A0A077YXC5_TRITR Loading...

RhoGAP domain containing protein

AlphaFold DB , UniProt , Accession A0A077YXC5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 374 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	24.5	Very low	31	Very low	248 Å²	248	131.5 Å²	131.5	100%	1.222	83%	0.831	S	S	*	*				0	116.2	0	-82.7	-177.8	-176.1	0	0	108.4
2	L	27.9	Very low	31.5	Very low	160 Å²	160	130.7 Å²	130.7	84%	0.838	83%	0.832	S	S	*	*			trans	-134	109.9	162.7	-111.4	154.6	0	0	0	105.6
3	A	27.2	Very low	31.8	Very low	91 Å²	91	128.2 Å²	128.2	75%	0.752	82%	0.821	S	S	*	*			trans	-71	134.7	174.7	0	0	0	0	0	109.1
4	I	36.2	Very low	32.3	Very low	150 Å²	150	124.6 Å²	124.6	77%	0.769	80%	0.799	S	S	*	*			trans	-105	101.6	169.3	-53	176.7	0	0	0	105.9	G6	I4-G6 PolarHBondContact O-N 3.12Å
5	N	35.1	Very low	32.9	Very low	161 Å²	161	122.5 Å²	122.5	86%	0.861	78%	0.783	S	S	*	*			trans	-77.3	111.7	161.5	-85.6	-8.8	0	0	0	107.4
6	G	26.6	Very low	33.1	Very low	73 Å²	73	123.1 Å²	123.1	75%	0.753	78%	0.775	S	S	*	*			trans	-63.5	133.3	170.8	0	0	0	0	0	110.7	I4	I4-G6 PolarHBondContact O-N 3.12Å
7	A	32.2	Very low	33.7	Very low	98 Å²	98	118.9 Å²	118.9	81%	0.81	75%	0.748	S	S	*	*			trans	-133.2	107.8	155.7	0	0	0	0	0	107.3	S9	A7-S9 PolarHBondContact O-N 3Å
8	T	27.9	Very low	33.9	Very low	139 Å²	139	119.4 Å²	119.4	85%	0.853	74%	0.739	S	S	*	*			trans	-58.7	120.1	168.6	46.5	0	0	0	0	110.3
9	S	34.1	Very low	34.2	Very low	106 Å²	106	118.1 Å²	118.1	74%	0.741	73%	0.734	S	S	*	*			trans	179.3	142.8	139.5	43.7	0	0	0	0	111	A7 S11	A7-S9 PolarHBondContact O-N 3Å; S9-S11 PolarHBondContact O-N 2.88Å
10	S	31.8	Very low	34.4	Very low	121 Å²	121	119.4 Å²	119.4	85%	0.846	73%	0.729	S	S	*	*			trans	-44.5	109	177.6	50.7	0	0	0	0	114.8
11	S	37.1	Very low	34.7	Very low	100 Å²	100	119.5 Å²	119.5	70%	0.699	73%	0.73	S	S	*	*	S	Bend	trans	175	146.9	147.9	49.8	0	0	0	0	109.2	S9 S13	S9-S11 PolarHBondContact O-N 2.88Å; S11-S13 PolarHBondContact O-N 2.98Å
12	S	37.7	Very low	35.5	Very low	121 Å²	121	113 Å²	113	85%	0.846	71%	0.709	S	S	*	*			trans	-58.2	105.9	-175.6	66.1	0	0	0	0	111.3
13	S	35.7	Very low	36.2	Very low	98 Å²	98	112.4 Å²	112.4	69%	0.685	71%	0.706	S	S	*	*			trans	-81.3	128.1	178.2	-69.1	0	0	0	0	110.3	S11 V15	S11-S13 PolarHBondContact O-N 2.98Å; S13-V15 PolarHBondContact O-N 3.4Å
14	P	38.4	Very low	36.9	Very low	78 Å²	78	115.3 Å²	115.3	51%	0.506	70%	0.704	S	S	.	*			trans	-68	130.5	-180	26.6	-32.7	0	0	0	110.9	M16	P14-M16 PolarHBondContact O-N 3.39Å; P14-M16 VanDerWaalsContact O-N 3.14Å
15	V	40.9	Very low	36.8	Very low	93 Å²	93	113.6 Å²	113.6	56%	0.564	71%	0.705	S	S	*	*			trans	-71.9	106.6	172.1	-179.7	0	0	0	0	108.9	S13 V17	S13-V15 PolarHBondContact O-N 3.4Å; V15-V17 HydrophobicContact CG1-CG2 4.16Å
16	M	36.6	Very low	36.7	Very low	132 Å²	132	117.5 Å²	117.5	65%	0.65	71%	0.708	S	S	*	*			trans	-92.7	117	170.2	-69.9	-74.1	-73.4	0	0	108.7	P14 L93	P14-M16 PolarHBondContact O-N 3.39Å; P14-M16 VanDerWaalsContact O-N 3.14Å; M16-L93 HydrophobicContact CE-CD1 4.3Å
17	V	42.7	Very low	37.3	Very low	52 Å²	52	117.8 Å²	117.8	32%	0.315	70%	0.698	S	S	.	*			trans	-95.8	119.8	174.8	-177.4	0	0	0	0	108.9	V15	V15-V17 HydrophobicContact CG1-CG2 4.16Å
18	Q	38	Very low	37.7	Very low	128 Å²	128	118.4 Å²	118.4	60%	0.598	69%	0.694	S	S	*	*			trans	-117.3	113.1	174.4	-167.4	169.3	-14	0	0	108.8	F20	Q18-F20 HydrophobicContact CB-CE2 4.07Å; Q18-F20 HydrophobicContact CB-CZ 4.46Å; Q18-F20 HydrophobicContact CG-CD2 4.3Å; Q18-F20 HydrophobicContact CG-CE1 4.26Å; Q18-F20 HydrophobicContact CG-CE2 3.75Å; Q18-F20 HydrophobicContact CG-CZ 3.74Å
19	C	39.6	Very low	38.2	Very low	94 Å²	94	121.2 Å²	121.2	64%	0.635	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-88.2	119.2	173.3	-60.2	0	0	0	0	108.5
20	F	38.8	Very low	38.9	Very low	145 Å²	145	120.6 Å²	120.6	64%	0.636	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-99.1	127.8	174.8	-67	-87.5	0	0	0	110	Q18	Q18-F20 HydrophobicContact CB-CE2 4.07Å; Q18-F20 HydrophobicContact CB-CZ 4.46Å; Q18-F20 HydrophobicContact CG-CD2 4.3Å; Q18-F20 HydrophobicContact CG-CE1 4.26Å; Q18-F20 HydrophobicContact CG-CE2 3.75Å; Q18-F20 HydrophobicContact CG-CZ 3.74Å
21	T	40.4	Very low	39.9	Very low	122 Å²	122	123.9 Å²	123.9	75%	0.748	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-87	138.1	157.7	49	0	0	0	0	108.1	D23	T21-D23 PolarHBondContact O-N 3.21Å
22	S	41.3	Very low	40.9	Very low	111 Å²	111	128.1 Å²	128.1	78%	0.776	68%	0.677	S	S	*	*	S	Bend	trans	-75.4	16.9	-168.5	-41.5	0	0	0	0	115.4
23	D	41.3	Very low	42.8	Very low	147 Å²	147	124.8 Å²	124.8	79%	0.786	65%	0.649	S	S	*	*			trans	-143.4	75	-169.9	-151.4	10.2	0	0	0	110.9	T21	T21-D23 PolarHBondContact O-N 3.21Å
24	E	41.6	Very low	45.3	Very low	153 Å²	153	124.3 Å²	124.3	72%	0.715	64%	0.636	S	S	*	*			trans	-161.5	94.9	160.1	-118.1	-174.5	152.5	0	0	110.7
25	S	34.3	Very low	47.8	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	64%	0.637	S	S	*	*			trans	-72.7	122.2	162.8	53.8	0	0	0	0	109.7
26	R	32.8	Very low	50.3	Low	244 Å²	244	122 Å²	122	92%	0.921	61%	0.61	S	S	*	*			trans	78.9	88.5	169.3	-59.6	174.4	163.3	170.2	-4.6	117.4
27	S	41.1	Very low	53	Low	78 Å²	78	120 Å²	120	55%	0.545	60%	0.598	S	S	.	*			trans	-155.6	133.8	152.9	-177.4	0	0	0	0	112.2	Y29	S27-Y29 PolarHBondContact O-N 3.39Å
28	P	39.8	Very low	55.5	Low	111 Å²	111	118.9 Å²	118.9	72%	0.721	59%	0.589	S	S	*	*	S	Bend	trans	-75	118.5	-176.7	30.5	-31.6	0	0	0	110.7
29	Y	39.1	Very low	58.3	Low	198 Å²	198	115 Å²	115	78%	0.776	58%	0.583	S	S	*	*			trans	53.6	83.9	171.6	-58.3	-84.9	0	0	0	115.3	S27 R31	S27-Y29 PolarHBondContact O-N 3.39Å; Y29-R31 PolarHBondContact O-N 3.21Å
30	V	47.4	Very low	61	Low	93 Å²	93	111.8 Å²	111.8	56%	0.564	56%	0.561	S	S	*	*			trans	-66	82.3	166.9	-175.7	0	0	0	0	109.4	R32	V30-R32 WeakPolarHBondContact CG1-O 3.44Å
31	R	53.9	Low	63.8	Low	190 Å²	190	106.6 Å²	106.6	72%	0.717	54%	0.542	S	S	*	.			trans	-81.2	2.2	172.9	-78.7	-163.5	-104.8	-161.3	-5.8	113.1	Y29	Y29-R31 PolarHBondContact O-N 3.21Å
32	R	58.4	Low	66.4	Low	190 Å²	190	101.5 Å²	101.5	72%	0.717	51%	0.513	S	S	*	.	B	Isolated β-bridge	trans	-108.6	125.7	179.9	-77.7	-174.7	-165.2	159	5.4	111.1	V30 G91	V30-R32 WeakPolarHBondContact CG1-O 3.44Å; R32-G91 CarbonylContact C-O 3.58Å; R32-G91 WeakPolarHBondContact CA-O 3.24Å
33	I	77.7	Confident	69	Low	50 Å²	50	100.4 Å²	100.4	26%	0.256	51%	0.505	S	S	.	.			trans	-90.4	160.2	165.2	-61.3	166.4	0	0	0	107.8	K35 G91 L93	I33-K35 PolarHBondContact O-N 3.15Å; I33-G91 PolarHBondContact N-O 3.01Å; I33-G91 WeakPolarHBondContact O-CA 3.25Å; I33-L93 HydrophobicContact CD1-CD2 3.43Å; I33-L93 VanDerWaalsContact CD1-CD2 3.43Å; I33-L93 HydrophobicContact CD1-CG 4.2Å; I33-L93 HydrophobicContact CG1-CD2 3.94Å
34	E	87.7	Confident	71.6	Confident	88 Å²	88	97.4 Å²	97.4	41%	0.411	49%	0.486	S	S	.	.			trans	-41.2	131.9	163.9	-174.2	-175.5	-160.1	0	0	111.9	P51	E34-P51 WeakPolarHBondContact OE2-CA 3.36Å
35	K	91.1	Very high	74.2	Confident	121 Å²	121	90.5 Å²	90.5	53%	0.526	46%	0.455	S	S	.	.			trans	-77.9	137	180	-63.4	177.5	-177.3	173.2	0	110	I33 Q89	I33-K35 PolarHBondContact O-N 3.15Å; K35-Q89 WeakPolarHBondContact CG-O 3.19Å
36	V	92.9	Very high	77.1	Confident	2 Å²	2	85.5 Å²	85.5	1%	0.012	42%	0.419	C	S	.	.			trans	-87.5	119.2	170	-172.8	0	0	0	0	109.4	F38 P51 M88 F111	V36-F38 HydrophobicContact CB-CD2 4.45Å; V36-F38 HydrophobicContact CB-CE2 3.99Å; V36-F38 HydrophobicContact CG1-CD2 4.09Å; V36-F38 HydrophobicContact CG1-CE2 3.67Å; V36-F38 HydrophobicContact CG1-CZ 4.33Å; V36-F38 PolarHBondContact O-N 3.12Å; V36-P51 HydrophobicContact CG2-CB 3.82Å; V36-M88 HydrophobicContact CB-CB 4.05Å; V36-M88 HydrophobicContact CB-CE 4.13Å; V36-M88 HydrophobicContact CG1-CE 4.11Å; V36-M88 HydrophobicContact CG2-CB 3.99Å; V36-M88 HydrophobicContact CG2-CE 3.7Å; V36-M88 PolarHBondContact N-O 3Å; V36-F111 HydrophobicContact CG1-CD2 3.83Å; V36-F111 HydrophobicContact CG1-CE2 3.63Å
37	K	93.9	Very high	79.9	Confident	89 Å²	89	77.3 Å²	77.3	39%	0.387	40%	0.399	S	S	.	.			trans	-87.5	107.8	179.7	-59.5	178.9	178.4	-174.9	0	110.2	V40 E44	K37-V40 HydrophobicContact CB-CG1 4.14Å; K37-V40 HydrophobicContact CB-CG2 3.53Å; K37-V40 HydrophobicContact CD-CG2 4.31Å; K37-E44 HydrophobicContact CD-CG 3.96Å; K37-E44 WeakPolarHBondContact CD-OE1 3.48Å; K37-E44 VanDerWaalsContact NZ-CG 3.34Å; K37-E44 IonicContact NZ-OE1 3.84Å; K37-E44 PolarHBondContact NZ-OE1 3.37Å
38	F	94.9	Very high	82.3	Confident	29 Å²	29	81.2 Å²	81.2	13%	0.127	41%	0.409	C	S	.	.			trans	-91.3	145.8	171.4	-70.7	-107.5	0	0	0	109.4	V36 I85 M88 Q89 V107 F111	V36-F38 HydrophobicContact CB-CD2 4.45Å; V36-F38 HydrophobicContact CB-CE2 3.99Å; V36-F38 HydrophobicContact CG1-CD2 4.09Å; V36-F38 HydrophobicContact CG1-CE2 3.67Å; V36-F38 HydrophobicContact CG1-CZ 4.33Å; V36-F38 PolarHBondContact O-N 3.12Å; F38-I85 HydrophobicContact CD1-CG2 4.38Å; F38-I85 HydrophobicContact CD2-CG2 4.23Å; F38-I85 HydrophobicContact CE1-CD1 4.32Å; F38-I85 HydrophobicContact CE1-CG1 3.99Å; F38-I85 HydrophobicContact CE1-CG2 4.24Å; F38-I85 HydrophobicContact CE2-CG2 4.09Å; F38-I85 HydrophobicContact CG-CG2 4.38Å; F38-I85 HydrophobicContact CZ-CB 4.4Å; F38-I85 HydrophobicContact CZ-CG1 3.92Å; F38-I85 HydrophobicContact CZ-CG2 4.11Å; F38-M88 HydrophobicContact CE2-CB 4.27Å; F38-M88 HydrophobicContact CE2-CE 4.47Å; F38-M88 HydrophobicContact CZ-CE 4.3Å; F38-M88 HydrophobicContact CZ-SD 4.49Å; F38-Q89 HydrophobicContact CD2-CG 3.62Å; F38-Q89 HydrophobicContact CE2-CG 4.16Å; F38-V107 HydrophobicContact CZ-CG1 4.25Å; F38-F111 HydrophobicContact CD1-CB 4.15Å; F38-F111 AromaticContact CD1-CD2 3.98Å; F38-F111 HydrophobicContact CD1-CD2 3.98Å; F38-F111 HydrophobicContact CD2-CD2 4.44Å; F38-F111 HydrophobicContact CE1-CB 3.57Å; F38-F111 AromaticContact CE1-CD2 3.9Å; F38-F111 HydrophobicContact CE1-CD2 3.9Å; F38-F111 HydrophobicContact CE1-CG 4.24Å; F38-F111 HydrophobicContact CE2-CD2 4.37Å; F38-F111 HydrophobicContact CG-CD2 4.26Å; F38-F111 HydrophobicContact CZ-CB 4.16Å; F38-F111 HydrophobicContact CZ-CD2 4.1Å
39	G	95.7	Very high	84.8	Confident	46 Å²	46	79.1 Å²	79.1	47%	0.474	39%	0.392	S	S	.	.	S	Bend	trans	88.3	-3.2	176.6	0	0	0	0	0	115.2	K114	G39-K114 CarbonylContact C-O 3.29Å; G39-K114 WeakPolarHBondContact CA-O 3.45Å; G39-K114 PolarHBondContact N-O 3.5Å
40	V	97	Very high	87.5	Confident	27 Å²	27	70.1 Å²	70.1	16%	0.164	36%	0.357	C	S	.	.	S	Bend	trans	-100.4	169.2	-178.1	-55.6	0	0	0	0	111.2	K37 E44 A45 L115 N116	K37-V40 HydrophobicContact CB-CG1 4.14Å; K37-V40 HydrophobicContact CB-CG2 3.53Å; K37-V40 HydrophobicContact CD-CG2 4.31Å; V40-E44 HydrophobicContact CB-CB 4.09Å; V40-E44 HydrophobicContact CB-CG 4.28Å; V40-E44 HydrophobicContact CG2-CB 3.99Å; V40-E44 HydrophobicContact CG2-CG 4.21Å; V40-A45 HydrophobicContact CG2-CB 3.86Å; V40-L115 CarbonylContact O-C 3.56Å; V40-L115 WeakPolarHBondContact O-CA 3.47Å; V40-N116 PolarHBondContact O-N 2.78Å
41	S	97.1	Very high	89.7	Confident	36 Å²	36	65.8 Å²	65.8	25%	0.252	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-64.8	158.8	175.3	63.9	0	0	0	0	111.6	S43 E44 A45	S41-S43 PolarHBondContact O-N 2.79Å; S41-S43 PolarHBondContact OG-OG 3.07Å; S41-E44 PolarHBondContact O-N 3.46Å; S41-E44 VanDerWaalsContact O-N 3.13Å; S41-E44 PolarHBondContact OG-N 2.98Å; S41-A45 WeakPolarHBondContact O-CB 3.17Å; S41-A45 PolarHBondContact O-N 3.25Å
42	A	96.5	Very high	91.5	Very high	16 Å²	16	58.1 Å²	58.1	13%	0.132	31%	0.308	C	S	.	.	H	α-helix	trans	-57.4	-37.3	173.8	0	0	0	0	0	112.4	E44 A45 F46	A42-E44 VanDerWaalsContact C-N 3.32Å; A42-E44 PolarHBondContact O-N 3.31Å; A42-A45 PolarHBondContact O-N 3.38Å; A42-F46 HydrophobicContact CB-CD2 4.17Å; A42-F46 HydrophobicContact CB-CE2 4.16Å; A42-F46 WeakPolarHBondContact O-CD2 3.29Å; A42-F46 PolarHBondContact O-N 3.29Å
