CB 3.85Å; Y356-A393 HydrophobicContact CD2-CB 3.77Å; Y356-A393 HydrophobicContact CE1-CB 3.64Å; Y356-A393 HydrophobicContact CE2-CB 3.56Å; Y356-A393 HydrophobicContact CG-CB 3.9Å; Y356-A393 VanDerWaalsContact CZ-CB 3.48Å; F389-A393 WeakPolarHBondContact O-CB 3.39Å; F389-A393 PolarHBondContact O-N 2.95Å; V390-A393 PolarHBondContact O-N 3.47Å; V391-A393 PolarHBondContact O-N 3.28Å; A393-V396 PolarHBondContact O-N 3.03Å; A393-H397 WeakPolarHBondContact O-CB 3.24Å; A393-H397 PolarHBondContact O-N 2.79Å
394	A	98.2	Very high	97.3	Very high	1 Å²	1	31 Å²	31	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-65.1	-39.1	174.6	0	0	0	0	0	112.1	F196 V390 V391 A392 H397 Y398	F196-A394 HydrophobicContact CE1-CB 4.45Å; F196-A394 HydrophobicContact CE2-CB 3.77Å; F196-A394 HydrophobicContact CZ-CB 3.46Å; F196-A394 VanDerWaalsContact CZ-CB 3.46Å; V390-A394 WeakPolarHBondContact O-CB 3.35Å; V390-A394 PolarHBondContact O-N 3.18Å; V391-A394 PolarHBondContact O-N 3.39Å; A392-A394 VanDerWaalsContact C-N 3.32Å; A392-A394 PolarHBondContact O-N 3.46Å; A394-H397 PolarHBondContact O-N 2.9Å; A394-Y398 WeakPolarHBondContact O-CB 3.45Å; A394-Y398 PolarHBondContact O-N 3.03Å
395	F	98.1	Very high	97	Very high	70 Å²	70	30.9 Å²	30.9	31%	0.307	16%	0.16	S	C	.	.	H	α-helix	trans	-68.3	-41.9	173.2	-80.5	-67.1	0	0	0	112.7	T195 F196 V199 V391 A392 H397 Y398 H399	T195-F395 HydrophobicContact CG2-CE1 4.19Å; T195-F395 HydrophobicContact CG2-CZ 3.54Å; F196-F395 HydrophobicContact CD2-CZ 4.29Å; F196-F395 HydrophobicContact CE2-CD2 4.22Å; F196-F395 HydrophobicContact CE2-CE1 4.28Å; F196-F395 AromaticContact CE2-CE2 3.9Å; F196-F395 HydrophobicContact CE2-CE2 3.9Å; F196-F395 AromaticContact CE2-CZ 3.9Å; F196-F395 HydrophobicContact CE2-CZ 3.9Å; F196-F395 HydrophobicContact CZ-CD1 4.23Å; F196-F395 HydrophobicContact CZ-CD2 4.45Å; F196-F395 HydrophobicContact CZ-CE1 4.22Å; F196-F395 HydrophobicContact CZ-CE2 4.45Å; F196-F395 HydrophobicContact CZ-CG 4.33Å; F196-F395 HydrophobicContact CZ-CZ 4.3Å; V199-F395 HydrophobicContact CG2-CE1 4.41Å; V391-F395 HydrophobicContact CG1-CD2 3.91Å; V391-F395 HydrophobicContact CG1-CE2 3.65Å; V391-F395 VanDerWaalsContact O-CD2 3.23Å; V391-F395 WeakPolarHBondContact O-CD2 3.32Å; V391-F395 PolarHBondContact O-N 3.43Å; V391-F395 VanDerWaalsContact O-N 3.09Å; A392-F395 PolarHBondContact O-N 3.31Å; F395-H397 VanDerWaalsContact C-N 3.28Å; F395-H397 PolarHBondContact O-N 2.86Å; F395-Y398 PolarHBondContact O-N 3.27Å; F395-H399 PolarHBondContact O-N 2.8Å