43	S	94.9	Very high	93.1	Very high	88 Å²	88	49.5 Å²	49.5	62%	0.615	28%	0.276	S	S	*	.	H	α-helix	trans	-61.5	-37	176.5	53.6	0	0	0	0	113.3	S41 S47	S41-S43 PolarHBondContact O-N 2.79Å; S41-S43 PolarHBondContact OG-OG 3.07Å; S43-S47 WeakPolarHBondContact O-CA 3.44Å; S43-S47 PolarHBondContact O-N 3.22Å
44	E	96.3	Very high	93.9	Very high	84 Å²	84	47.1 Å²	47.1	39%	0.393	26%	0.264	S	S	.	.	H	α-helix	trans	-81.3	-37.8	177	-170.4	-173.4	160.1	0	0	112.1	K37 V40 S41 A42 F46	K37-E44 HydrophobicContact CD-CG 3.96Å; K37-E44 WeakPolarHBondContact CD-OE1 3.48Å; K37-E44 VanDerWaalsContact NZ-CG 3.34Å; K37-E44 IonicContact NZ-OE1 3.84Å; K37-E44 PolarHBondContact NZ-OE1 3.37Å; V40-E44 HydrophobicContact CB-CB 4.09Å; V40-E44 HydrophobicContact CB-CG 4.28Å; V40-E44 HydrophobicContact CG2-CB 3.99Å; V40-E44 HydrophobicContact CG2-CG 4.21Å; S41-E44 PolarHBondContact O-N 3.46Å; S41-E44 VanDerWaalsContact O-N 3.13Å; S41-E44 PolarHBondContact OG-N 2.98Å; A42-E44 VanDerWaalsContact C-N 3.32Å; A42-E44 PolarHBondContact O-N 3.31Å; E44-F46 PolarHBondContact O-N 2.92Å
45	A	96.2	Very high	94.3	Very high	7 Å²	7	44.6 Å²	44.6	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-29.5	179.6	0	0	0	0	0	112.6	V40 S41 A42 F111 L115	V40-A45 HydrophobicContact CG2-CB 3.86Å; S41-A45 WeakPolarHBondContact O-CB 3.17Å; S41-A45 PolarHBondContact O-N 3.25Å; A42-A45 PolarHBondContact O-N 3.38Å; A45-F111 HydrophobicContact CB-CZ 4.09Å; A45-L115 HydrophobicContact CB-CD2 3.78Å
46	F	95.6	Very high	94.4	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.035	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.2	39.8	-177.8	-46.1	-63.8	0	0	0	112.5	A42 E44 H48 L54 F111 L115 P154 C155 L158	A42-F46 HydrophobicContact CB-CD2 4.17Å; A42-F46 HydrophobicContact CB-CE2 4.16Å; A42-F46 WeakPolarHBondContact O-CD2 3.29Å; A42-F46 PolarHBondContact O-N 3.29Å; E44-F46 PolarHBondContact O-N 2.92Å; F46-H48 PolarHBondContact O-N 2.61Å; F46-H48 VanDerWaalsContact O-N 3.13Å; F46-L54 HydrophobicContact CE1-CD2 4.31Å; F46-F111 AromaticContact CE1-CE1 3.88Å; F46-F111 HydrophobicContact CE1-CE1 3.88Å; F46-F111 AromaticContact CE1-CZ 3.84Å; F46-F111 HydrophobicContact CE1-CZ 3.84Å; F46-F111 AromaticContact CZ-CE1 3.61Å; F46-F111 HydrophobicContact CZ-CE1 3.61Å; F46-F111 AromaticContact CZ-CZ 3.82Å; F46-F111 HydrophobicContact CZ-CZ 3.82Å; F46-L115 HydrophobicContact CE2-CD1 4.35Å; F46-P154 HydrophobicContact CB-CB 3.63Å; F46-P154 HydrophobicContact CB-CG 4.24Å; F46-P154 HydrophobicContact CG-CB 4.18Å; F46-C155 WeakPolarHBondContact CD2-SG 3.49Å; F46-L158 HydrophobicContact CE1-CD2 3.97Å; F46-L158 HydrophobicContact CE2-CD2 4.15Å; F46-L158 HydrophobicContact CZ-CD2 3.36Å
47	S	91.5	Very high	94.6	Very high	72 Å²	72	40.8 Å²	40.8	50%	0.503	24%	0.24	S	C	.	.	S	Bend	trans	-59.4	-25.2	-176.8	61.7	0	0	0	0	113.8	S43	S43-S47 WeakPolarHBondContact O-CA 3.44Å; S43-S47 PolarHBondContact O-N 3.22Å
48	H	89.9	Confident	94.8	Very high	160 Å²	160	36.6 Å²	36.6	74%	0.741	22%	0.222	S	C	*	.	S	Bend	trans	-118.4	-57.5	176.8	-59.7	-58.7	0	0	0	111.8	F46	F46-H48 PolarHBondContact O-N 2.61Å; F46-H48 VanDerWaalsContact O-N 3.13Å
49	D	94	Very high	94.8	Very high	68 Å²	68	36.7 Å²	36.7	36%	0.364	22%	0.223	S	C	.	.	S	Bend	trans	-159.2	-172.5	177.4	-154.5	-18.8	0	0	0	109.2	P51	D49-P51 WeakPolarHBondContact O-CD 3.34Å
50	I	95.3	Very high	94.8	Very high	9 Å²	9	37 Å²	37	5%	0.046	21%	0.21	C	C	.	.	S	Bend	trans	-65.8	121.9	168.7	-56.6	173.9	0	0	0	108.8	A52 L54 L55 L58 P154 H157 L158 L161	I50-A52 PolarHBondContact O-N 3.49Å; I50-L54 HydrophobicContact CG2-CB 4.37Å; I50-L54 HydrophobicContact CG2-CD2 4.12Å; I50-L54 HydrophobicContact CG2-CG 4.25Å; I50-L55 HydrophobicContact CG2-CB 4.1Å; I50-L58 HydrophobicContact CG2-CD1 4.33Å; I50-P154 HydrophobicContact CG1-CB 4.46Å; I50-H157 HydrophobicContact CD1-CB 3.87Å; I50-L158 HydrophobicContact CD1-CB 3.92Å; I50-L158 HydrophobicContact CG1-CB 4.42Å; I50-L161 HydrophobicContact CD1-CD1 4.13Å
51	P	93.8	Very high	94.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	20%	0.203	C	C	.	.			trans	-54.3	132.6	-179.9	-29.3	35.4	0	0	0	112.4	E34 V36 D49 T53 L54 L55	E34-P51 WeakPolarHBondContact OE2-CA 3.36Å; V36-P51 HydrophobicContact CG2-CB 3.82Å; D49-P51 WeakPolarHBondContact O-CD 3.34Å; P51-T53 VanDerWaalsContact C-N 3.26Å; P51-T53 PolarHBondContact O-N 2.72Å; P51-T53 VanDerWaalsContact O-N 3.09Å; P51-L54 HydrophobicContact CB-CB 4.45Å; P51-L54 WeakPolarHBondContact O-CA 3.16Å; P51-L54 WeakPolarHBondContact O-CB 3.43Å; P51-L54 PolarHBondContact O-N 3.21Å; P51-L55 PolarHBondContact O-N 3.1Å
52	A	91.5	Very high	94.8	Very high	30 Å²	30	34.3 Å²	34.3	25%	0.248	19%	0.192	C	C	.	.	H	α-helix	trans	-53.1	-41.6	-169.3	0	0	0	0	0	113.3	I50 L54 L55 V56	I50-A52 PolarHBondContact O-N 3.49Å; A52-L54 VanDerWaalsContact C-N 3.33Å; A52-L54 PolarHBondContact O-N 2.97Å; A52-L55 WeakPolarHBondContact O-CB 3.41Å; A52-L55 PolarHBondContact O-N 2.81Å; A52-V56 WeakPolarHBondContact O-CG2 3.46Å; A52-V56 PolarHBondContact O-N 2.9Å
53	T	91.8	Very high	94.7	Very high	8 Å²	8	39.4 Å²	39.4	5%	0.049	21%	0.211	C	C	.	.	H	α-helix	trans	-64.6	-37.6	178.9	-50.1	0	0	0	0	112.1	P51 L57 M88 V94	P51-T53 VanDerWaalsContact C-N 3.26Å; P51-T53 PolarHBondContact O-N 2.72Å; P51-T53 VanDerWaalsContact O-N 3.09Å; T53-L57 WeakPolarHBondContact O-CG 3.47Å; T53-L57 PolarHBondContact O-N 2.98Å; T53-M88 HydrophobicContact CG2-CE 4.34Å; T53-M88 HydrophobicContact CG2-CG 3.73Å; T53-M88 HydrophobicContact CG2-SD 4.39Å; T53-V94 HydrophobicContact CG2-CG1 3.73Å
54	L	95.3	Very high	94.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-67.7	-41.9	174.8	178.8	63	0	0	0	110.8	F46 I50 P51 A52 V56 L57 L58 M88 I108 F111	F46-L54 HydrophobicContact CE1-CD2 4.31Å; I50-L54 HydrophobicContact CG2-CB 4.37Å; I50-L54 HydrophobicContact CG2-CD2 4.12Å; I50-L54 HydrophobicContact CG2-CG 4.25Å; P51-L54 HydrophobicContact CB-CB 4.45Å; P51-L54 WeakPolarHBondContact O-CA 3.16Å; P51-L54 WeakPolarHBondContact O-CB 3.43Å; P51-L54 PolarHBondContact O-N 3.21Å; A52-L54 VanDerWaalsContact C-N 3.33Å; A52-L54 PolarHBondContact O-N 2.97Å; L54-V56 PolarHBondContact O-N 3.08Å; L54-L57 WeakPolarHBondContact O-CB 3.47Å; L54-L57 PolarHBondContact O-N 3.47Å; L54-L58 HydrophobicContact CG-CD1 4.15Å; L54-L58 WeakPolarHBondContact O-CG 3.34Å; L54-L58 PolarHBondContact O-N 3.09Å; L54-M88 HydrophobicContact CB-CE 4.32Å; L54-I108 HydrophobicContact CD1-CG1 4.14Å; L54-F111 HydrophobicContact CD1-CD1 4.27Å; L54-F111 HydrophobicContact CD1-CG 4.46Å; L54-F111 HydrophobicContact CD2-CD1 3.64Å; L54-F111 HydrophobicContact CD2-CE1 3.33Å; L54-F111 HydrophobicContact CD2-CE2 4.37Å; L54-F111 HydrophobicContact CD2-CG 4.27Å; L54-F111 HydrophobicContact CD2-CZ 3.74Å
55	L	95.3	Very high	94.7	Very high	35 Å²	35	33.5 Å²	33.5	18%	0.183	18%	0.176	C	C	.	.	H	α-helix	trans	-59.2	-44	175.4	-177	59.9	0	0	0	111.8	I50 P51 A52 L57 L58 L59 L161 I243	I50-L55 HydrophobicContact CG2-CB 4.1Å; P51-L55 PolarHBondContact O-N 3.1Å; A52-L55 WeakPolarHBondContact O-CB 3.41Å; A52-L55 PolarHBondContact O-N 2.81Å; L55-L57 VanDerWaalsContact C-N 3.32Å; L55-L57 PolarHBondContact O-N 3.04Å; L55-L58 WeakPolarHBondContact O-CB 3.41Å; L55-L58 PolarHBondContact O-N 2.89Å; L55-L59 HydrophobicContact CD1-CD1 4.34Å; L55-L59 HydrophobicContact CD1-CG 4.24Å; L55-L59 HydrophobicContact CG-CD1 4.11Å; L55-L59 HydrophobicContact CG-CG 4.42Å; L55-L59 WeakPolarHBondContact O-CG 3.41Å; L55-L59 PolarHBondContact O-N 3.25Å; L55-L161 HydrophobicContact CD1-CD1 3.55Å; L55-I243 HydrophobicContact CD1-CG1 4.33Å; L55-I243 HydrophobicContact CD2-CD1 4.34Å
56	V	93.9	Very high	94.7	Very high	43 Å²	43	33.8 Å²	33.8	26%	0.261	18%	0.177	S	C	.	.	H	α-helix	trans	-64.2	-36.3	177	-177.5	0	0	0	0	111.8	A52 L54 R60 I96	A52-V56 WeakPolarHBondContact O-CG2 3.46Å; A52-V56 PolarHBondContact O-N 2.9Å; L54-V56 PolarHBondContact O-N 3.08Å; V56-R60 VanDerWaalsContact O-CB 3.26Å; V56-R60 WeakPolarHBondContact O-CB 3.34Å; V56-R60 PolarHBondContact O-N 2.67Å; V56-I96 HydrophobicContact CB-CD1 3.74Å; V56-I96 HydrophobicContact CG1-CD1 3.32Å
57	L	96.5	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-44.8	172.8	-65.9	178.2	0	0	0	111.7	T53 L54 L55 R60 V61 L84 M88 I96 A104 V107 I108	T53-L57 WeakPolarHBondContact O-CG 3.47Å; T53-L57 PolarHBondContact O-N 2.98Å; L54-L57 WeakPolarHBondContact O-CB 3.47Å; L54-L57 PolarHBondContact O-N 3.47Å; L55-L57 VanDerWaalsContact C-N 3.32Å; L55-L57 PolarHBondContact O-N 3.04Å; L57-R60 PolarHBondContact O-N 3.17Å; L57-V61 WeakPolarHBondContact O-CG2 3.34Å; L57-V61 PolarHBondContact O-N 2.96Å; L57-L84 HydrophobicContact CD1-CD2 4.19Å; L57-L84 HydrophobicContact CD2-CD2 4.05Å; L57-M88 HydrophobicContact CD1-CE 3.82Å; L57-M88 HydrophobicContact CD1-SD 3.67Å; L57-I96 HydrophobicContact CD2-CD1 4.07Å; L57-I96 HydrophobicContact CD2-CG1 4.29Å; L57-I96 HydrophobicContact CD2-CG2 3.55Å; L57-A104 HydrophobicContact CD2-CB 3.92Å; L57-V107 HydrophobicContact CD1-CB 4.45Å; L57-V107 HydrophobicContact CD1-CG1 3.93Å; L57-I108 HydrophobicContact CB-CD1 4.03Å; L57-I108 HydrophobicContact CB-CG1 4.16Å
58	L	97.1	Very high	94.9	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-59.3	-48.3	176.8	-71.9	159.2	0	0	0	111.2	I50 L54 L55 R60 V61 N62 I108 L158 L161 L162	I50-L58 HydrophobicContact CG2-CD1 4.33Å; L54-L58 HydrophobicContact CG-CD1 4.15Å; L54-L58 WeakPolarHBondContact O-CG 3.34Å; L54-L58 PolarHBondContact O-N 3.09Å; L55-L58 WeakPolarHBondContact O-CB 3.41Å; L55-L58 PolarHBondContact O-N 2.89Å; L58-R60 VanDerWaalsContact C-N 3.34Å; L58-R60 PolarHBondContact O-N 2.95Å; L58-V61 PolarHBondContact O-N 3.31Å; L58-N62 VanDerWaalsContact O-CB 3.29Å; L58-N62 WeakPolarHBondContact O-CB 3.48Å; L58-N62 PolarHBondContact O-N 3.13Å; L58-I108 HydrophobicContact CD2-CD1 4.04Å; L58-I108 HydrophobicContact CD2-CG1 4.42Å; L58-I108 HydrophobicContact CD2-CG2 3.98Å; L58-I108 HydrophobicContact CG-CD1 4.26Å; L58-L158 HydrophobicContact CD1-CD1 3.37Å; L58-L158 HydrophobicContact CD2-CD1 4.02Å; L58-L158 HydrophobicContact CG-CD1 4.34Å; L58-L161 HydrophobicContact CD1-CD1 4.36Å; L58-L162 HydrophobicContact CD2-CD2 3.58Å; L58-L162 HydrophobicContact CD2-CG 4.02Å
59	L	95.9	Very high	95.1	Very high	30 Å²	30	38 Å²	38	16%	0.157	19%	0.186	C	C	.	.	H	α-helix	trans	-65.8	-35.9	179.1	-66.5	176.9	0	0	0	112.4	L55 N62 K63 L161 I243 T244	L55-L59 HydrophobicContact CD1-CD1 4.34Å; L55-L59 HydrophobicContact CD1-CG 4.24Å; L55-L59 HydrophobicContact CG-CD1 4.11Å; L55-L59 HydrophobicContact CG-CG 4.42Å; L55-L59 WeakPolarHBondContact O-CG 3.41Å; L55-L59 PolarHBondContact O-N 3.25Å; L59-N62 WeakPolarHBondContact O-CB 3.38Å; L59-N62 PolarHBondContact O-N 3.32Å; L59-K63 WeakPolarHBondContact O-CB 3.22Å; L59-K63 PolarHBondContact O-N 3.35Å; L59-L161 HydrophobicContact CD2-CD2 4.21Å; L59-I243 HydrophobicContact CD1-CG1 4.31Å; L59-I243 HydrophobicContact CD2-CG1 4.2Å; L59-I243 HydrophobicContact CD2-CG2 4.31Å; L59-I243 WeakPolarHBondContact CD2-O 3.23Å; L59-T244 HydrophobicContact CD2-CG2 4.11Å
60	R	95.6	Very high	95.2	Very high	53 Å²	53	37.9 Å²	37.9	20%	0.2	19%	0.185	C	C	.	.	H	α-helix	trans	-63.8	-45.5	173.9	-175.6	-178.4	175	106.5	-7.5	111.5	V56 L57 L58 K63 L64 I96 E97 F99 I101	V56-R60 VanDerWaalsContact O-CB 3.26Å; V56-R60 WeakPolarHBondContact O-CB 3.34Å; V56-R60 PolarHBondContact O-N 2.67Å; L57-R60 PolarHBondContact O-N 3.17Å; L58-R60 VanDerWaalsContact C-N 3.34Å; L58-R60 PolarHBondContact O-N 2.95Å; R60-K63 PolarHBondContact O-N 3.4Å; R60-L64 HydrophobicContact CG-CD1 4.25Å; R60-L64 PolarHBondContact O-N 2.91Å; R60-I96 VanDerWaalsContact NH1-C 3.31Å; R60-I96 PolarHBondContact NH1-O 3.49Å; R60-I96 PolarHBondContact NH2-O 2.81Å; R60-E97 VanDerWaalsContact NH1-CA 3.3Å; R60-E97 PolarHBondContact NH2-O 2.87Å; R60-F99 PolarHBondContact NH2-O 2.85Å; R60-I101 HydrophobicContact CG-CD1 3.78Å
61	V	97.1	Very high	95.3	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-66.3	-38.9	175.5	-179.9	0	0	0	0	111.2	L57 L58 K63 G65 I71 W72 I101 A104 A105 I108 T165	L57-V61 WeakPolarHBondContact O-CG2 3.34Å; L57-V61 PolarHBondContact O-N 2.96Å; L58-V61 PolarHBondContact O-N 3.31Å; V61-K63 VanDerWaalsContact C-N 3.34Å; V61-K63 PolarHBondContact O-N 3.4Å; V61-G65 WeakPolarHBondContact O-CA 3.37Å; V61-G65 PolarHBondContact O-N 2.79Å; V61-I71 HydrophobicContact CG1-CG1 4.47Å; V61-W72 HydrophobicContact CB-CZ2 4.42Å; V61-W72 HydrophobicContact CG1-CZ2 3.56Å; V61-I101 HydrophobicContact CB-CD1 4.32Å; V61-I101 HydrophobicContact CG2-CD1 3.81Å; V61-I101 HydrophobicContact CG2-CG1 4.28Å; V61-A104 HydrophobicContact CG2-CB 3.87Å; V61-A105 HydrophobicContact CG2-CB 4.49Å; V61-I108 HydrophobicContact CG2-CD1 3.96Å; V61-T165 HydrophobicContact CG1-CG2 4.14Å
62	N	96.9	Very high	95.4	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.027	18%	0.183	C	C	.	.	H	α-helix	trans	-57.5	-45.4	172.7	-175.9	-99.2	0	0	0	111.5	L58 L59 P66 T165 Y240 T244 R246	L58-N62 VanDerWaalsContact O-CB 3.29Å; L58-N62 WeakPolarHBondContact O-CB 3.48Å; L58-N62 PolarHBondContact O-N 3.13Å; L59-N62 WeakPolarHBondContact O-CB 3.38Å; L59-N62 PolarHBondContact O-N 3.32Å; N62-P66 WeakPolarHBondContact O-CD 3.15Å; N62-T165 HydrophobicContact CB-CG2 4.27Å; N62-T165 WeakPolarHBondContact CB-OG1 3.42Å; N62-T165 PolarHBondContact ND2-OG1 3.19Å; N62-Y240 PolarHBondContact ND2-OH 3.44Å; N62-T244 WeakPolarHBondContact OD1-CB 3.21Å; N62-T244 VanDerWaalsContact OD1-CG2 3.26Å; N62-T244 WeakPolarHBondContact OD1-CG2 2.98Å; N62-R246 PolarHBondContact ND2-NH1 3.28Å; N62-R246 PolarHBondContact O-NH1 3.22Å; N62-R246 PolarHBondContact O-NH2 3.1Å; N62-R246 PolarHBondContact OD1-NH1 3.39Å
63	K	95.1	Very high	95.7	Very high	123 Å²	123	40.3 Å²	40.3	54%	0.535	19%	0.187	S	C	.	.	H	α-helix	trans	-69.9	-48.7	-179.6	-177.6	171.6	-179.7	174.8	0	113.2	L59 R60 V61	L59-K63 WeakPolarHBondContact O-CB 3.22Å; L59-K63 PolarHBondContact O-N 3.35Å; R60-K63 PolarHBondContact O-N 3.4Å; V61-K63 VanDerWaalsContact C-N 3.34Å; V61-K63 PolarHBondContact O-N 3.4Å
64	L	95.7	Very high	95.9	Very high	49 Å²	49	41.1 Å²	41.1	26%	0.257	19%	0.194	S	C	.	.	H	α-helix	trans	-101.5	-20.1	-168.7	-59.6	178.4	0	0	0	114.4	R60 L67 R68 I101	R60-L64 HydrophobicContact CG-CD1 4.25Å; R60-L64 PolarHBondContact O-N 2.91Å; L64-L67 PolarHBondContact O-N 3.31Å; L64-R68 VanDerWaalsContact O-CG 3.22Å; L64-R68 WeakPolarHBondContact O-CG 3.48Å; L64-I101 HydrophobicContact CB-CD1 3.98Å; L64-I101 HydrophobicContact CB-CG1 4.22Å; L64-I101 HydrophobicContact CD1-CD1 4.33Å
65	G	95.6	Very high	95.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-56	-45.2	-176.7	0	0	0	0	0	114.6	V61 L67 R68 I71	V61-G65 WeakPolarHBondContact O-CA 3.37Å; V61-G65 PolarHBondContact O-N 2.79Å; G65-L67 PolarHBondContact O-N 3.31Å; G65-R68 PolarHBondContact O-N 2.96Å; G65-I71 WeakPolarHBondContact O-CG2 3.14Å
66	P	95.5	Very high	96	Very high	13 Å²	13	42.9 Å²	42.9	8%	0.084	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-56.7	-23.3	179.5	-28.7	36.8	0	0	0	114.7	N62 L168 I169 A172 T178	N62-P66 WeakPolarHBondContact O-CD 3.15Å; P66-L168 HydrophobicContact CG-CB 4.2Å; P66-I169 HydrophobicContact CG-CG1 4.18Å; P66-A172 HydrophobicContact CB-CB 3.72Å; P66-T178 WeakPolarHBondContact O-CG2 3.49Å
67	L	95	Very high	96.1	Very high	102 Å²	102	44.9 Å²	44.9	53%	0.534	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-96.1	12.5	-177.8	-52.9	178.5	0	0	0	113.2	L64 G65	L64-L67 PolarHBondContact O-N 3.31Å; G65-L67 PolarHBondContact O-N 3.31Å
68	R	95.5	Very high	96.1	Very high	92 Å²	92	49 Å²	49	35%	0.347	24%	0.237	S	C	.	.	S	Bend	trans	-127.3	122.3	-168.5	-64.2	-75.9	-176.3	-80	1.3	110.1	L64 G65 I71 I101	L64-R68 VanDerWaalsContact O-CG 3.22Å; L64-R68 WeakPolarHBondContact O-CG 3.48Å; G65-R68 PolarHBondContact O-N 2.96Å; R68-I71 HydrophobicContact CB-CB 4.21Å; R68-I71 WeakPolarHBondContact O-CG2 3.49Å; R68-I101 HydrophobicContact CB-CG2 4.35Å; R68-I101 HydrophobicContact CG-CG2 3.87Å
69	K	95.1	Very high	96.1	Very high	135 Å²	135	51.3 Å²	51.3	59%	0.587	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	141.3	174.9	-63.3	-172	172.7	178.9	0	109.9	I71 Y102	K69-I71 PolarHBondContact O-N 2.7Å; K69-Y102 WeakPolarHBondContact O-CE1 3.49Å; K69-Y102 PolarHBondContact O-OH 2.95Å
70	D	95.1	Very high	96.2	Very high	64 Å²	64	53.5 Å²	53.5	34%	0.342	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	20.4	173	-49.7	-18.4	0	0	0	114.6	W72 R73 A74	D70-W72 PolarHBondContact O-N 2.84Å; D70-R73 HydrophobicContact CB-CB 4.34Å; D70-R73 CarbonylContact O-C 3.56Å; D70-R73 WeakPolarHBondContact O-CA 3.41Å; D70-R73 WeakPolarHBondContact O-CB 3.4Å; D70-R73 PolarHBondContact O-N 3.36Å; D70-R73 IonicContact OD1-CZ 2.59Å; D70-R73 IonicContact OD1-NE 3.92Å; D70-R73 IonicContact OD1-NH2 3.55Å; D70-R73 PolarHBondContact OD1-NH2 3.23Å; D70-A74 HydrophobicContact CB-CB 3.85Å; D70-A74 WeakPolarHBondContact O-CB 3.46Å; D70-A74 PolarHBondContact O-N 3.45Å
71	I	97.2	Very high	96.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	140.6	178	-174	59.9	0	0	0	110.3	V61 G65 R68 K69 R73 I101 Y102 A105 I169 M180	V61-I71 HydrophobicContact CG1-CG1 4.47Å; G65-I71 WeakPolarHBondContact O-CG2 3.14Å; R68-I71 HydrophobicContact CB-CB 4.21Å; R68-I71 WeakPolarHBondContact O-CG2 3.49Å; K69-I71 PolarHBondContact O-N 2.7Å; I71-R73 PolarHBondContact O-N 3.33Å; I71-I101 HydrophobicContact CD1-CG1 4.16Å; I71-I101 HydrophobicContact CD1-CG2 4.08Å; I71-Y102 HydrophobicContact CD1-CD1 4.09Å; I71-Y102 HydrophobicContact CD1-CE1 4.39Å; I71-A105 HydrophobicContact CD1-CB 3.91Å; I71-I169 HydrophobicContact CG1-CD1 4.49Å; I71-I169 HydrophobicContact CG2-CD1 3.81Å; I71-I169 HydrophobicContact CG2-CG1 4.17Å; I71-I169 HydrophobicContact CG2-CG2 3.7Å; I71-M180 HydrophobicContact CG2-CG 4.23Å; I71-M180 WeakPolarHBondContact O-CE 3.39Å
72	W	97.4	Very high	96.3	Very high	3 Å²	3	59.2 Å²	59.2	1%	0.011	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	-26.8	-168.8	-56.7	99.9	0	0	0	116.1	V61 D70 A105 I108 K109 L162 F166 I185 V189	V61-W72 HydrophobicContact CB-CZ2 4.42Å; V61-W72 HydrophobicContact CG1-CZ2 3.56Å; D70-W72 PolarHBondContact O-N 2.84Å; W72-A105 HydrophobicContact CD2-CB 4.1Å; W72-A105 HydrophobicContact CE3-CB 4.01Å; W72-A105 HydrophobicContact CZ3-CB 4.21Å; W72-I108 HydrophobicContact CH2-CB 4.05Å; W72-I108 HydrophobicContact CH2-CD1 4.1Å; W72-I108 HydrophobicContact CH2-CG2 3.81Å; W72-I108 HydrophobicContact CZ3-CB 4.22Å; W72-I108 HydrophobicContact CZ3-CG2 4.13Å; W72-K109 HydrophobicContact CE3-CD 4.07Å; W72-K109 HydrophobicContact CE3-CG 3.68Å; W72-K109 HydrophobicContact CZ3-CG 3.7Å; W72-K109 PolarHBondContact O-NZ 2.94Å; W72-L162 HydrophobicContact CH2-CD2 3.92Å; W72-L162 HydrophobicContact CZ2-CD2 4.43Å; W72-F166 AromaticContact CD2-CE1 3.76Å; W72-F166 HydrophobicContact CD2-CE1 3.76Å; W72-F166 AromaticContact CE2-CE1 3.47Å; W72-F166 VanDerWaalsContact CE2-CE1 3.47Å; W72-F166 HydrophobicContact CE3-CE1 4.23Å; W72-F166 HydrophobicContact CG-CE1 4.17Å; W72-F166 HydrophobicContact CH2-CE1 4.18Å; W72-F166 AromaticContact CZ2-CE1 3.69Å; W72-F166 HydrophobicContact CZ2-CE1 3.69Å; W72-F166 HydrophobicContact CZ3-CE1 4.43Å; W72-F166 AromaticContact NE1-CD1 3.85Å; W72-F166 AromaticContact NE1-CE1 3.69Å; W72-I185 HydrophobicContact CB-CD1 4.42Å; W72-V189 HydrophobicContact CB-CG1 3.88Å; W72-V189 HydrophobicContact CD2-CG1 4.2Å; W72-V189 HydrophobicContact CE3-CG1 3.95Å; W72-V189 HydrophobicContact CG-CG1 4.19Å
73	R	96.3	Very high	96.3	Very high	89 Å²	89	64.9 Å²	64.9	34%	0.336	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-52.2	173.7	177.8	167.7	60.7	-130.6	8.2	112	D70 I71 R179 M180 S188	D70-R73 HydrophobicContact CB-CB 4.34Å; D70-R73 CarbonylContact O-C 3.56Å; D70-R73 WeakPolarHBondContact O-CA 3.41Å; D70-R73 WeakPolarHBondContact O-CB 3.4Å; D70-R73 PolarHBondContact O-N 3.36Å; D70-R73 IonicContact OD1-CZ 2.59Å; D70-R73 IonicContact OD1-NE 3.92Å; D70-R73 IonicContact OD1-NH2 3.55Å; D70-R73 PolarHBondContact OD1-NH2 3.23Å; I71-R73 PolarHBondContact O-N 3.33Å; R73-R179 PolarHBondContact NH1-O 3.43Å; R73-R179 PolarHBondContact NH2-O 3.35Å; R73-R179 VanDerWaalsContact NH2-O 3.16Å; R73-M180 HydrophobicContact CB-CE 4.27Å; R73-M180 HydrophobicContact CB-SD 4.18Å; R73-M180 PolarHBondContact NH1-SD 3.29Å; R73-S188 WeakPolarHBondContact CB-OG 3.49Å
74	A	96.1	Very high	96.3	Very high	25 Å²	25	59 Å²	59	21%	0.207	29%	0.287	C	S	.	.	S	Bend	trans	-73.3	139.1	-179	0	0	0	0	0	111.9	D70 Y102	D70-A74 HydrophobicContact CB-CB 3.85Å; D70-A74 WeakPolarHBondContact O-CB 3.46Å; D70-A74 PolarHBondContact O-N 3.45Å; A74-Y102 HydrophobicContact CB-CD1 4Å; A74-Y102 HydrophobicContact CB-CE1 4.09Å
75	P	95.8	Very high	96.4	Very high	66 Å²	66	57.5 Å²	57.5	43%	0.429	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-75.4	144.5	179	29	-33.8	0	0	0	112.5	E373	P75-E373 WeakPolarHBondContact CB-OE1 3.17Å; P75-E373 WeakPolarHBondContact CG-OE1 3.38Å
76	G	96.8	Very high	96.4	Very high	5 Å²	5	61.2 Å²	61.2	5%	0.052	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-72.1	160.4	164.1	0	0	0	0	0	112.3	Q78 S106	G76-Q78 PolarHBondContact O-N 3.13Å; G76-Q78 VanDerWaalsContact O-N 3.15Å; G76-S106 PolarHBondContact N-OG 3.43Å
77	N	96.8	Very high	96.2	Very high	86 Å²	86	61.8 Å²	61.8	46%	0.46	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-60.2	119.7	173.6	177.4	-59.8	0	0	0	110.3	A79 H80 V81	N77-A79 VanDerWaalsContact C-N 3.31Å; N77-A79 PolarHBondContact O-N 3.11Å; N77-A79 WeakPolarHBondContact OD1-CB 3.29Å; N77-A79 PolarHBondContact OD1-N 3.09Å; N77-H80 HydrophobicContact CB-CB 4.13Å; N77-H80 CarbonylContact O-C 3.5Å; N77-H80 WeakPolarHBondContact O-CA 3.37Å; N77-H80 WeakPolarHBondContact O-CB 3.34Å; N77-H80 PolarHBondContact O-N 3Å; N77-H80 PolarHBondContact OD1-N 3.41Å; N77-H80 VanDerWaalsContact OD1-N 3.1Å; N77-V81 WeakPolarHBondContact O-CG2 3.48Å; N77-V81 PolarHBondContact O-N 3.29Å
78	Q	96.5	Very high	96.2	Very high	85 Å²	85	57 Å²	57	40%	0.397	27%	0.273	S	S	.	.	H	α-helix	trans	-65.1	-29.2	-171.4	-63.3	-60.8	-25.8	0	0	114	G76 R82	G76-Q78 PolarHBondContact O-N 3.13Å; G76-Q78 VanDerWaalsContact O-N 3.15Å; Q78-R82 WeakPolarHBondContact O-CG 3.42Å; Q78-R82 PolarHBondContact O-N 3.36Å; Q78-R82 VanDerWaalsContact O-N 3.09Å; Q78-R82 PolarHBondContact O-NE 3.32Å
79	A	97.6	Very high	96.2	Very high	51 Å²	51	56.3 Å²	56.3	42%	0.421	27%	0.274	S	S	.	.	H	α-helix	trans	-69.2	-42.7	172.8	0	0	0	0	0	110.7	N77 R82 K83	N77-A79 VanDerWaalsContact C-N 3.31Å; N77-A79 PolarHBondContact O-N 3.11Å; N77-A79 WeakPolarHBondContact OD1-CB 3.29Å; N77-A79 PolarHBondContact OD1-N 3.09Å; A79-R82 PolarHBondContact O-N 3.07Å; A79-K83 WeakPolarHBondContact O-CB 3.5Å; A79-K83 PolarHBondContact O-N 2.98Å
80	H	97.4	Very high	96	Very high	77 Å²	77	53.9 Å²	53.9	36%	0.356	26%	0.264	S	S	.	.	H	α-helix	trans	-67.9	-37.8	175.9	-70	-173.4	0	0	0	112.6	N77 K83 L84 F99 T103	N77-H80 HydrophobicContact CB-CB 4.13Å; N77-H80 CarbonylContact O-C 3.5Å; N77-H80 WeakPolarHBondContact O-CA 3.37Å; N77-H80 WeakPolarHBondContact O-CB 3.34Å; N77-H80 PolarHBondContact O-N 3Å; N77-H80 PolarHBondContact OD1-N 3.41Å; N77-H80 VanDerWaalsContact OD1-N 3.1Å; H80-K83 PolarHBondContact O-N 3.38Å; H80-L84 WeakPolarHBondContact O-CB 3.2Å; H80-L84 PolarHBondContact O-N 2.81Å; H80-F99 HydrophobicContact CB-CD1 4.03Å; H80-F99 HydrophobicContact CB-CE1 4.18Å; H80-F99 WeakPolarHBondContact O-CE1 3.13Å; H80-T103 HydrophobicContact CB-CG2 3.97Å