396	V	98.2	Very high	96.6	Very high	23 Å²	23	33 Å²	33	14%	0.139	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-42	174.1	171.1	0	0	0	0	110.5	W348 L351 M352 L355 A392 A393 H399 G400	W348-V396 HydrophobicContact CB-CG1 4.48Å; W348-V396 HydrophobicContact CE3-CG1 4.05Å; W348-V396 WeakPolarHBondContact O-CG1 3.26Å; L351-V396 HydrophobicContact CB-CG1 4.11Å; L351-V396 HydrophobicContact CD2-CG1 3.97Å; L351-V396 HydrophobicContact CD2-CG2 3.99Å; L351-V396 HydrophobicContact CG-CG1 4.02Å; L351-V396 HydrophobicContact CG-CG2 4.33Å; M352-V396 HydrophobicContact CB-CB 4.48Å; M352-V396 HydrophobicContact CB-CG1 3.93Å; L355-V396 HydrophobicContact CD1-CG2 3.88Å; A392-V396 WeakPolarHBondContact O-CG2 3.39Å; A392-V396 PolarHBondContact O-N 3.27Å; A393-V396 PolarHBondContact O-N 3.03Å; V396-H399 PolarHBondContact O-N 3.36Å; V396-G400 PolarHBondContact O-N 3.42Å
397	H	97.8	Very high	96.2	Very high	11 Å²	11	33.6 Å²	33.6	5%	0.051	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-49.5	174.8	-176.9	77.2	0	0	0	111.7	F222 S265 M352 A393 A394 F395 H399 G400 I401	F222-H397 AromaticContact CD2-CD2 3.79Å; F222-H397 AromaticContact CE2-CD2 3.52Å; F222-H397 AromaticContact CZ-CD2 3.86Å; S265-H397 WeakPolarHBondContact CA-NE2 3.47Å; S265-H397 WeakPolarHBondContact CB-NE2 3.06Å; S265-H397 PolarHBondContact O-CE1 2.82Å; S265-H397 PolarHBondContact O-NE2 2.82Å; M352-H397 HydrophobicContact CG-CB 4.18Å; A393-H397 WeakPolarHBondContact O-CB 3.24Å; A393-H397 PolarHBondContact O-N 2.79Å; A394-H397 PolarHBondContact O-N 2.9Å; F395-H397 VanDerWaalsContact C-N 3.28Å; F395-H397 PolarHBondContact O-N 2.86Å; H397-H399 VanDerWaalsContact C-N 3.3Å; H397-H399 PolarHBondContact O-N 3.31Å; H397-G400 WeakPolarHBondContact O-CA 3.23Å; H397-G400 PolarHBondContact O-N 3.47Å; H397-G400 VanDerWaalsContact O-N 3.07Å; H397-I401 WeakPolarHBondContact NE2-CG2 3.45Å; H397-I401 WeakPolarHBondContact O-CG1 3.49Å; H397-I401 PolarHBondContact O-N 2.85Å
398	Y	97.4	Very high	95.6	Very high	44 Å²	44	36.4 Å²	36.4	17%	0.173	19%	0.191	C	C	.	.	H	α-helix	trans	-54.6	-45.8	177	173.9	-114.1	0	0	0	111.9	V199 F219 F222 F223 A394 F395 I401 T402	V199-Y398 HydrophobicContact CG1-CD1 4.45Å; V199-Y398 HydrophobicContact CG1-CE1 3.86Å; V199-Y398 HydrophobicContact CG1-CE2 4.23Å; F219-Y398 HydrophobicContact CD1-CD2 4.4Å; F219-Y398 HydrophobicContact CD1-CE2 4.1Å; F219-Y398 HydrophobicContact CE1-CD2 4.18Å; F219-Y398 AromaticContact CE1-CE2 3.93Å; F219-Y398 HydrophobicContact CE1-CE2 3.93Å; F222-Y398 HydrophobicContact CE1-CD2 4.13Å; F222-Y398 HydrophobicContact CE1-CG 4.41Å; F223-Y398 AromaticContact CE1-CD2 3.9Å; F223-Y398 HydrophobicContact CE1-CD2 3.9Å; F223-Y398 AromaticContact CE1-CE2 3.8Å; F223-Y398 HydrophobicContact CE1-CE2 3.8Å; F223-Y398 HydrophobicContact CZ-CD2 4.01Å; F223-Y398 AromaticContact CZ-CE2 3.49Å; F223-Y398 HydrophobicContact CZ-CE2 3.49Å; F223-Y398 VanDerWaalsContact CZ-CE2 3.49Å; A394-Y398 WeakPolarHBondContact O-CB 3.45Å; A394-Y398 PolarHBondContact O-N 3.03Å; F395-Y398 PolarHBondContact O-N 3.27Å; Y398-I401 VanDerWaalsContact O-CG1 3.23Å; Y398-I401 WeakPolarHBondContact O-CG1 3.1Å; Y398-T402 WeakPolarHBondContact O-CB 3.44Å; Y398-T402 PolarHBondContact O-N 2.73Å; Y398-T402 PolarHBondContact O-OG1 3.2Å
399	H	96.6	Very high	94.7	Very high	76 Å²	76	35.8 Å²	35.8	35%	0.352	19%	0.187	S	C	.	.	H	α-helix	trans	-60	-49.9	174.1	-176.8	-79	0	0	0	111.1	W348 F395 V396 H397 I401 T402 E403	W348-H399 AromaticContact CD2-ND1 3.71Å; W348-H399 AromaticContact CE2-CE1 3.41Å; W348-H399 VanDerWaalsContact CE2-CE1 3.41Å; W348-H399 AromaticContact CE2-ND1 3.3Å; W348-H399 VanDerWaalsContact CE2-ND1 3.3Å; W348-H399 AromaticContact CH2-CE1 4Å; W348-H399 AromaticContact CZ2-CE1 3.26Å; W348-H399 WeakPolarHBondContact CZ2-CE1 3.47Å; W348-H399 AromaticContact CZ2-ND1 3.53Å; W348-H399 AromaticContact NE1-CE1 3.59Å; W348-H399 AromaticContact NE1-ND1 3.52Å; F395-H399 PolarHBondContact O-N 2.8Å; V396-H399 PolarHBondContact O-N 3.36Å; H397-H399 VanDerWaalsContact C-N 3.3Å; H397-H399 PolarHBondContact O-N 3.31Å; H399-I401 PolarHBondContact O-N 3.13Å; H399-T402 WeakPolarHBondContact O-CB 3.02Å; H399-T402 PolarHBondContact O-N 2.96Å; H399-T402 VanDerWaalsContact O-N 3.13Å; H399-E403 WeakPolarHBondContact O-CG 3.49Å; H399-E403 PolarHBondContact O-N 3.23Å
400	G	96.3	Very high	94	Very high	6 Å²	6	37.6 Å²	37.6	6%	0.062	21%	0.207	C	C	.	.	H	α-helix	trans	-55.6	-46.8	179.4	0	0	0	0	0	113.7	S345 V396 H397 T402 E403 M404	S345-G400 WeakPolarHBondContact CB-O 3.26Å; S345-G400 PolarHBondContact OG-O 2.75Å; V396-G400 PolarHBondContact O-N 3.42Å; H397-G400 WeakPolarHBondContact O-CA 3.23Å; H397-G400 PolarHBondContact O-N 3.47Å; H397-G400 VanDerWaalsContact O-N 3.07Å; G400-T402 VanDerWaalsContact C-N 3.35Å; G400-E403 PolarHBondContact O-N 2.95Å; G400-M404 WeakPolarHBondContact O-CG 3.49Å; G400-M404 PolarHBondContact O-N 3.19Å; G400-M404 VanDerWaalsContact O-N 3.16Å