81	V	97.5	Very high	95.7	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-59.3	-50.5	173.3	170.3	0	0	0	0	110.3	N77 K83 L84 I85 T103 V107 K110	N77-V81 WeakPolarHBondContact O-CG2 3.48Å; N77-V81 PolarHBondContact O-N 3.29Å; V81-K83 PolarHBondContact O-N 2.96Å; V81-L84 PolarHBondContact O-N 3.1Å; V81-I85 HydrophobicContact CG1-CD1 3.94Å; V81-I85 WeakPolarHBondContact O-CG1 3.27Å; V81-I85 PolarHBondContact O-N 3.17Å; V81-T103 HydrophobicContact CG2-CG2 3.91Å; V81-V107 HydrophobicContact CB-CG2 4.37Å; V81-V107 HydrophobicContact CG1-CG2 3.97Å; V81-V107 HydrophobicContact CG2-CG2 4.48Å; V81-K110 HydrophobicContact CG1-CD 4.36Å
82	R	97.2	Very high	95.3	Very high	171 Å²	171	56.8 Å²	56.8	65%	0.645	27%	0.271	S	S	*	.	H	α-helix	trans	-60.4	-44.1	176.7	-74.4	-176	-72.5	164.3	-4.5	112.2	Q78 A79 I85 H86	Q78-R82 WeakPolarHBondContact O-CG 3.42Å; Q78-R82 PolarHBondContact O-N 3.36Å; Q78-R82 VanDerWaalsContact O-N 3.09Å; Q78-R82 PolarHBondContact O-NE 3.32Å; A79-R82 PolarHBondContact O-N 3.07Å; R82-I85 PolarHBondContact O-N 3.39Å; R82-H86 WeakPolarHBondContact O-CB 3.41Å; R82-H86 PolarHBondContact O-N 3.47Å
83	K	96.5	Very high	94.5	Very high	124 Å²	124	60.3 Å²	60.3	54%	0.539	29%	0.289	S	S	.	.	H	α-helix	trans	-60.1	-46.5	177.4	-176.9	177	-179.9	179.5	0	111.7	A79 H80 V81 H86 I87 F99	A79-K83 WeakPolarHBondContact O-CB 3.5Å; A79-K83 PolarHBondContact O-N 2.98Å; H80-K83 PolarHBondContact O-N 3.38Å; V81-K83 PolarHBondContact O-N 2.96Å; K83-H86 PolarHBondContact O-N 3.39Å; K83-I87 HydrophobicContact CG-CD1 3.94Å; K83-I87 VanDerWaalsContact O-CG1 3.25Å; K83-I87 WeakPolarHBondContact O-CG1 3.39Å; K83-I87 PolarHBondContact O-N 3.48Å; K83-F99 HydrophobicContact CD-CZ 4.41Å; K83-F99 HydrophobicContact CG-CZ 4.41Å
84	L	96.3	Very high	93.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-66.4	-43.9	-179	-178.1	53.4	0	0	0	111.8	L57 H80 V81 H86 I87 M88 V94 F99 T103 V107	L57-L84 HydrophobicContact CD1-CD2 4.19Å; L57-L84 HydrophobicContact CD2-CD2 4.05Å; H80-L84 WeakPolarHBondContact O-CB 3.2Å; H80-L84 PolarHBondContact O-N 2.81Å; V81-L84 PolarHBondContact O-N 3.1Å; L84-H86 VanDerWaalsContact C-N 3.34Å; L84-H86 PolarHBondContact O-N 3.19Å; L84-I87 PolarHBondContact O-N 2.91Å; L84-M88 HydrophobicContact CD1-CG 4.23Å; L84-M88 HydrophobicContact CD1-SD 4.16Å; L84-M88 HydrophobicContact CG-SD 4Å; L84-M88 VanDerWaalsContact O-CG 3.28Å; L84-M88 WeakPolarHBondContact O-CG 3.22Å; L84-M88 PolarHBondContact O-N 3.3Å; L84-V94 HydrophobicContact CD1-CG2 3.77Å; L84-F99 HydrophobicContact CB-CD1 4.11Å; L84-F99 HydrophobicContact CB-CE1 3.79Å; L84-F99 HydrophobicContact CB-CZ 4.14Å; L84-F99 HydrophobicContact CD1-CD2 4.36Å; L84-F99 HydrophobicContact CD1-CE2 4.17Å; L84-F99 HydrophobicContact CD1-CZ 4.3Å; L84-F99 HydrophobicContact CD2-CB 4.47Å; L84-F99 HydrophobicContact CD2-CD1 4.23Å; L84-F99 HydrophobicContact CD2-CG 4.18Å; L84-T103 HydrophobicContact CD2-CG2 4.18Å; L84-V107 HydrophobicContact CB-CG2 4.1Å; L84-V107 HydrophobicContact CD2-CB 4.29Å; L84-V107 HydrophobicContact CD2-CG1 4.49Å; L84-V107 HydrophobicContact CD2-CG2 3.84Å; L84-V107 HydrophobicContact CG-CG1 4.46Å; L84-V107 HydrophobicContact CG-CG2 4.07Å
85	I	96.3	Very high	93.5	Very high	17 Å²	17	58.4 Å²	58.4	9%	0.087	28%	0.283	C	S	.	.	H	α-helix	trans	-57.6	-47.2	174.6	-69.8	170.1	0	0	0	110.9	F38 V81 R82 I87 M88 Q89 V107 K110	F38-I85 HydrophobicContact CD1-CG2 4.38Å; F38-I85 HydrophobicContact CD2-CG2 4.23Å; F38-I85 HydrophobicContact CE1-CD1 4.32Å; F38-I85 HydrophobicContact CE1-CG1 3.99Å; F38-I85 HydrophobicContact CE1-CG2 4.24Å; F38-I85 HydrophobicContact CE2-CG2 4.09Å; F38-I85 HydrophobicContact CG-CG2 4.38Å; F38-I85 HydrophobicContact CZ-CB 4.4Å; F38-I85 HydrophobicContact CZ-CG1 3.92Å; F38-I85 HydrophobicContact CZ-CG2 4.11Å; V81-I85 HydrophobicContact CG1-CD1 3.94Å; V81-I85 WeakPolarHBondContact O-CG1 3.27Å; V81-I85 PolarHBondContact O-N 3.17Å; R82-I85 PolarHBondContact O-N 3.39Å; I85-I87 PolarHBondContact O-N 3.07Å; I85-M88 PolarHBondContact O-N 3.27Å; I85-Q89 HydrophobicContact CG2-CG 4.26Å; I85-Q89 WeakPolarHBondContact O-CG 3.36Å; I85-Q89 PolarHBondContact O-N 2.85Å; I85-V107 HydrophobicContact CD1-CG2 4.45Å; I85-V107 HydrophobicContact CG1-CG1 4.06Å; I85-V107 HydrophobicContact CG1-CG2 4.01Å; I85-K110 HydrophobicContact CD1-CB 4.36Å; I85-K110 HydrophobicContact CD1-CD 3.59Å; I85-K110 HydrophobicContact CD1-CG 3.9Å
86	H	95.5	Very high	93.1	Very high	79 Å²	79	56.1 Å²	56.1	37%	0.366	27%	0.267	S	S	.	.	H	α-helix	trans	-59.4	-45	178	177.8	80.6	0	0	0	112.1	R82 K83 L84 M88 Q89 H90 R92	R82-H86 WeakPolarHBondContact O-CB 3.41Å; R82-H86 PolarHBondContact O-N 3.47Å; K83-H86 PolarHBondContact O-N 3.39Å; L84-H86 VanDerWaalsContact C-N 3.34Å; L84-H86 PolarHBondContact O-N 3.19Å; H86-M88 VanDerWaalsContact C-N 3.34Å; H86-M88 PolarHBondContact O-N 2.81Å; H86-Q89 PolarHBondContact O-N 3.33Å; H86-H90 AromaticContact CD2-CD2 3.9Å; H86-H90 AromaticContact CE1-CD2 3.14Å; H86-H90 PolarHBondContact CE1-CD2 3.34Å; H86-H90 AromaticContact CE1-NE2 3.05Å; H86-H90 PolarHBondContact CE1-NE2 3.42Å; H86-H90 AromaticContact CG-CD2 3.85Å; H86-H90 AromaticContact ND1-CD2 3.38Å; H86-H90 PolarHBondContact ND1-CD2 3.46Å; H86-H90 AromaticContact ND1-NE2 3.37Å; H86-H90 PolarHBondContact ND1-NE2 3.47Å; H86-H90 AromaticContact NE2-CD2 3.48Å; H86-H90 PolarHBondContact NE2-CD2 3.42Å; H86-H90 AromaticContact NE2-NE2 3.83Å; H86-H90 PolarHBondContact O-CD2 3.28Å; H86-H90 PolarHBondContact O-N 3.13Å; H86-H90 VanDerWaalsContact O-N 3.14Å; H86-R92 PolarHBondContact NE2-NH1 3.37Å; H86-R92 VanDerWaalsContact NE2-NH1 3.17Å
87	I	93	Very high	92.7	Very high	24 Å²	24	60.9 Å²	60.9	12%	0.123	29%	0.288	C	S	.	.	H	α-helix	trans	-59.2	-45.6	176.8	-71.8	167.7	0	0	0	111.1	K83 L84 I85 H90 G91 R92 V94 F99	K83-I87 HydrophobicContact CG-CD1 3.94Å; K83-I87 VanDerWaalsContact O-CG1 3.25Å; K83-I87 WeakPolarHBondContact O-CG1 3.39Å; K83-I87 PolarHBondContact O-N 3.48Å; L84-I87 PolarHBondContact O-N 2.91Å; I85-I87 PolarHBondContact O-N 3.07Å; I87-H90 PolarHBondContact O-N 2.82Å; I87-G91 PolarHBondContact O-N 2.84Å; I87-R92 HydrophobicContact CG2-CB 3.96Å; I87-R92 WeakPolarHBondContact CG2-O 3.28Å; I87-R92 PolarHBondContact O-N 2.9Å; I87-V94 HydrophobicContact CD1-CG2 4.42Å; I87-V94 HydrophobicContact CG2-CB 3.66Å; I87-V94 HydrophobicContact CG2-CG1 4.46Å; I87-V94 HydrophobicContact CG2-CG2 3.98Å; I87-F99 HydrophobicContact CD1-CZ 4.18Å
88	M	94.3	Very high	92.3	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-65.5	-42.2	179.4	-69.4	172	70.3	0	0	112.8	V36 F38 T53 L54 L57 L84 I85 H86 H90 G91 V107	V36-M88 HydrophobicContact CB-CB 4.05Å; V36-M88 HydrophobicContact CB-CE 4.13Å; V36-M88 HydrophobicContact CG1-CE 4.11Å; V36-M88 HydrophobicContact CG2-CB 3.99Å; V36-M88 HydrophobicContact CG2-CE 3.7Å; V36-M88 PolarHBondContact N-O 3Å; F38-M88 HydrophobicContact CE2-CB 4.27Å; F38-M88 HydrophobicContact CE2-CE 4.47Å; F38-M88 HydrophobicContact CZ-CE 4.3Å; F38-M88 HydrophobicContact CZ-SD 4.49Å; T53-M88 HydrophobicContact CG2-CE 4.34Å; T53-M88 HydrophobicContact CG2-CG 3.73Å; T53-M88 HydrophobicContact CG2-SD 4.39Å; L54-M88 HydrophobicContact CB-CE 4.32Å; L57-M88 HydrophobicContact CD1-CE 3.82Å; L57-M88 HydrophobicContact CD1-SD 3.67Å; L84-M88 HydrophobicContact CD1-CG 4.23Å; L84-M88 HydrophobicContact CD1-SD 4.16Å; L84-M88 HydrophobicContact CG-SD 4Å; L84-M88 VanDerWaalsContact O-CG 3.28Å; L84-M88 WeakPolarHBondContact O-CG 3.22Å; L84-M88 PolarHBondContact O-N 3.3Å; I85-M88 PolarHBondContact O-N 3.27Å; H86-M88 VanDerWaalsContact C-N 3.34Å; H86-M88 PolarHBondContact O-N 2.81Å; M88-H90 VanDerWaalsContact C-N 3.3Å; M88-H90 PolarHBondContact O-N 2.92Å; M88-G91 PolarHBondContact O-N 2.9Å; M88-V107 HydrophobicContact CE-CG1 4.32Å; M88-V107 HydrophobicContact SD-CG1 3.69Å
89	Q	94.6	Very high	92.2	Very high	79 Å²	79	60.2 Å²	60.2	37%	0.369	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-33.4	178	-74.9	175.9	-43.2	0	0	112.8	K35 F38 I85 H86 G91	K35-Q89 WeakPolarHBondContact CG-O 3.19Å; F38-Q89 HydrophobicContact CD2-CG 3.62Å; F38-Q89 HydrophobicContact CE2-CG 4.16Å; I85-Q89 HydrophobicContact CG2-CG 4.26Å; I85-Q89 WeakPolarHBondContact O-CG 3.36Å; I85-Q89 PolarHBondContact O-N 2.85Å; H86-Q89 PolarHBondContact O-N 3.33Å; Q89-G91 VanDerWaalsContact C-N 3.34Å
90	H	92.5	Very high	92.2	Very high	83 Å²	83	60.1 Å²	60.1	38%	0.384	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	0.2	177.6	-70.5	-65.8	0	0	0	113.9	H86 I87 M88 R92	H86-H90 AromaticContact CD2-CD2 3.9Å; H86-H90 AromaticContact CE1-CD2 3.14Å; H86-H90 PolarHBondContact CE1-CD2 3.34Å; H86-H90 AromaticContact CE1-NE2 3.05Å; H86-H90 PolarHBondContact CE1-NE2 3.42Å; H86-H90 AromaticContact CG-CD2 3.85Å; H86-H90 AromaticContact ND1-CD2 3.38Å; H86-H90 PolarHBondContact ND1-CD2 3.46Å; H86-H90 AromaticContact ND1-NE2 3.37Å; H86-H90 PolarHBondContact ND1-NE2 3.47Å; H86-H90 AromaticContact NE2-CD2 3.48Å; H86-H90 PolarHBondContact NE2-CD2 3.42Å; H86-H90 AromaticContact NE2-NE2 3.83Å; H86-H90 PolarHBondContact O-CD2 3.28Å; H86-H90 PolarHBondContact O-N 3.13Å; H86-H90 VanDerWaalsContact O-N 3.14Å; I87-H90 PolarHBondContact O-N 2.82Å; M88-H90 VanDerWaalsContact C-N 3.3Å; M88-H90 PolarHBondContact O-N 2.92Å; H90-R92 VanDerWaalsContact C-N 3.29Å; H90-R92 HydrophobicContact CB-CG 4.09Å; H90-R92 PolarHBondContact O-N 2.81Å
91	G	88.8	Confident	92.1	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	34.4	179.8	0	0	0	0	0	112.3	R32 I33 I87 M88 Q89	R32-G91 CarbonylContact C-O 3.58Å; R32-G91 WeakPolarHBondContact CA-O 3.24Å; I33-G91 PolarHBondContact N-O 3.01Å; I33-G91 WeakPolarHBondContact O-CA 3.25Å; I87-G91 PolarHBondContact O-N 2.84Å; M88-G91 PolarHBondContact O-N 2.9Å; Q89-G91 VanDerWaalsContact C-N 3.34Å
92	R	87.5	Confident	92.2	Very high	125 Å²	125	60 Å²	60	47%	0.472	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-88.6	144	-179.1	-68.5	178.5	-177.3	157.2	3.4	110.4	H86 I87 H90 V94	H86-R92 PolarHBondContact NE2-NH1 3.37Å; H86-R92 VanDerWaalsContact NE2-NH1 3.17Å; I87-R92 HydrophobicContact CG2-CB 3.96Å; I87-R92 WeakPolarHBondContact CG2-O 3.28Å; I87-R92 PolarHBondContact O-N 2.9Å; H90-R92 VanDerWaalsContact C-N 3.29Å; H90-R92 HydrophobicContact CB-CG 4.09Å; H90-R92 PolarHBondContact O-N 2.81Å; R92-V94 PolarHBondContact O-N 3.35Å
93	L	82.3	Confident	92.2	Very high	77 Å²	77	51.8 Å²	51.8	40%	0.403	24%	0.244	S	C	.	.			trans	-55	136.5	170.1	-73.6	163.3	0	0	0	110.6	M16 I33	M16-L93 HydrophobicContact CE-CD1 4.3Å; I33-L93 HydrophobicContact CD1-CD2 3.43Å; I33-L93 VanDerWaalsContact CD1-CD2 3.43Å; I33-L93 HydrophobicContact CD1-CG 4.2Å; I33-L93 HydrophobicContact CG1-CD2 3.94Å
94	V	83.7	Confident	92.3	Very high	29 Å²	29	45.9 Å²	45.9	18%	0.176	22%	0.219	C	C	.	.			trans	-134.2	123.4	-176.5	62.7	0	0	0	0	110.3	T53 L84 I87 R92 I96 F99	T53-V94 HydrophobicContact CG2-CG1 3.73Å; L84-V94 HydrophobicContact CD1-CG2 3.77Å; I87-V94 HydrophobicContact CD1-CG2 4.42Å; I87-V94 HydrophobicContact CG2-CB 3.66Å; I87-V94 HydrophobicContact CG2-CG1 4.46Å; I87-V94 HydrophobicContact CG2-CG2 3.98Å; R92-V94 PolarHBondContact O-N 3.35Å; V94-I96 HydrophobicContact CG1-CD1 4.26Å; V94-I96 HydrophobicContact CG1-CG1 3.78Å; V94-I96 HydrophobicContact CG2-CG1 4.42Å; V94-I96 PolarHBondContact O-N 3.42Å; V94-F99 HydrophobicContact CG2-CD2 4.18Å; V94-F99 HydrophobicContact CG2-CE2 3.57Å; V94-F99 HydrophobicContact CG2-CZ 4.43Å
95	N	86.9	Confident	92.4	Very high	45 Å²	45	46 Å²	46	24%	0.241	22%	0.219	C	C	.	.			trans	-80.5	101.1	164.4	-176.9	0.7	0	0	0	108.3	E97 H98	N95-E97 PolarHBondContact O-N 3.1Å; N95-E97 VanDerWaalsContact OD1-CB 3.22Å; N95-E97 WeakPolarHBondContact OD1-CB 3.44Å; N95-E97 WeakPolarHBondContact OD1-CG 3.47Å; N95-E97 PolarHBondContact OD1-N 3.04Å; N95-H98 PolarHBondContact ND2-NE2 2.82Å; N95-H98 VanDerWaalsContact ND2-NE2 3.14Å; N95-H98 PolarHBondContact O-N 3.13Å