401	I	95.7	Very high	92.8	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-72	-28.3	178.3	63.3	173.9	0	0	0	112.8	F219 F222 P268 W269 H397 Y398 H399 M404 A405	F219-I401 HydrophobicContact CD1-CD1 3.84Å; F219-I401 HydrophobicContact CD1-CG1 4.45Å; F219-I401 HydrophobicContact CE1-CD1 3.52Å; F219-I401 HydrophobicContact CE1-CG1 3.64Å; F219-I401 HydrophobicContact CZ-CB 4.39Å; F219-I401 HydrophobicContact CZ-CD1 4.09Å; F219-I401 HydrophobicContact CZ-CG1 3.93Å; F222-I401 HydrophobicContact CD1-CD1 3.96Å; F222-I401 HydrophobicContact CE1-CD1 4.45Å; F222-I401 HydrophobicContact CG-CD1 4.33Å; P268-I401 HydrophobicContact CB-CB 4.29Å; P268-I401 HydrophobicContact CB-CD1 3.85Å; P268-I401 HydrophobicContact CB-CG2 4.24Å; P268-I401 HydrophobicContact CG-CD1 3.65Å; P268-I401 HydrophobicContact CG-CG2 4.23Å; W269-I401 HydrophobicContact CB-CG2 4.18Å; H397-I401 WeakPolarHBondContact NE2-CG2 3.45Å; H397-I401 WeakPolarHBondContact O-CG1 3.49Å; H397-I401 PolarHBondContact O-N 2.85Å; Y398-I401 VanDerWaalsContact O-CG1 3.23Å; Y398-I401 WeakPolarHBondContact O-CG1 3.1Å; H399-I401 PolarHBondContact O-N 3.13Å; I401-M404 PolarHBondContact O-N 3.08Å; I401-A405 WeakPolarHBondContact O-CB 3.46Å; I401-A405 PolarHBondContact O-N 2.68Å
402	T	94.3	Very high	91.1	Very high	36 Å²	36	45.9 Å²	45.9	22%	0.221	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-45.7	174.2	-58.8	0	0	0	0	110.5	Y398 H399 G400 M404 A405 V406	Y398-T402 WeakPolarHBondContact O-CB 3.44Å; Y398-T402 PolarHBondContact O-N 2.73Å; Y398-T402 PolarHBondContact O-OG1 3.2Å; H399-T402 WeakPolarHBondContact O-CB 3.02Å; H399-T402 PolarHBondContact O-N 2.96Å; H399-T402 VanDerWaalsContact O-N 3.13Å; G400-T402 VanDerWaalsContact C-N 3.35Å; T402-M404 VanDerWaalsContact C-N 3.34Å; T402-M404 PolarHBondContact O-N 3.26Å; T402-A405 WeakPolarHBondContact O-CB 3.28Å; T402-A405 PolarHBondContact O-N 3.28Å; T402-A405 VanDerWaalsContact O-N 3.16Å; T402-V406 WeakPolarHBondContact O-CG2 3.36Å; T402-V406 PolarHBondContact O-N 3.22Å
403	E	93.3	Very high	89.6	Confident	83 Å²	83	52 Å²	52	39%	0.388	28%	0.282	S	S	.	.	H	α-helix	trans	-59.6	-43.8	174.7	-67.8	-63.3	104.2	0	0	111.6	S345 H399 G400 A405 V406 V407	S345-E403 WeakPolarHBondContact OG-CB 3.44Å; H399-E403 WeakPolarHBondContact O-CG 3.49Å; H399-E403 PolarHBondContact O-N 3.23Å; G400-E403 PolarHBondContact O-N 2.95Å; E403-A405 VanDerWaalsContact C-N 3.31Å; E403-A405 PolarHBondContact O-N 2.77Å; E403-V406 PolarHBondContact O-N 2.96Å; E403-V407 WeakPolarHBondContact O-CG2 3.27Å; E403-V407 PolarHBondContact O-N 2.87Å