96	I	87.4	Confident	92.5	Very high	17 Å²	17	45.8 Å²	45.8	9%	0.087	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-67.3	-18.9	-176.9	-57.9	171.7	0	0	0	110.7	V56 L57 R60 V94 H98 F99	V56-I96 HydrophobicContact CB-CD1 3.74Å; V56-I96 HydrophobicContact CG1-CD1 3.32Å; L57-I96 HydrophobicContact CD2-CD1 4.07Å; L57-I96 HydrophobicContact CD2-CG1 4.29Å; L57-I96 HydrophobicContact CD2-CG2 3.55Å; R60-I96 VanDerWaalsContact NH1-C 3.31Å; R60-I96 PolarHBondContact NH1-O 3.49Å; R60-I96 PolarHBondContact NH2-O 2.81Å; V94-I96 HydrophobicContact CG1-CD1 4.26Å; V94-I96 HydrophobicContact CG1-CG1 3.78Å; V94-I96 HydrophobicContact CG2-CG1 4.42Å; V94-I96 PolarHBondContact O-N 3.42Å; I96-H98 PolarHBondContact O-N 3.34Å; I96-F99 PolarHBondContact O-N 3.16Å
97	E	88	Confident	92.6	Very high	106 Å²	106	42 Å²	42	50%	0.495	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-59.6	-31.2	175.8	-61.5	-174.1	160.3	0	0	114	R60 N95 F99	R60-E97 VanDerWaalsContact NH1-CA 3.3Å; R60-E97 PolarHBondContact NH2-O 2.87Å; N95-E97 PolarHBondContact O-N 3.1Å; N95-E97 VanDerWaalsContact OD1-CB 3.22Å; N95-E97 WeakPolarHBondContact OD1-CB 3.44Å; N95-E97 WeakPolarHBondContact OD1-CG 3.47Å; N95-E97 PolarHBondContact OD1-N 3.04Å; E97-F99 PolarHBondContact O-N 3.24Å
98	H	89.5	Confident	92.8	Very high	143 Å²	143	40.9 Å²	40.9	66%	0.662	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-73.2	-10.4	176.2	-60.6	-47	0	0	0	114	N95 I96	N95-H98 PolarHBondContact ND2-NE2 2.82Å; N95-H98 VanDerWaalsContact ND2-NE2 3.14Å; N95-H98 PolarHBondContact O-N 3.13Å; I96-H98 PolarHBondContact O-N 3.34Å
99	F	94.2	Very high	93	Very high	13 Å²	13	41.7 Å²	41.7	6%	0.057	20%	0.2	C	C	.	.	S	Bend	trans	-103.1	135.2	178.4	-63.3	-87.2	0	0	0	110.3	R60 H80 K83 L84 I87 V94 I96 E97 T103	R60-F99 PolarHBondContact NH2-O 2.85Å; H80-F99 HydrophobicContact CB-CD1 4.03Å; H80-F99 HydrophobicContact CB-CE1 4.18Å; H80-F99 WeakPolarHBondContact O-CE1 3.13Å; K83-F99 HydrophobicContact CD-CZ 4.41Å; K83-F99 HydrophobicContact CG-CZ 4.41Å; L84-F99 HydrophobicContact CB-CD1 4.11Å; L84-F99 HydrophobicContact CB-CE1 3.79Å; L84-F99 HydrophobicContact CB-CZ 4.14Å; L84-F99 HydrophobicContact CD1-CD2 4.36Å; L84-F99 HydrophobicContact CD1-CE2 4.17Å; L84-F99 HydrophobicContact CD1-CZ 4.3Å; L84-F99 HydrophobicContact CD2-CB 4.47Å; L84-F99 HydrophobicContact CD2-CD1 4.23Å; L84-F99 HydrophobicContact CD2-CG 4.18Å; I87-F99 HydrophobicContact CD1-CZ 4.18Å; V94-F99 HydrophobicContact CG2-CD2 4.18Å; V94-F99 HydrophobicContact CG2-CE2 3.57Å; V94-F99 HydrophobicContact CG2-CZ 4.43Å; I96-F99 PolarHBondContact O-N 3.16Å; E97-F99 PolarHBondContact O-N 3.24Å; F99-T103 HydrophobicContact CB-CG2 4.32Å; F99-T103 HydrophobicContact CD1-CG2 3.88Å
100	S	96.1	Very high	93.1	Very high	49 Å²	49	40.7 Å²	40.7	34%	0.343	19%	0.194	S	C	.	.			trans	-64.5	156.5	174.9	77.4	0	0	0	0	110.2	Y102 T103 A104	S100-Y102 PolarHBondContact O-N 3.04Å; S100-T103 WeakPolarHBondContact O-CB 3.4Å; S100-T103 PolarHBondContact O-N 3.05Å; S100-T103 VanDerWaalsContact O-N 3.11Å; S100-T103 PolarHBondContact OG-N 3.35Å; S100-T103 VanDerWaalsContact OG-N 3.07Å; S100-T103 PolarHBondContact OG-OG1 3.13Å; S100-A104 PolarHBondContact O-N 3.21Å
101	I	97	Very high	93.4	Very high	10 Å²	10	36.8 Å²	36.8	5%	0.051	18%	0.176	C	C	.	.	H	α-helix	trans	-63.1	-31.4	176.1	-158.7	63.4	0	0	0	112.2	R60 V61 L64 R68 I71 A104 A105	R60-I101 HydrophobicContact CG-CD1 3.78Å; V61-I101 HydrophobicContact CB-CD1 4.32Å; V61-I101 HydrophobicContact CG2-CD1 3.81Å; V61-I101 HydrophobicContact CG2-CG1 4.28Å; L64-I101 HydrophobicContact CB-CD1 3.98Å; L64-I101 HydrophobicContact CB-CG1 4.22Å; L64-I101 HydrophobicContact CD1-CD1 4.33Å; R68-I101 HydrophobicContact CB-CG2 4.35Å; R68-I101 HydrophobicContact CG-CG2 3.87Å; I71-I101 HydrophobicContact CD1-CG1 4.16Å; I71-I101 HydrophobicContact CD1-CG2 4.08Å; I101-A104 PolarHBondContact O-N 3.41Å; I101-A105 PolarHBondContact O-N 2.97Å
102	Y	97.9	Very high	93.8	Very high	66 Å²	66	37 Å²	37	26%	0.259	18%	0.177	S	C	.	.	H	α-helix	trans	-65.7	-40.3	173.3	-54.2	-70.4	0	0	0	111.2	K69 I71 A74 S100 A105 S106	K69-Y102 WeakPolarHBondContact O-CE1 3.49Å; K69-Y102 PolarHBondContact O-OH 2.95Å; I71-Y102 HydrophobicContact CD1-CD1 4.09Å; I71-Y102 HydrophobicContact CD1-CE1 4.39Å; A74-Y102 HydrophobicContact CB-CD1 4Å; A74-Y102 HydrophobicContact CB-CE1 4.09Å; S100-Y102 PolarHBondContact O-N 3.04Å; Y102-A105 PolarHBondContact O-N 2.79Å; Y102-S106 WeakPolarHBondContact O-CB 3.49Å; Y102-S106 PolarHBondContact O-N 3.25Å; Y102-S106 PolarHBondContact O-OG 3.06Å
103	T	98.1	Very high	94.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-43	172.8	-65.1	0	0	0	0	111.7	H80 V81 L84 F99 S100 S106 V107	H80-T103 HydrophobicContact CB-CG2 3.97Å; V81-T103 HydrophobicContact CG2-CG2 3.91Å; L84-T103 HydrophobicContact CD2-CG2 4.18Å; F99-T103 HydrophobicContact CB-CG2 4.32Å; F99-T103 HydrophobicContact CD1-CG2 3.88Å; S100-T103 WeakPolarHBondContact O-CB 3.4Å; S100-T103 PolarHBondContact O-N 3.05Å; S100-T103 VanDerWaalsContact O-N 3.11Å; S100-T103 PolarHBondContact OG-N 3.35Å; S100-T103 VanDerWaalsContact OG-N 3.07Å; S100-T103 PolarHBondContact OG-OG1 3.13Å; T103-S106 PolarHBondContact O-N 3.33Å; T103-V107 HydrophobicContact CG2-CG2 4.5Å; T103-V107 WeakPolarHBondContact O-CG2 3.45Å; T103-V107 PolarHBondContact O-N 3.02Å
104	A	97.8	Very high	94.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.7	-48.4	175.2	0	0	0	0	0	111.6	L57 V61 S100 I101 S106 V107 I108	L57-A104 HydrophobicContact CD2-CB 3.92Å; V61-A104 HydrophobicContact CG2-CB 3.87Å; S100-A104 PolarHBondContact O-N 3.21Å; I101-A104 PolarHBondContact O-N 3.41Å; A104-S106 PolarHBondContact O-N 3.12Å; A104-V107 PolarHBondContact O-N 3.39Å; A104-I108 WeakPolarHBondContact O-CD1 3.29Å; A104-I108 WeakPolarHBondContact O-CG1 3.5Å; A104-I108 PolarHBondContact O-N 3.32Å
105	A	98.3	Very high	95.5	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-60	-45	176.7	0	0	0	0	0	112.3	V61 I71 W72 I101 Y102 V107 I108 K109	V61-A105 HydrophobicContact CG2-CB 4.49Å; I71-A105 HydrophobicContact CD1-CB 3.91Å; W72-A105 HydrophobicContact CD2-CB 4.1Å; W72-A105 HydrophobicContact CE3-CB 4.01Å; W72-A105 HydrophobicContact CZ3-CB 4.21Å; I101-A105 PolarHBondContact O-N 2.97Å; Y102-A105 PolarHBondContact O-N 2.79Å; A105-V107 PolarHBondContact O-N 3.21Å; A105-I108 PolarHBondContact O-N 2.97Å; A105-K109 WeakPolarHBondContact O-CG 3.44Å; A105-K109 PolarHBondContact O-N 2.88Å
106	S	98.2	Very high	95.9	Very high	13 Å²	13	34.9 Å²	34.9	9%	0.091	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-38.9	176.1	-69.9	0	0	0	0	112.9	G76 Y102 T103 A104 K109 K110	G76-S106 PolarHBondContact N-OG 3.43Å; Y102-S106 WeakPolarHBondContact O-CB 3.49Å; Y102-S106 PolarHBondContact O-N 3.25Å; Y102-S106 PolarHBondContact O-OG 3.06Å; T103-S106 PolarHBondContact O-N 3.33Å; A104-S106 PolarHBondContact O-N 3.12Å; S106-K109 PolarHBondContact O-N 3.28Å; S106-K110 VanDerWaalsContact O-CB 3.23Å; S106-K110 WeakPolarHBondContact O-CB 3.39Å; S106-K110 PolarHBondContact O-N 3.49Å
107	V	98.1	Very high	96.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.9	-39.9	176	169.7	0	0	0	0	111.5	F38 L57 V81 L84 I85 M88 T103 A104 A105 K110 F111	F38-V107 HydrophobicContact CZ-CG1 4.25Å; L57-V107 HydrophobicContact CD1-CB 4.45Å; L57-V107 HydrophobicContact CD1-CG1 3.93Å; V81-V107 HydrophobicContact CB-CG2 4.37Å; V81-V107 HydrophobicContact CG1-CG2 3.97Å; V81-V107 HydrophobicContact CG2-CG2 4.48Å; L84-V107 HydrophobicContact CB-CG2 4.1Å; L84-V107 HydrophobicContact CD2-CB 4.29Å; L84-V107 HydrophobicContact CD2-CG1 4.49Å; L84-V107 HydrophobicContact CD2-CG2 3.84Å; L84-V107 HydrophobicContact CG-CG1 4.46Å; L84-V107 HydrophobicContact CG-CG2 4.07Å; I85-V107 HydrophobicContact CD1-CG2 4.45Å; I85-V107 HydrophobicContact CG1-CG1 4.06Å; I85-V107 HydrophobicContact CG1-CG2 4.01Å; M88-V107 HydrophobicContact CE-CG1 4.32Å; M88-V107 HydrophobicContact SD-CG1 3.69Å; T103-V107 HydrophobicContact CG2-CG2 4.5Å; T103-V107 WeakPolarHBondContact O-CG2 3.45Å; T103-V107 PolarHBondContact O-N 3.02Å; A104-V107 PolarHBondContact O-N 3.39Å; A105-V107 PolarHBondContact O-N 3.21Å; V107-K110 PolarHBondContact O-N 3.47Å; V107-F111 WeakPolarHBondContact O-CB 3.2Å; V107-F111 PolarHBondContact O-N 2.89Å
108	I	98.3	Very high	96.6	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-48.1	174.8	-64.1	158.5	0	0	0	110.7	L54 L57 L58 V61 W72 A104 A105 K110 F111 L112 L162	L54-I108 HydrophobicContact CD1-CG1 4.14Å; L57-I108 HydrophobicContact CB-CD1 4.03Å; L57-I108 HydrophobicContact CB-CG1 4.16Å; L58-I108 HydrophobicContact CD2-CD1 4.04Å; L58-I108 HydrophobicContact CD2-CG1 4.42Å; L58-I108 HydrophobicContact CD2-CG2 3.98Å; L58-I108 HydrophobicContact CG-CD1 4.26Å; V61-I108 HydrophobicContact CG2-CD1 3.96Å; W72-I108 HydrophobicContact CH2-CB 4.05Å; W72-I108 HydrophobicContact CH2-CD1 4.1Å; W72-I108 HydrophobicContact CH2-CG2 3.81Å; W72-I108 HydrophobicContact CZ3-CB 4.22Å; W72-I108 HydrophobicContact CZ3-CG2 4.13Å; A104-I108 WeakPolarHBondContact O-CD1 3.29Å; A104-I108 WeakPolarHBondContact O-CG1 3.5Å; A104-I108 PolarHBondContact O-N 3.32Å; A105-I108 PolarHBondContact O-N 2.97Å; I108-K110 VanDerWaalsContact C-N 3.29Å; I108-K110 PolarHBondContact O-N 3.42Å; I108-F111 PolarHBondContact O-N 3.37Å; I108-L112 HydrophobicContact CG2-CD1 4.18Å; I108-L112 WeakPolarHBondContact O-CG 3.32Å; I108-L112 PolarHBondContact O-N 3.28Å; I108-L112 VanDerWaalsContact O-N 3.09Å; I108-L162 HydrophobicContact CG2-CD2 3.93Å
109	K	98	Very high	97	Very high	18 Å²	18	25 Å²	25	8%	0.078	14%	0.139	C	C	.	.	H	α-helix	trans	-54.9	-46.3	174.2	-75	-159.4	-61.8	-178	0	111.4	W72 A105 S106 F111 L112 S113 V189 S192	W72-K109 HydrophobicContact CE3-CD 4.07Å; W72-K109 HydrophobicContact CE3-CG 3.68Å; W72-K109 HydrophobicContact CZ3-CG 3.7Å; W72-K109 PolarHBondContact O-NZ 2.94Å; A105-K109 WeakPolarHBondContact O-CG 3.44Å; A105-K109 PolarHBondContact O-N 2.88Å; S106-K109 PolarHBondContact O-N 3.28Å; K109-F111 PolarHBondContact O-N 2.9Å; K109-L112 PolarHBondContact O-N 2.88Å; K109-S113 WeakPolarHBondContact O-CB 3.23Å; K109-S113 PolarHBondContact O-N 3.35Å; K109-S113 PolarHBondContact O-OG 3.1Å; K109-V189 HydrophobicContact CD-CG1 4.44Å; K109-S192 WeakPolarHBondContact CB-OG 3.34Å; K109-S192 WeakPolarHBondContact O-CB 3.35Å; K109-S192 PolarHBondContact O-OG 2.98Å
110	K	97.3	Very high	97.2	Very high	58 Å²	58	24.8 Å²	24.8	25%	0.252	14%	0.138	S	C	.	.	H	α-helix	trans	-68.9	-31.4	-179.3	-171.5	152	-178.2	165.6	0	113.4	V81 I85 S106 V107 I108 S113 K114	V81-K110 HydrophobicContact CG1-CD 4.36Å; I85-K110 HydrophobicContact CD1-CB 4.36Å; I85-K110 HydrophobicContact CD1-CD 3.59Å; I85-K110 HydrophobicContact CD1-CG 3.9Å; S106-K110 VanDerWaalsContact O-CB 3.23Å; S106-K110 WeakPolarHBondContact O-CB 3.39Å; S106-K110 PolarHBondContact O-N 3.49Å; V107-K110 PolarHBondContact O-N 3.47Å; I108-K110 VanDerWaalsContact C-N 3.29Å; I108-K110 PolarHBondContact O-N 3.42Å; K110-S113 WeakPolarHBondContact CA-OG 3.12Å; K110-S113 PolarHBondContact O-OG 3.18Å; K110-K114 HydrophobicContact CG-CG 4.46Å; K110-K114 WeakPolarHBondContact O-CB 3.37Å; K110-K114 WeakPolarHBondContact O-CG 3.38Å; K110-K114 PolarHBondContact O-N 3.44Å
111	F	98.1	Very high	97.2	Very high	1 Å²	1	23.6 Å²	23.6	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-64.4	-51.5	172.3	173.3	-100.3	0	0	0	110.5	V36 F38 A45 F46 L54 V107 I108 K109 S113 K114 L115	V36-F111 HydrophobicContact CG1-CD2 3.83Å; V36-F111 HydrophobicContact CG1-CE2 3.63Å; F38-F111 HydrophobicContact CD1-CB 4.15Å; F38-F111 AromaticContact CD1-CD2 3.98Å; F38-F111 HydrophobicContact CD1-CD2 3.98Å; F38-F111 HydrophobicContact CD2-CD2 4.44Å; F38-F111 HydrophobicContact CE1-CB 3.57Å; F38-F111 AromaticContact CE1-CD2 3.9Å; F38-F111 HydrophobicContact CE1-CD2 3.9Å; F38-F111 HydrophobicContact CE1-CG 4.24Å; F38-F111 HydrophobicContact CE2-CD2 4.37Å; F38-F111 HydrophobicContact CG-CD2 4.26Å; F38-F111 HydrophobicContact CZ-CB 4.16Å; F38-F111 HydrophobicContact CZ-CD2 4.1Å; A45-F111 HydrophobicContact CB-CZ 4.09Å; F46-F111 AromaticContact CE1-CE1 3.88Å; F46-F111 HydrophobicContact CE1-CE1 3.88Å; F46-F111 AromaticContact CE1-CZ 3.84Å; F46-F111 HydrophobicContact CE1-CZ 3.84Å; F46-F111 AromaticContact CZ-CE1 3.61Å; F46-F111 HydrophobicContact CZ-CE1 3.61Å; F46-F111 AromaticContact CZ-CZ 3.82Å; F46-F111 HydrophobicContact CZ-CZ 3.82Å; L54-F111 HydrophobicContact CD1-CD1 4.27Å; L54-F111 HydrophobicContact CD1-CG 4.46Å; L54-F111 HydrophobicContact CD2-CD1 3.64Å; L54-F111 HydrophobicContact CD2-CE1 3.33Å; L54-F111 HydrophobicContact CD2-CE2 4.37Å; L54-F111 HydrophobicContact CD2-CG 4.27Å; L54-F111 HydrophobicContact CD2-CZ 3.74Å; V107-F111 WeakPolarHBondContact O-CB 3.2Å; V107-F111 PolarHBondContact O-N 2.89Å; I108-F111 PolarHBondContact O-N 3.37Å; K109-F111 PolarHBondContact O-N 2.9Å; F111-S113 PolarHBondContact O-N 3.41Å; F111-K114 PolarHBondContact O-N 2.93Å; F111-K114 VanDerWaalsContact O-N 3.16Å; F111-L115 HydrophobicContact CE1-CD1 4.49Å; F111-L115 HydrophobicContact CE1-CD2 4.36Å; F111-L115 HydrophobicContact CE2-CD2 4.45Å; F111-L115 HydrophobicContact CZ-CD2 4.05Å; F111-L115 PolarHBondContact O-N 2.69Å
112	L	97.9	Very high	97.1	Very high	5 Å²	5	25.9 Å²	25.9	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-43.2	178.4	-66	165.8	0	0	0	112.3	I108 K109 K114 L115 I119 L158 L162 S192 L193 H195	I108-L112 HydrophobicContact CG2-CD1 4.18Å; I108-L112 WeakPolarHBondContact O-CG 3.32Å; I108-L112 PolarHBondContact O-N 3.28Å; I108-L112 VanDerWaalsContact O-N 3.09Å; K109-L112 PolarHBondContact O-N 2.88Å; L112-K114 PolarHBondContact O-N 3.29Å; L112-L115 HydrophobicContact CD2-CD1 4.41Å; L112-L115 PolarHBondContact O-N 3.33Å; L112-I119 HydrophobicContact CD2-CD1 3.98Å; L112-L158 HydrophobicContact CD2-CD2 3.98Å; L112-L162 HydrophobicContact CD1-CD1 3.81Å; L112-L162 HydrophobicContact CD2-CD1 4.31Å; L112-S192 CarbonylContact C-O 3.16Å; L112-S192 VanDerWaalsContact C-O 3.29Å; L112-S192 VanDerWaalsContact CB-O 3.27Å; L112-S192 WeakPolarHBondContact CB-O 3.28Å; L112-L193 HydrophobicContact CD1-CD2 3.95Å; L112-L193 HydrophobicContact CD2-CD2 4.46Å; L112-H195 PolarHBondContact O-NE2 3.22Å
113	S	95.8	Very high	97	Very high	20 Å²	20	30.7 Å²	30.7	14%	0.14	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.1	-179.9	80.4	0	0	0	0	113.8	K109 K110 F111 S192	K109-S113 WeakPolarHBondContact O-CB 3.23Å; K109-S113 PolarHBondContact O-N 3.35Å; K109-S113 PolarHBondContact O-OG 3.1Å; K110-S113 WeakPolarHBondContact CA-OG 3.12Å; K110-S113 PolarHBondContact O-OG 3.18Å; F111-S113 PolarHBondContact O-N 3.41Å; S113-S192 PolarHBondContact N-O 3.18Å
114	K	95.8	Very high	97	Very high	93 Å²	93	32.7 Å²	32.7	40%	0.404	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	1.7	178.6	-64.6	-65.1	179.6	-159.3	0	112.7	G39 K110 F111 L112 N116 F374	G39-K114 CarbonylContact C-O 3.29Å; G39-K114 WeakPolarHBondContact CA-O 3.45Å; G39-K114 PolarHBondContact N-O 3.5Å; K110-K114 HydrophobicContact CG-CG 4.46Å; K110-K114 WeakPolarHBondContact O-CB 3.37Å; K110-K114 WeakPolarHBondContact O-CG 3.38Å; K110-K114 PolarHBondContact O-N 3.44Å; F111-K114 PolarHBondContact O-N 2.93Å; F111-K114 VanDerWaalsContact O-N 3.16Å; L112-K114 PolarHBondContact O-N 3.29Å; K114-N116 PolarHBondContact O-N 3.44Å; K114-F374 PolarHBondContact NZ-OXT 2.98Å
115	L	97	Very high	97	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	19%	0.19	C	C	.	.	S	Bend	trans	-65.4	123	172.9	-71.2	175.3	0	0	0	109.9	V40 A45 F46 F111 L112 G117 G118 I119 H195	V40-L115 CarbonylContact O-C 3.56Å; V40-L115 WeakPolarHBondContact O-CA 3.47Å; A45-L115 HydrophobicContact CB-CD2 3.78Å; F46-L115 HydrophobicContact CE2-CD1 4.35Å; F111-L115 HydrophobicContact CE1-CD1 4.49Å; F111-L115 HydrophobicContact CE1-CD2 4.36Å; F111-L115 HydrophobicContact CE2-CD2 4.45Å; F111-L115 HydrophobicContact CZ-CD2 4.05Å; F111-L115 PolarHBondContact O-N 2.69Å; L112-L115 HydrophobicContact CD2-CD1 4.41Å; L112-L115 PolarHBondContact O-N 3.33Å; L115-G117 PolarHBondContact O-N 3.1Å; L115-G118 PolarHBondContact O-N 3.5Å; L115-I119 HydrophobicContact CD1-CB 4.15Å; L115-H195 PolarHBondContact O-CE1 2.93Å; L115-H195 PolarHBondContact O-ND1 2.9Å
116	N	95.5	Very high	96.9	Very high	117 Å²	117	37.1 Å²	37.1	63%	0.626	21%	0.21	S	C	*	.	B	Isolated β-bridge	trans	-64.5	123	177.2	-173.6	14.8	0	0	0	109.7	V40 K114 G118	V40-N116 PolarHBondContact O-N 2.78Å; K114-N116 PolarHBondContact O-N 3.44Å; N116-G118 VanDerWaalsContact C-N 3.3Å
117	G	94	Very high	96.9	Very high	46 Å²	46	39.7 Å²	39.7	47%	0.474	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	0.3	-173.7	0	0	0	0	0	115.2	L115 G121	L115-G117 PolarHBondContact O-N 3.1Å; G117-G121 VanDerWaalsContact O-CA 3.32Å; G117-G121 WeakPolarHBondContact O-CA 3.43Å; G117-G121 PolarHBondContact O-N 2.94Å
118	G	96.3	Very high	96.9	Very high	6 Å²	6	39.7 Å²	39.7	6%	0.062	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	172.7	-176.1	0	0	0	0	0	113.5	L115 N116	L115-G118 PolarHBondContact O-N 3.5Å; N116-G118 VanDerWaalsContact C-N 3.3Å
119	I	97.8	Very high	96.8	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.031	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-30.1	180	-168.5	164.4	0	0	0	112.5	L112 L115 L158 L159 L193	L112-I119 HydrophobicContact CD2-CD1 3.98Å; L115-I119 HydrophobicContact CD1-CB 4.15Å; I119-L158 HydrophobicContact CD1-CD2 3.73Å; I119-L158 HydrophobicContact CD1-CG 4.3Å; I119-L159 HydrophobicContact CD1-CD2 3.84Å; I119-L159 HydrophobicContact CD1-CG 4Å; I119-L159 HydrophobicContact CG2-CD2 4.49Å; I119-L193 HydrophobicContact CG2-CD2 4.32Å
120	F	97.6	Very high	96.8	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.035	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-34.2	-179.9	-61.1	-60.6	0	0	0	112.6	N124 E125 L128 F148 L151 L159 L193 F194	F120-N124 HydrophobicContact CB-CB 4.05Å; F120-N124 VanDerWaalsContact O-CB 3.26Å; F120-N124 WeakPolarHBondContact O-CB 3.47Å; F120-N124 PolarHBondContact O-ND2 3.14Å; F120-E125 HydrophobicContact CB-CG 3.86Å; F120-E125 HydrophobicContact CD2-CG 4.34Å; F120-L128 HydrophobicContact CD1-CD1 3.92Å; F120-L128 HydrophobicContact CD2-CD1 4.14Å; F120-L128 HydrophobicContact CE1-CD1 4.13Å; F120-L128 HydrophobicContact CE2-CD1 4.31Å; F120-L128 HydrophobicContact CG-CD1 3.94Å; F120-L128 HydrophobicContact CZ-CD1 4.32Å; F120-F148 HydrophobicContact CE1-CD1 4.03Å; F120-F148 AromaticContact CE1-CE1 3.58Å; F120-F148 HydrophobicContact CE1-CE1 3.58Å; F120-F148 HydrophobicContact CZ-CE1 4.07Å; F120-L151 HydrophobicContact CD1-CD1 3.99Å; F120-L151 HydrophobicContact CE1-CD1 4.2Å; F120-L159 HydrophobicContact CD1-CD1 4.46Å; F120-L159 HydrophobicContact CE1-CD1 3.61Å; F120-L159 HydrophobicContact CE1-CD2 3.91Å; F120-L159 HydrophobicContact CE1-CG 4.44Å; F120-L159 HydrophobicContact CZ-CD1 4.27Å; F120-L159 HydrophobicContact CZ-CD2 3.69Å; F120-L193 WeakPolarHBondContact CD2-O 3.27Å; F120-L193 HydrophobicContact CE2-CB 4.21Å; F120-F194 HydrophobicContact CD2-CD1 4.25Å; F120-F194 HydrophobicContact CD2-CE1 4.01Å; F120-F194 HydrophobicContact CD2-CZ 4.25Å; F120-F194 HydrophobicContact CE2-CD1 4.48Å; F120-F194 AromaticContact CE2-CE1 3.99Å; F120-F194 HydrophobicContact CE2-CE1 3.99Å; F120-F194 HydrophobicContact CE2-CE2 4.07Å; F120-F194 AromaticContact CE2-CZ 3.76Å; F120-F194 HydrophobicContact CE2-CZ 3.76Å; F120-F194 HydrophobicContact CZ-CZ 4.49Å
121	G	95.7	Very high	96.8	Very high	24 Å²	24	40.1 Å²	40.1	25%	0.247	24%	0.235	C	C	.	.			trans	79.8	151.2	-163.7	0	0	0	0	0	111.8	G117 E123 N124 E125	G117-G121 VanDerWaalsContact O-CA 3.32Å; G117-G121 WeakPolarHBondContact O-CA 3.43Å; G117-G121 PolarHBondContact O-N 2.94Å; G121-E123 VanDerWaalsContact C-N 3.31Å; G121-E123 PolarHBondContact O-N 3.3Å; G121-N124 PolarHBondContact O-N 3.25Å; G121-E125 WeakPolarHBondContact O-CG 3.45Å; G121-E125 PolarHBondContact O-N 2.93Å
122	A	95.2	Very high	96.6	Very high	59 Å²	59	40.9 Å²	40.9	49%	0.488	24%	0.239	S	C	.	.	H	α-helix	trans	-58.7	-38.4	-172.9	0	0	0	0	0	113.7	E125 Q126 T196	A122-E125 PolarHBondContact O-N 3.36Å; A122-Q126 WeakPolarHBondContact O-CG 3.27Å; A122-Q126 PolarHBondContact O-N 3.24Å; A122-Q126 VanDerWaalsContact O-N 3.14Å; A122-T196 HydrophobicContact CB-CG2 3.9Å
123	E	96.6	Very high	96.6	Very high	167 Å²	167	47.9 Å²	47.9	78%	0.78	27%	0.272	S	S	*	.	H	α-helix	trans	-64.2	-48.2	179.9	-64.3	-179.7	178.7	0	0	111.9	G121 E125 Q126 V127	G121-E123 VanDerWaalsContact C-N 3.31Å; G121-E123 PolarHBondContact O-N 3.3Å; E123-E125 VanDerWaalsContact C-N 3.33Å; E123-E125 PolarHBondContact O-N 3.07Å; E123-Q126 WeakPolarHBondContact O-CB 3.5Å; E123-Q126 PolarHBondContact O-N 2.89Å; E123-V127 WeakPolarHBondContact O-CG2 3.48Å; E123-V127 PolarHBondContact O-N 3.16Å; E123-V127 VanDerWaalsContact O-N 3.1Å
124	N	98	Very high	96.6	Very high	41 Å²	41	49.4 Å²	49.4	22%	0.219	28%	0.278	C	S	.	.	H	α-helix	trans	-66.2	-34.7	177.6	-75.4	-34.5	0	0	0	112.1	F120 G121 Q126 V127 L128 V147	F120-N124 HydrophobicContact CB-CB 4.05Å; F120-N124 VanDerWaalsContact O-CB 3.26Å; F120-N124 WeakPolarHBondContact O-CB 3.47Å; F120-N124 PolarHBondContact O-ND2 3.14Å; G121-N124 PolarHBondContact O-N 3.25Å; N124-Q126 VanDerWaalsContact C-N 3.32Å; N124-Q126 PolarHBondContact O-N 3Å; N124-V127 PolarHBondContact O-N 3.11Å; N124-L128 WeakPolarHBondContact O-CB 3.46Å; N124-L128 VanDerWaalsContact O-CG 3.27Å; N124-L128 WeakPolarHBondContact O-CG 3.41Å; N124-L128 PolarHBondContact O-N 2.99Å; N124-V147 HydrophobicContact CB-CG1 3.72Å
125	E	97.8	Very high	96.6	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-60.1	-42.3	172.7	-69.2	-171.8	-161.4	0	0	111.5	F120 G121 A122 E123 V127 L128 F129 F194 H195 T196	F120-E125 HydrophobicContact CB-CG 3.86Å; F120-E125 HydrophobicContact CD2-CG 4.34Å; G121-E125 WeakPolarHBondContact O-CG 3.45Å; G121-E125 PolarHBondContact O-N 2.93Å; A122-E125 PolarHBondContact O-N 3.36Å; E123-E125 VanDerWaalsContact C-N 3.33Å; E123-E125 PolarHBondContact O-N 3.07Å; E125-V127 PolarHBondContact O-N 3.02Å; E125-L128 PolarHBondContact O-N 3.33Å; E125-F129 HydrophobicContact CB-CE2 4.39Å; E125-F129 HydrophobicContact CB-CZ 4.26Å; E125-F129 WeakPolarHBondContact O-CD1 3.32Å; E125-F129 WeakPolarHBondContact O-CD2 3.38Å; E125-F129 WeakPolarHBondContact O-CG 3.24Å; E125-F129 PolarHBondContact O-N 2.67Å; E125-F194 HydrophobicContact CB-CD1 4.23Å; E125-F194 HydrophobicContact CG-CD1 3.75Å; E125-F194 HydrophobicContact CG-CE1 4.39Å; E125-F194 WeakPolarHBondContact OE1-CA 3.29Å; E125-H195 PolarHBondContact OE1-N 3.2Å; E125-H195 PolarHBondContact OE2-N 3.46Å; E125-T196 HydrophobicContact CB-CG2 4.5Å; E125-T196 WeakPolarHBondContact OE2-CB 3.42Å; E125-T196 VanDerWaalsContact OE2-CG2 3.28Å; E125-T196 WeakPolarHBondContact OE2-CG2 3.45Å; E125-T196 PolarHBondContact OE2-N 2.99Å; E125-T196 PolarHBondContact OE2-OG1 3.35Å
126	Q	96.4	Very high	96.6	Very high	93 Å²	93	56.2 Å²	56.2	44%	0.435	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-41.5	175.4	-66.2	-59.5	-22.3	0	0	112.4	A122 E123 N124 F129 S130	A122-Q126 WeakPolarHBondContact O-CG 3.27Å; A122-Q126 PolarHBondContact O-N 3.24Å; A122-Q126 VanDerWaalsContact O-N 3.14Å; E123-Q126 WeakPolarHBondContact O-CB 3.5Å; E123-Q126 PolarHBondContact O-N 2.89Å; N124-Q126 VanDerWaalsContact C-N 3.32Å; N124-Q126 PolarHBondContact O-N 3Å; Q126-F129 PolarHBondContact O-N 2.91Å; Q126-S130 WeakPolarHBondContact O-CB 3.31Å; Q126-S130 PolarHBondContact O-N 2.91Å; Q126-S130 PolarHBondContact O-OG 2.92Å