404	M	93.8	Very high	88.4	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-40.5	175.8	-67.2	172.7	76.3	0	0	112.1	W269 Y272 A344 S345 G400 I401 T402 R408	W269-M404 VanDerWaalsContact CD1-SD 3.52Å; W269-M404 WeakPolarHBondContact O-CE 3.11Å; Y272-M404 HydrophobicContact CG-CB 4.32Å; A344-M404 HydrophobicContact CB-CE 4.18Å; S345-M404 WeakPolarHBondContact OG-CG 3.49Å; G400-M404 WeakPolarHBondContact O-CG 3.49Å; G400-M404 PolarHBondContact O-N 3.19Å; G400-M404 VanDerWaalsContact O-N 3.16Å; I401-M404 PolarHBondContact O-N 3.08Å; T402-M404 VanDerWaalsContact C-N 3.34Å; T402-M404 PolarHBondContact O-N 3.26Å; M404-R408 WeakPolarHBondContact O-CG 3.26Å; M404-R408 PolarHBondContact O-N 3.32Å; M404-R408 VanDerWaalsContact O-N 3.07Å
405	A	92.1	Very high	86.8	Confident	7 Å²	7	60.6 Å²	60.6	6%	0.058	33%	0.331	C	S	.	.	H	α-helix	trans	-64.4	-45.1	176.7	0	0	0	0	0	111.3	F219 Y272 I401 T402 E403 V407 R408 L409	F219-A405 HydrophobicContact CE2-CB 4.03Å; F219-A405 HydrophobicContact CZ-CB 4.15Å; Y272-A405 HydrophobicContact CD1-CB 4.32Å; Y272-A405 HydrophobicContact CD2-CB 4.38Å; Y272-A405 HydrophobicContact CE1-CB 3.77Å; Y272-A405 HydrophobicContact CE2-CB 3.88Å; I401-A405 WeakPolarHBondContact O-CB 3.46Å; I401-A405 PolarHBondContact O-N 2.68Å; T402-A405 WeakPolarHBondContact O-CB 3.28Å; T402-A405 PolarHBondContact O-N 3.28Å; T402-A405 VanDerWaalsContact O-N 3.16Å; E403-A405 VanDerWaalsContact C-N 3.31Å; E403-A405 PolarHBondContact O-N 2.77Å; A405-V407 PolarHBondContact O-N 2.83Å; A405-R408 PolarHBondContact O-N 2.86Å; A405-L409 WeakPolarHBondContact O-CB 3.23Å; A405-L409 VanDerWaalsContact O-CG 3.23Å; A405-L409 WeakPolarHBondContact O-CG 3.43Å; A405-L409 PolarHBondContact O-N 2.89Å
406	V	90.4	Very high	84.5	Confident	81 Å²	81	63.2 Å²	63.2	49%	0.491	35%	0.353	S	S	.	.	H	α-helix	trans	-60.1	-45.8	177.4	171.4	0	0	0	0	111.3	T402 E403 R408 L409 S410	T402-V406 WeakPolarHBondContact O-CG2 3.36Å; T402-V406 PolarHBondContact O-N 3.22Å; E403-V406 PolarHBondContact O-N 2.96Å; V406-R408 VanDerWaalsContact C-N 3.33Å; V406-R408 PolarHBondContact O-N 3.48Å; V406-L409 PolarHBondContact O-N 3.17Å; V406-S410 WeakPolarHBondContact O-CB 3.35Å; V406-S410 PolarHBondContact O-N 3.37Å; V406-S410 PolarHBondContact O-OG 2.97Å