127	V	97.4	Very high	96.5	Very high	67 Å²	67	53.3 Å²	53.3	41%	0.406	30%	0.302	S	S	.	.	H	α-helix	trans	-62.1	-45.7	175.3	177.9	0	0	0	0	110.4	E123 N124 E125 F129 S130 C131 V147	E123-V127 WeakPolarHBondContact O-CG2 3.48Å; E123-V127 PolarHBondContact O-N 3.16Å; E123-V127 VanDerWaalsContact O-N 3.1Å; N124-V127 PolarHBondContact O-N 3.11Å; E125-V127 PolarHBondContact O-N 3.02Å; V127-F129 VanDerWaalsContact C-N 3.33Å; V127-F129 PolarHBondContact O-N 3.13Å; V127-S130 PolarHBondContact O-N 3.41Å; V127-C131 PolarHBondContact O-N 3.2Å; V127-C131 PolarHBondContact O-SG 3.23Å; V127-V147 HydrophobicContact CB-CG2 4.03Å; V127-V147 HydrophobicContact CG1-CG2 3.54Å
128	L	98.2	Very high	96.5	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-61.8	-39.3	178	-73.6	169.8	0	0	0	112.3	F120 N124 E125 C131 V144 V147 F148 F194 V218	F120-L128 HydrophobicContact CD1-CD1 3.92Å; F120-L128 HydrophobicContact CD2-CD1 4.14Å; F120-L128 HydrophobicContact CE1-CD1 4.13Å; F120-L128 HydrophobicContact CE2-CD1 4.31Å; F120-L128 HydrophobicContact CG-CD1 3.94Å; F120-L128 HydrophobicContact CZ-CD1 4.32Å; N124-L128 WeakPolarHBondContact O-CB 3.46Å; N124-L128 VanDerWaalsContact O-CG 3.27Å; N124-L128 WeakPolarHBondContact O-CG 3.41Å; N124-L128 PolarHBondContact O-N 2.99Å; E125-L128 PolarHBondContact O-N 3.33Å; L128-C131 WeakPolarHBondContact O-CB 3.33Å; L128-C131 PolarHBondContact O-N 2.94Å; L128-V144 HydrophobicContact CD2-CB 4.41Å; L128-V144 HydrophobicContact CD2-CG1 4.14Å; L128-V144 HydrophobicContact CD2-CG2 4.08Å; L128-V147 HydrophobicContact CD1-CG1 3.99Å; L128-V147 HydrophobicContact CD2-CB 4.1Å; L128-V147 HydrophobicContact CD2-CG1 4.08Å; L128-V147 HydrophobicContact CD2-CG2 4.23Å; L128-V147 HydrophobicContact CG-CB 4.36Å; L128-V147 HydrophobicContact CG-CG1 3.92Å; L128-V147 HydrophobicContact CG-CG2 4.3Å; L128-F148 HydrophobicContact CD2-CE1 4.44Å; L128-F194 HydrophobicContact CB-CE1 4.22Å; L128-F194 HydrophobicContact CD1-CE1 3.77Å; L128-F194 HydrophobicContact CD1-CZ 4.18Å; L128-V218 HydrophobicContact CB-CG1 4.19Å; L128-V218 HydrophobicContact CD2-CG1 4.43Å; L128-V218 WeakPolarHBondContact O-CG2 3.26Å
129	F	97.6	Very high	96.6	Very high	18 Å²	18	61.5 Å²	61.5	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-45.1	174.4	-65.1	-13.4	0	0	0	111.7	E125 Q126 V127 C131 L132 F194 T196 T214 A215 V218	E125-F129 HydrophobicContact CB-CE2 4.39Å; E125-F129 HydrophobicContact CB-CZ 4.26Å; E125-F129 WeakPolarHBondContact O-CD1 3.32Å; E125-F129 WeakPolarHBondContact O-CD2 3.38Å; E125-F129 WeakPolarHBondContact O-CG 3.24Å; E125-F129 PolarHBondContact O-N 2.67Å; Q126-F129 PolarHBondContact O-N 2.91Å; V127-F129 VanDerWaalsContact C-N 3.33Å; V127-F129 PolarHBondContact O-N 3.13Å; F129-C131 PolarHBondContact O-N 3.38Å; F129-L132 WeakPolarHBondContact O-CB 3.35Å; F129-L132 PolarHBondContact O-N 3Å; F129-F194 HydrophobicContact CD1-CD1 4.49Å; F129-F194 AromaticContact CE1-CD1 3.45Å; F129-F194 HydrophobicContact CE1-CD1 3.45Å; F129-F194 VanDerWaalsContact CE1-CD1 3.45Å; F129-F194 AromaticContact CE1-CE1 3.84Å; F129-F194 HydrophobicContact CE1-CE1 3.84Å; F129-F194 HydrophobicContact CE1-CG 4.14Å; F129-F194 HydrophobicContact CZ-CB 4.37Å; F129-F194 AromaticContact CZ-CD1 3.84Å; F129-F194 HydrophobicContact CZ-CD1 3.84Å; F129-F194 HydrophobicContact CZ-CG 4.4Å; F129-T196 WeakPolarHBondContact CE2-OG1 3.4Å; F129-T214 HydrophobicContact CB-CG2 3.64Å; F129-T214 HydrophobicContact CD1-CG2 3.7Å; F129-T214 HydrophobicContact CD2-CG2 4.44Å; F129-T214 HydrophobicContact CG-CG2 3.66Å; F129-A215 HydrophobicContact CE1-CB 3.78Å; F129-A215 HydrophobicContact CZ-CB 4.13Å; F129-V218 HydrophobicContact CD1-CG2 4.07Å
130	S	96.9	Very high	96.5	Very high	63 Å²	63	63.2 Å²	63.2	44%	0.441	33%	0.331	S	S	.	.	H	α-helix	trans	-65.1	-27.3	178.9	-52.8	0	0	0	0	112.4	Q126 V127 L132 E133	Q126-S130 WeakPolarHBondContact O-CB 3.31Å; Q126-S130 PolarHBondContact O-N 2.91Å; Q126-S130 PolarHBondContact O-OG 2.92Å; V127-S130 PolarHBondContact O-N 3.41Å; S130-L132 PolarHBondContact O-N 3.42Å; S130-L132 VanDerWaalsContact O-N 3.13Å; S130-E133 WeakPolarHBondContact O-CB 3.34Å; S130-E133 PolarHBondContact O-N 3.24Å
131	C	96.5	Very high	96.5	Very high	4 Å²	4	64 Å²	64	3%	0.027	33%	0.334	C	S	.	.	H	α-helix	trans	-56.8	-29.8	175.8	-69.4	0	0	0	0	112.5	V127 L128 F129 E133 I134 R140 A143 V144	V127-C131 PolarHBondContact O-N 3.2Å; V127-C131 PolarHBondContact O-SG 3.23Å; L128-C131 WeakPolarHBondContact O-CB 3.33Å; L128-C131 PolarHBondContact O-N 2.94Å; F129-C131 PolarHBondContact O-N 3.38Å; C131-E133 PolarHBondContact O-N 2.92Å; C131-E133 VanDerWaalsContact O-N 3.16Å; C131-I134 HydrophobicContact CB-CD1 4.42Å; C131-I134 WeakPolarHBondContact O-CB 3.44Å; C131-I134 PolarHBondContact O-N 2.92Å; C131-I134 VanDerWaalsContact O-N 3.13Å; C131-R140 HydrophobicContact CB-CG 4.19Å; C131-R140 WeakPolarHBondContact O-CD 3.37Å; C131-R140 VanDerWaalsContact O-CG 3.23Å; C131-R140 WeakPolarHBondContact O-CG 3.46Å; C131-R140 PolarHBondContact O-NE 3.05Å; C131-A143 WeakPolarHBondContact SG-CB 3.44Å; C131-V144 HydrophobicContact CB-CG2 4.35Å
132	L	95.8	Very high	96.6	Very high	17 Å²	17	66.4 Å²	66.4	9%	0.089	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-17.7	179.4	-64.3	-176.5	0	0	0	113.7	F129 S130 T214 R217 V218 F221	F129-L132 WeakPolarHBondContact O-CB 3.35Å; F129-L132 PolarHBondContact O-N 3Å; S130-L132 PolarHBondContact O-N 3.42Å; S130-L132 VanDerWaalsContact O-N 3.13Å; L132-T214 HydrophobicContact CD1-CG2 3.93Å; L132-R217 HydrophobicContact CD1-CB 3.6Å; L132-R217 HydrophobicContact CD2-CB 4.48Å; L132-V218 HydrophobicContact CD1-CG2 3.94Å; L132-V218 HydrophobicContact CD2-CG2 4.24Å; L132-V218 HydrophobicContact CG-CG2 3.97Å; L132-F221 HydrophobicContact CD2-CB 4.47Å
133	E	96.2	Very high	96.7	Very high	153 Å²	153	63.8 Å²	63.8	72%	0.715	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-20.8	177.7	-57.6	-176.8	166.3	0	0	112.6	S130 C131 Q135	S130-E133 WeakPolarHBondContact O-CB 3.34Å; S130-E133 PolarHBondContact O-N 3.24Å; C131-E133 PolarHBondContact O-N 2.92Å; C131-E133 VanDerWaalsContact O-N 3.16Å; E133-Q135 PolarHBondContact O-N 3.03Å; E133-Q135 PolarHBondContact O-NE2 3.18Å; E133-Q135 VanDerWaalsContact O-NE2 3.1Å
134	I	97.1	Very high	96.8	Very high	52 Å²	52	55.9 Å²	55.9	27%	0.267	28%	0.28	S	S	.	.			trans	-65.9	115.2	177.4	-57	173	0	0	0	108.7	C131 D136 K139 R140 A143	C131-I134 HydrophobicContact CB-CD1 4.42Å; C131-I134 WeakPolarHBondContact O-CB 3.44Å; C131-I134 PolarHBondContact O-N 2.92Å; C131-I134 VanDerWaalsContact O-N 3.13Å; I134-D136 WeakPolarHBondContact CG2-O 3.5Å; I134-K139 HydrophobicContact CG2-CB 3.83Å; I134-R140 HydrophobicContact CB-CB 4.17Å; I134-R140 HydrophobicContact CB-CG 4.47Å; I134-R140 HydrophobicContact CG2-CB 4.2Å; I134-R140 VanDerWaalsContact O-CZ 3.22Å; I134-R140 PolarHBondContact O-NE 3.43Å; I134-R140 PolarHBondContact O-NH2 3.26Å; I134-A143 HydrophobicContact CD1-CB 3.71Å
135	Q	95.2	Very high	96.8	Very high	165 Å²	165	55 Å²	55	77%	0.771	28%	0.277	S	S	*	.	S	Bend	trans	-69.5	-40.8	-176.3	-62.3	-57.5	-50.2	0	0	112.9	E133 S137	E133-Q135 PolarHBondContact O-N 3.03Å; E133-Q135 PolarHBondContact O-NE2 3.18Å; E133-Q135 VanDerWaalsContact O-NE2 3.1Å; Q135-S137 PolarHBondContact O-N 3.49Å
136	D	96.4	Very high	96.8	Very high	72 Å²	72	63.5 Å²	63.5	39%	0.385	31%	0.309	S	S	.	.			trans	-73.2	115.1	178.6	177.8	2.1	0	0	0	110.5	I134 Q138 K139 R140	I134-D136 WeakPolarHBondContact CG2-O 3.5Å; D136-Q138 VanDerWaalsContact C-N 3.25Å; D136-Q138 PolarHBondContact O-N 3.34Å; D136-Q138 WeakPolarHBondContact OD1-CB 3.45Å; D136-Q138 PolarHBondContact OD1-N 2.95Å; D136-K139 HydrophobicContact CB-CB 4.16Å; D136-K139 HydrophobicContact CB-CD 4.13Å; D136-K139 HydrophobicContact CB-CG 4.3Å; D136-K139 PolarHBondContact O-N 2.89Å; D136-K139 WeakPolarHBondContact OD2-CD 3.43Å; D136-K139 WeakPolarHBondContact OD2-CE 3.34Å; D136-K139 VanDerWaalsContact OD2-CG 3.29Å; D136-K139 WeakPolarHBondContact OD2-CG 3.33Å; D136-R140 WeakPolarHBondContact O-CB 3.32Å; D136-R140 PolarHBondContact O-N 3.48Å
137	S	93.7	Very high	96.8	Very high	56 Å²	56	59.3 Å²	59.3	39%	0.392	29%	0.29	S	S	.	.	H	α-helix	trans	-60.9	-32.8	-180	-57.8	0	0	0	0	112.8	Q135 R140 R141	Q135-S137 PolarHBondContact O-N 3.49Å; S137-R140 PolarHBondContact O-N 3.32Å; S137-R141 WeakPolarHBondContact O-CG 3.49Å; S137-R141 PolarHBondContact O-N 2.89Å
138	Q	95	Very high	96.9	Very high	101 Å²	101	56.2 Å²	56.2	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-66.9	-51.4	178.6	-170.4	-173.6	-49.6	0	0	110.7	D136 R140 R141 E142 N230	D136-Q138 VanDerWaalsContact C-N 3.25Å; D136-Q138 PolarHBondContact O-N 3.34Å; D136-Q138 WeakPolarHBondContact OD1-CB 3.45Å; D136-Q138 PolarHBondContact OD1-N 2.95Å; Q138-R140 PolarHBondContact O-N 3.14Å; Q138-R141 WeakPolarHBondContact O-CB 3.38Å; Q138-R141 PolarHBondContact O-N 3.08Å; Q138-R141 VanDerWaalsContact O-N 3.1Å; Q138-E142 PolarHBondContact NE2-OE1 3.41Å; Q138-E142 PolarHBondContact O-N 3.4Å; Q138-N230 WeakPolarHBondContact CG-ND2 3.44Å; Q138-N230 PolarHBondContact O-ND2 3.28Å
139	K	96.6	Very high	96.8	Very high	124 Å²	124	58.7 Å²	58.7	54%	0.539	29%	0.288	S	S	.	.	H	α-helix	trans	-60.7	-33.8	174.8	-71.6	176.1	-172.4	179	0	112.4	I134 D136 E142 A143	I134-K139 HydrophobicContact CG2-CB 3.83Å; D136-K139 HydrophobicContact CB-CB 4.16Å; D136-K139 HydrophobicContact CB-CD 4.13Å; D136-K139 HydrophobicContact CB-CG 4.3Å; D136-K139 PolarHBondContact O-N 2.89Å; D136-K139 WeakPolarHBondContact OD2-CD 3.43Å; D136-K139 WeakPolarHBondContact OD2-CE 3.34Å; D136-K139 VanDerWaalsContact OD2-CG 3.29Å; D136-K139 WeakPolarHBondContact OD2-CG 3.33Å; K139-E142 PolarHBondContact O-N 2.66Å; K139-A143 WeakPolarHBondContact O-CB 3.33Å; K139-A143 PolarHBondContact O-N 3.13Å
140	R	97.3	Very high	96.8	Very high	42 Å²	42	61.6 Å²	61.6	16%	0.158	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-45.7	173.9	-168.4	-178.2	-54.5	160.4	0.2	111.3	C131 I134 D136 S137 Q138 A143 V144 F221	C131-R140 HydrophobicContact CB-CG 4.19Å; C131-R140 WeakPolarHBondContact O-CD 3.37Å; C131-R140 VanDerWaalsContact O-CG 3.23Å; C131-R140 WeakPolarHBondContact O-CG 3.46Å; C131-R140 PolarHBondContact O-NE 3.05Å; I134-R140 HydrophobicContact CB-CB 4.17Å; I134-R140 HydrophobicContact CB-CG 4.47Å; I134-R140 HydrophobicContact CG2-CB 4.2Å; I134-R140 VanDerWaalsContact O-CZ 3.22Å; I134-R140 PolarHBondContact O-NE 3.43Å; I134-R140 PolarHBondContact O-NH2 3.26Å; D136-R140 WeakPolarHBondContact O-CB 3.32Å; D136-R140 PolarHBondContact O-N 3.48Å; S137-R140 PolarHBondContact O-N 3.32Å; Q138-R140 PolarHBondContact O-N 3.14Å; R140-A143 PolarHBondContact O-N 3.06Å; R140-V144 WeakPolarHBondContact O-CG2 3.49Å; R140-V144 PolarHBondContact O-N 3.4Å; R140-V144 VanDerWaalsContact O-N 3.11Å; R140-F221 HydrophobicContact CB-CE1 4.44Å; R140-F221 HydrophobicContact CB-CE2 4.45Å; R140-F221 HydrophobicContact CB-CZ 3.86Å; R140-F221 VanDerWaalsContact CD-CZ 3.48Å; R140-F221 HydrophobicContact CG-CD1 4.46Å; R140-F221 HydrophobicContact CG-CE1 3.74Å; R140-F221 HydrophobicContact CG-CE2 4.1Å; R140-F221 HydrophobicContact CG-CZ 3.54Å
141	R	97.3	Very high	96.8	Very high	24 Å²	24	59.7 Å²	59.7	9%	0.091	30%	0.295	C	S	.	.	H	α-helix	trans	-60.6	-45.7	174.7	-70.4	-169.8	-60.3	-91.7	3.9	111.4	S137 Q138 A143 V144 C145 F221 N225 F228 N230 L231	S137-R141 WeakPolarHBondContact O-CG 3.49Å; S137-R141 PolarHBondContact O-N 2.89Å; Q138-R141 WeakPolarHBondContact O-CB 3.38Å; Q138-R141 PolarHBondContact O-N 3.08Å; Q138-R141 VanDerWaalsContact O-N 3.1Å; R141-A143 VanDerWaalsContact C-N 3.31Å; R141-A143 PolarHBondContact O-N 2.85Å; R141-V144 PolarHBondContact O-N 3.09Å; R141-V144 VanDerWaalsContact O-N 3.17Å; R141-C145 WeakPolarHBondContact O-CB 3.32Å; R141-C145 PolarHBondContact O-N 2.95Å; R141-F221 HydrophobicContact CG-CE1 4.33Å; R141-F221 HydrophobicContact CG-CZ 3.73Å; R141-N225 WeakPolarHBondContact CD-OD1 3.49Å; R141-N225 HydrophobicContact CG-CB 4.09Å; R141-N225 PolarHBondContact NH1-OD1 2.74Å; R141-F228 VanDerWaalsContact CZ-CD1 3.49Å; R141-N230 CarbonylContact C-O 3.52Å; R141-N230 WeakPolarHBondContact CD-OD1 3.03Å; R141-N230 PolarHBondContact NE-OD1 3.45Å; R141-N230 VanDerWaalsContact O-O 3.12Å; R141-L231 HydrophobicContact CB-CD1 4.37Å; R141-L231 HydrophobicContact CG-CD1 4.31Å