407	V	89.1	Confident	81.9	Confident	44 Å²	44	66 Å²	66	27%	0.267	37%	0.374	S	S	.	.	H	α-helix	trans	-59.9	-43.9	176.9	171.4	0	0	0	0	111.1	E343 E403 A405 S410 G411	E343-V407 HydrophobicContact CB-CG1 4.05Å; E343-V407 HydrophobicContact CG-CG1 4.08Å; E403-V407 WeakPolarHBondContact O-CG2 3.27Å; E403-V407 PolarHBondContact O-N 2.87Å; A405-V407 PolarHBondContact O-N 2.83Å; V407-S410 PolarHBondContact O-OG 3.16Å; V407-G411 PolarHBondContact O-N 3.3Å; V407-G411 VanDerWaalsContact O-N 3.08Å
408	R	85.1	Confident	79.4	Confident	59 Å²	59	71.2 Å²	71.2	22%	0.223	40%	0.401	C	S	.	.	H	α-helix	trans	-74.4	-28.7	-178.8	-67.2	-62.5	175.3	-142.3	-11.1	114.3	Y272 Y331 E343 M404 A405 V406	Y272-R408 HydrophobicContact CD1-CB 4.17Å; Y272-R408 HydrophobicContact CD1-CG 4.24Å; Y331-R408 PolarHBondContact OH-NH2 3.43Å; E343-R408 IonicContact OE2-CZ 3.59Å; E343-R408 IonicContact OE2-NH1 2.68Å; E343-R408 PolarHBondContact OE2-NH1 2.86Å; E343-R408 IonicContact OE2-NH2 3.31Å; E343-R408 PolarHBondContact OE2-NH2 3.04Å; M404-R408 WeakPolarHBondContact O-CG 3.26Å; M404-R408 PolarHBondContact O-N 3.32Å; M404-R408 VanDerWaalsContact O-N 3.07Å; A405-R408 PolarHBondContact O-N 2.86Å; V406-R408 VanDerWaalsContact C-N 3.33Å; V406-R408 PolarHBondContact O-N 3.48Å
409	L	80.3	Confident	76.6	Confident	81 Å²	81	72.5 Å²	72.5	42%	0.424	42%	0.421	S	S	.	.	H	α-helix	trans	-82.3	-20.1	176.7	-67.8	172.3	0	0	0	113	E215 A405 V406	E215-L409 HydrophobicContact CG-CD1 4.23Å; E215-L409 HydrophobicContact CG-CD2 4.39Å; A405-L409 WeakPolarHBondContact O-CB 3.23Å; A405-L409 VanDerWaalsContact O-CG 3.23Å; A405-L409 WeakPolarHBondContact O-CG 3.43Å; A405-L409 PolarHBondContact O-N 2.89Å; V406-L409 PolarHBondContact O-N 3.17Å
410	S	83.5	Confident	73.8	Confident	95 Å²	95	75.3 Å²	75.3	66%	0.664	44%	0.437	S	S	*	.	H	α-helix	trans	-95.5	-22.4	177.4	56.8	0	0	0	0	114.3	V406 V407	V406-S410 WeakPolarHBondContact O-CB 3.35Å; V406-S410 PolarHBondContact O-N 3.37Å; V406-S410 PolarHBondContact O-OG 2.97Å; V407-S410 PolarHBondContact O-OG 3.16Å
411	G	72.8	Confident	71.2	Confident	42 Å²	42	80.1 Å²	80.1	43%	0.433	47%	0.466	S	S	.	.	S	Bend	trans	-85.4	170.1	179.4	0	0	0	0	0	114.6	V407	V407-G411 PolarHBondContact O-N 3.3Å; V407-G411 VanDerWaalsContact O-N 3.08Å
412	D	62.6	Low	68.8	Low	162 Å²	162	84.5 Å²	84.5	87%	0.866	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-62	136.1	173.8	-73.7	-36.2	0	0	0	111
413	Q	67.8	Low	66.5	Low	170 Å²	170	88.3 Å²	88.3	79%	0.794	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-64.8	139.3	174.1	-63.8	-171.6	7.2	0	0	109.3	D415	Q413-D415 PolarHBondContact O-N 3.3Å
414	C	73.4	Confident	64.2	Low	49 Å²	49	90.7 Å²	90.7	33%	0.331	54%	0.54	S	S	.	.			trans	-28.1	115.7	-176.7	-53.7	0	0	0	0	114.1	C276 T416	C276-C414 WeakPolarHBondContact CA-SG 3.44Å; C276-C414 HydrophobicContact CB-CB 3.68Å; C276-C414 WeakPolarHBondContact CB-SG 3.42Å; C276-C414 VanDerWaalsContact SG-CA 3.55Å; C276-C414 WeakPolarHBondContact SG-CB 3.39Å; C276-C414 CovalentContact SG-SG 2.03Å; C276-C414 PolarHBondContact SG-SG 3.48Å; C414-T416 PolarHBondContact O-N 3.12Å; C414-T416 VanDerWaalsContact O-N 3.09Å
415	D	64.5	Low	61.7	Low	131 Å²	131	97.8 Å²	97.8	70%	0.701	60%	0.599	S	S	*	*			trans	-52.2	121.1	173.2	-79.2	-33.3	0	0	0	109.6	Q413 S417	Q413-D415 PolarHBondContact O-N 3.3Å; D415-S417 PolarHBondContact O-N 3.27Å
416	T	50.5	Low	60.2	Low	126 Å²	126	102.4 Å²	102.4	77%	0.773	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	2.5	-176.1	-4.7	0	0	0	0	113.8	C414	C414-T416 PolarHBondContact O-N 3.12Å; C414-T416 VanDerWaalsContact O-N 3.09Å
417	S	41.8	Very low	58.6	Low	81 Å²	81	103.5 Å²	103.5	57%	0.566	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-19.7	-171.2	62.5	0	0	0	0	114.8	D415	D415-S417 PolarHBondContact O-N 3.27Å
418	I	46.1	Very low	56.9	Low	121 Å²	121	106.8 Å²	106.8	62%	0.621	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-21.7	-178.5	-63.7	175.3	0	0	0	112.7	L420 T421	I418-L420 PolarHBondContact O-N 3.2Å; I418-T421 PolarHBondContact O-OG1 3.23Å
419	A	37.7	Very low	55.3	Low	71 Å²	71	109.6 Å²	109.6	59%	0.587	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-13.3	-177.1	0	0	0	0	0	114.8
420	L	39	Very low	53.7	Low	134 Å²	134	111.4 Å²	111.4	70%	0.702	69%	0.694	S	S	*	*	S	Bend	trans	-93.7	-15.5	-178.1	-79.5	159.7	0	0	0	113.8	I418	I418-L420 PolarHBondContact O-N 3.2Å
421	T	41.7	Very low	51.7	Low	108 Å²	108	112.5 Å²	112.5	66%	0.663	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-10.8	-178.8	18.8	0	0	0	0	115	I418	I418-T421 PolarHBondContact O-OG1 3.23Å
422	S	45.1	Very low	50.2	Low	93 Å²	93	117.5 Å²	117.5	65%	0.65	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	5.5	177.2	61.2	0	0	0	0	114.6
423	T	46.4	Very low	49.3	Very low	115 Å²	115	114.1 Å²	114.1	71%	0.706	70%	0.704	S	S	*	*	S	Bend	trans	-116.5	5.1	-179	-32.4	0	0	0	0	112.2
424	V	44.6	Very low	47.7	Very low	133 Å²	133	109.4 Å²	109.4	81%	0.806	70%	0.696	S	S	*	*			trans	-129.5	13.6	-176	-169.2	0	0	0	0	112.8
425	A	42.2	Very low	45.4	Very low	151 Å²	151	114.9 Å²	114.9	100%	1.248	73%	0.729	S	S	*	*			trans	-133.9	0	167.5	0	0	0	0	0	108.7

Retrieved 425 of 425 residues in 637.1 ms (Link to these results)

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