142	E	96.8	Very high	96.9	Very high	75 Å²	75	62.2 Å²	62.2	35%	0.35	31%	0.313	S	S	.	.	H	α-helix	trans	-60.8	-38.3	177.3	-71.4	164.5	-164.2	0	0	112.6	Q138 K139 C145 R146 N230	Q138-E142 PolarHBondContact NE2-OE1 3.41Å; Q138-E142 PolarHBondContact O-N 3.4Å; K139-E142 PolarHBondContact O-N 2.66Å; E142-C145 PolarHBondContact O-N 3.23Å; E142-R146 WeakPolarHBondContact O-CG 3.48Å; E142-R146 PolarHBondContact O-N 2.85Å; E142-N230 HydrophobicContact CG-CB 4.09Å; E142-N230 PolarHBondContact N-O 3.28Å
143	A	97.5	Very high	97	Very high	4 Å²	4	65.3 Å²	65.3	3%	0.033	33%	0.333	C	S	.	.	H	α-helix	trans	-64.9	-42.7	175.2	0	0	0	0	0	112.2	C131 I134 K139 R140 R141 R146 V147	C131-A143 WeakPolarHBondContact SG-CB 3.44Å; I134-A143 HydrophobicContact CD1-CB 3.71Å; K139-A143 WeakPolarHBondContact O-CB 3.33Å; K139-A143 PolarHBondContact O-N 3.13Å; R140-A143 PolarHBondContact O-N 3.06Å; R141-A143 VanDerWaalsContact C-N 3.31Å; R141-A143 PolarHBondContact O-N 2.85Å; A143-R146 PolarHBondContact O-N 3.42Å; A143-V147 PolarHBondContact O-N 2.65Å
144	V	98.2	Very high	97	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-43.7	172.6	173.7	0	0	0	0	111.2	L128 C131 R140 R141 R146 V147 F148 F221 V222 L231	L128-V144 HydrophobicContact CD2-CB 4.41Å; L128-V144 HydrophobicContact CD2-CG1 4.14Å; L128-V144 HydrophobicContact CD2-CG2 4.08Å; C131-V144 HydrophobicContact CB-CG2 4.35Å; R140-V144 WeakPolarHBondContact O-CG2 3.49Å; R140-V144 PolarHBondContact O-N 3.4Å; R140-V144 VanDerWaalsContact O-N 3.11Å; R141-V144 PolarHBondContact O-N 3.09Å; R141-V144 VanDerWaalsContact O-N 3.17Å; V144-R146 VanDerWaalsContact C-N 3.28Å; V144-R146 PolarHBondContact O-N 3.26Å; V144-V147 WeakPolarHBondContact O-CB 3.13Å; V144-V147 PolarHBondContact O-N 3.01Å; V144-V147 VanDerWaalsContact O-N 3.1Å; V144-F148 HydrophobicContact CG1-CD1 4.46Å; V144-F148 HydrophobicContact CG1-CD2 3.92Å; V144-F148 HydrophobicContact CG1-CE1 4.07Å; V144-F148 HydrophobicContact CG1-CE2 3.49Å; V144-F148 VanDerWaalsContact CG1-CE2 3.49Å; V144-F148 HydrophobicContact CG1-CG 4.4Å; V144-F148 HydrophobicContact CG1-CZ 3.59Å; V144-F148 PolarHBondContact O-N 3.42Å; V144-F221 HydrophobicContact CG2-CD1 4.3Å; V144-F221 HydrophobicContact CG2-CE1 3.96Å; V144-V222 HydrophobicContact CG1-CG2 4.02Å; V144-L231 HydrophobicContact CB-CD1 3.99Å; V144-L231 HydrophobicContact CG1-CD1 3.72Å
145	C	97.8	Very high	97	Very high	22 Å²	22	56.5 Å²	56.5	15%	0.149	29%	0.292	C	S	.	.	H	α-helix	trans	-58.9	-39	178.7	-172.4	0	0	0	0	111.7	R141 E142 F148 S149 N230 L231	R141-C145 WeakPolarHBondContact O-CB 3.32Å; R141-C145 PolarHBondContact O-N 2.95Å; E142-C145 PolarHBondContact O-N 3.23Å; C145-F148 PolarHBondContact O-N 3.4Å; C145-S149 VanDerWaalsContact O-CB 3.27Å; C145-S149 WeakPolarHBondContact O-CB 3.43Å; C145-S149 PolarHBondContact O-N 3.29Å; C145-S149 PolarHBondContact O-OG 3.01Å; C145-N230 VanDerWaalsContact CB-O 3.29Å; C145-N230 WeakPolarHBondContact CB-O 3.43Å; C145-L231 WeakPolarHBondContact CA-O 3.5Å; C145-L231 WeakPolarHBondContact CB-O 3.34Å
146	R	97.8	Very high	97.2	Very high	179 Å²	179	49.6 Å²	49.6	68%	0.675	26%	0.26	S	S	*	.	H	α-helix	trans	-60.7	-44.2	174.6	-76.9	-176.3	-71.6	169.6	-1.2	112.3	E142 A143 V144 S149 S150	E142-R146 WeakPolarHBondContact O-CG 3.48Å; E142-R146 PolarHBondContact O-N 2.85Å; A143-R146 PolarHBondContact O-N 3.42Å; V144-R146 VanDerWaalsContact C-N 3.28Å; V144-R146 PolarHBondContact O-N 3.26Å; R146-S149 PolarHBondContact O-N 3.38Å; R146-S150 PolarHBondContact O-N 2.89Å; R146-S150 VanDerWaalsContact O-N 3.13Å
147	V	98.2	Very high	97.3	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-45.2	176.7	175.2	0	0	0	0	111	N124 V127 L128 A143 V144 S149 S150	N124-V147 HydrophobicContact CB-CG1 3.72Å; V127-V147 HydrophobicContact CB-CG2 4.03Å; V127-V147 HydrophobicContact CG1-CG2 3.54Å; L128-V147 HydrophobicContact CD1-CG1 3.99Å; L128-V147 HydrophobicContact CD2-CB 4.1Å; L128-V147 HydrophobicContact CD2-CG1 4.08Å; L128-V147 HydrophobicContact CD2-CG2 4.23Å; L128-V147 HydrophobicContact CG-CB 4.36Å; L128-V147 HydrophobicContact CG-CG1 3.92Å; L128-V147 HydrophobicContact CG-CG2 4.3Å; A143-V147 PolarHBondContact O-N 2.65Å; V144-V147 WeakPolarHBondContact O-CB 3.13Å; V144-V147 PolarHBondContact O-N 3.01Å; V144-V147 VanDerWaalsContact O-N 3.1Å; V147-S149 VanDerWaalsContact C-N 3.33Å; V147-S149 PolarHBondContact O-N 3.39Å; V147-S150 PolarHBondContact O-N 3.13Å; V147-S150 PolarHBondContact O-OG 3Å
148	F	98	Very high	97.5	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.009	23%	0.229	C	C	.	.	H	α-helix	trans	-64.6	-40.7	178	-67.9	-10.8	0	0	0	111.6	F120 L128 V144 C145 S150 L151 Q156 L159 F163 V222 F232	F120-F148 HydrophobicContact CE1-CD1 4.03Å; F120-F148 AromaticContact CE1-CE1 3.58Å; F120-F148 HydrophobicContact CE1-CE1 3.58Å; F120-F148 HydrophobicContact CZ-CE1 4.07Å; L128-F148 HydrophobicContact CD2-CE1 4.44Å; V144-F148 HydrophobicContact CG1-CD1 4.46Å; V144-F148 HydrophobicContact CG1-CD2 3.92Å; V144-F148 HydrophobicContact CG1-CE1 4.07Å; V144-F148 HydrophobicContact CG1-CE2 3.49Å; V144-F148 VanDerWaalsContact CG1-CE2 3.49Å; V144-F148 HydrophobicContact CG1-CG 4.4Å; V144-F148 HydrophobicContact CG1-CZ 3.59Å; V144-F148 PolarHBondContact O-N 3.42Å; C145-F148 PolarHBondContact O-N 3.4Å; F148-S150 PolarHBondContact O-N 3.39Å; F148-L151 PolarHBondContact O-N 3.46Å; F148-Q156 WeakPolarHBondContact O-CG 3.47Å; F148-L159 HydrophobicContact CD1-CD1 4.15Å; F148-L159 HydrophobicContact CE1-CD1 4.36Å; F148-F163 HydrophobicContact CZ-CD2 4.49Å; F148-F163 AromaticContact CZ-CE2 3.98Å; F148-F163 HydrophobicContact CZ-CE2 3.98Å; F148-V222 HydrophobicContact CE2-CG1 3.96Å; F148-V222 HydrophobicContact CZ-CG1 4.09Å; F148-V222 HydrophobicContact CZ-CG2 4.17Å; F148-F232 AromaticContact CD2-CD1 3.76Å; F148-F232 HydrophobicContact CD2-CD1 3.76Å; F148-F232 HydrophobicContact CD2-CD2 4.31Å; F148-F232 AromaticContact CD2-CE1 3.33Å; F148-F232 HydrophobicContact CD2-CE1 3.33Å; F148-F232 AromaticContact CD2-CE2 3.94Å; F148-F232 HydrophobicContact CD2-CE2 3.94Å; F148-F232 HydrophobicContact CD2-CG 4.23Å; F148-F232 AromaticContact CD2-CZ 3.44Å; F148-F232 HydrophobicContact CD2-CZ 3.44Å; F148-F232 VanDerWaalsContact CD2-CZ 3.44Å; F148-F232 HydrophobicContact CE2-CD1 4.39Å; F148-F232 HydrophobicContact CE2-CD2 4.38Å; F148-F232 AromaticContact CE2-CE1 3.66Å; F148-F232 HydrophobicContact CE2-CE1 3.66Å; F148-F232 AromaticContact CE2-CE2 3.64Å; F148-F232 HydrophobicContact CE2-CE2 3.64Å; F148-F232 AromaticContact CE2-CZ 3.22Å; F148-F232 HydrophobicContact CE2-CZ 3.22Å; F148-F232 HydrophobicContact CG-CE1 4.14Å; F148-F232 HydrophobicContact CZ-CZ 4.2Å
149	S	97.5	Very high	97.7	Very high	54 Å²	54	40 Å²	40	38%	0.378	21%	0.206	S	C	.	.	H	α-helix	trans	-67.2	-21.9	179.9	-54.4	0	0	0	0	113.4	C145 R146 V147 L151 Q156 P233	C145-S149 VanDerWaalsContact O-CB 3.27Å; C145-S149 WeakPolarHBondContact O-CB 3.43Å; C145-S149 PolarHBondContact O-N 3.29Å; C145-S149 PolarHBondContact O-OG 3.01Å; R146-S149 PolarHBondContact O-N 3.38Å; V147-S149 VanDerWaalsContact C-N 3.33Å; V147-S149 PolarHBondContact O-N 3.39Å; S149-L151 VanDerWaalsContact C-N 3.33Å; S149-Q156 PolarHBondContact O-NE2 3.45Å; S149-P233 WeakPolarHBondContact OG-CG 3.43Å
150	S	97.2	Very high	97.7	Very high	79 Å²	79	34 Å²	34	55%	0.552	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.3	176.3	63.5	0	0	0	0	114.3	R146 V147 F148	R146-S150 PolarHBondContact O-N 2.89Å; R146-S150 VanDerWaalsContact O-N 3.13Å; V147-S150 PolarHBondContact O-N 3.13Å; V147-S150 PolarHBondContact O-OG 3Å; F148-S150 PolarHBondContact O-N 3.39Å
151	L	97.5	Very high	97.8	Very high	22 Å²	22	32 Å²	32	12%	0.115	17%	0.173	C	C	.	.	S	Bend	trans	-81.4	163	177.8	-55.9	174.5	0	0	0	111.2	F120 F148 S149 C155 Q156 L159	F120-L151 HydrophobicContact CD1-CD1 3.99Å; F120-L151 HydrophobicContact CE1-CD1 4.2Å; F148-L151 PolarHBondContact O-N 3.46Å; S149-L151 VanDerWaalsContact C-N 3.33Å; L151-C155 HydrophobicContact CB-CB 4Å; L151-C155 HydrophobicContact CD1-CB 4.47Å; L151-Q156 HydrophobicContact CB-CG 4.22Å; L151-Q156 PolarHBondContact O-NE2 3.49Å; L151-L159 HydrophobicContact CD1-CD1 3.36Å
152	S	97	Very high	97.8	Very high	57 Å²	57	31 Å²	31	40%	0.399	17%	0.169	S	C	.	.			trans	-62.8	148.2	172.4	69.2	0	0	0	0	111.5	P154 C155 Q156	S152-P154 VanDerWaalsContact C-N 3.33Å; S152-C155 WeakPolarHBondContact O-CA 3.05Å; S152-C155 WeakPolarHBondContact O-CB 3.4Å; S152-C155 PolarHBondContact O-N 3.35Å; S152-C155 PolarHBondContact OG-SG 3.3Å; S152-Q156 WeakPolarHBondContact O-CG 3.38Å; S152-Q156 PolarHBondContact O-N 2.83Å
153	V	97.5	Very high	97.9	Very high	83 Å²	83	27.4 Å²	27.4	50%	0.503	15%	0.153	S	C	.	.	H	α-helix	trans	-50.7	-44	-178.5	176.1	0	0	0	0	113	C155 Q156 H157	V153-C155 VanDerWaalsContact C-N 3.33Å; V153-C155 PolarHBondContact O-N 3.31Å; V153-Q156 WeakPolarHBondContact O-CB 3.49Å; V153-Q156 PolarHBondContact O-N 3.35Å; V153-Q156 VanDerWaalsContact O-N 3.14Å; V153-H157 VanDerWaalsContact CG1-CE1 3.45Å; V153-H157 WeakPolarHBondContact CG1-CE1 3.4Å; V153-H157 PolarHBondContact O-N 3.33Å
154	P	97.4	Very high	97.9	Very high	17 Å²	17	27.2 Å²	27.2	11%	0.11	15%	0.151	C	C	.	.	H	α-helix	trans	-61.8	-35.6	175.3	-26.7	37.3	0	0	0	114.2	F46 I50 S152 L158	F46-P154 HydrophobicContact CB-CB 3.63Å; F46-P154 HydrophobicContact CB-CG 4.24Å; F46-P154 HydrophobicContact CG-CB 4.18Å; I50-P154 HydrophobicContact CG1-CB 4.46Å; S152-P154 VanDerWaalsContact C-N 3.33Å; P154-L158 WeakPolarHBondContact O-CB 3.44Å; P154-L158 PolarHBondContact O-N 3Å
155	C	98	Very high	97.9	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.02	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-41.5	174.1	-65.8	0	0	0	0	110.9	F46 L151 S152 V153 L158 L159	F46-C155 WeakPolarHBondContact CD2-SG 3.49Å; L151-C155 HydrophobicContact CB-CB 4Å; L151-C155 HydrophobicContact CD1-CB 4.47Å; S152-C155 WeakPolarHBondContact O-CA 3.05Å; S152-C155 WeakPolarHBondContact O-CB 3.4Å; S152-C155 PolarHBondContact O-N 3.35Å; S152-C155 PolarHBondContact OG-SG 3.3Å; V153-C155 VanDerWaalsContact C-N 3.33Å; V153-C155 PolarHBondContact O-N 3.31Å; C155-L158 PolarHBondContact O-N 3.44Å; C155-L159 WeakPolarHBondContact O-CB 3.46Å; C155-L159 VanDerWaalsContact O-CG 3.24Å; C155-L159 WeakPolarHBondContact O-CG 3.48Å; C155-L159 PolarHBondContact O-N 3.39Å
156	Q	98.2	Very high	97.9	Very high	20 Å²	20	26.4 Å²	26.4	9%	0.093	15%	0.145	C	C	.	.	H	α-helix	trans	-60.4	-47.1	175.5	-61.2	-174.1	38	0	0	111.5	F148 S149 L151 S152 V153 L158 L159 V160 N236	F148-Q156 WeakPolarHBondContact O-CG 3.47Å; S149-Q156 PolarHBondContact O-NE2 3.45Å; L151-Q156 HydrophobicContact CB-CG 4.22Å; L151-Q156 PolarHBondContact O-NE2 3.49Å; S152-Q156 WeakPolarHBondContact O-CG 3.38Å; S152-Q156 PolarHBondContact O-N 2.83Å; V153-Q156 WeakPolarHBondContact O-CB 3.49Å; V153-Q156 PolarHBondContact O-N 3.35Å; V153-Q156 VanDerWaalsContact O-N 3.14Å; Q156-L158 VanDerWaalsContact C-N 3.34Å; Q156-L158 PolarHBondContact O-N 3.23Å; Q156-L159 PolarHBondContact O-N 3.48Å; Q156-V160 PolarHBondContact O-N 3.44Å; Q156-N236 PolarHBondContact OE1-ND2 3.35Å
157	H	98.1	Very high	97.9	Very high	25 Å²	25	21.4 Å²	21.4	12%	0.116	13%	0.126	C	C	.	.	H	α-helix	trans	-58.8	-42	174.9	-74.1	175.1	0	0	0	112.6	I50 V153 V160 L161 F239	I50-H157 HydrophobicContact CD1-CB 3.87Å; V153-H157 VanDerWaalsContact CG1-CE1 3.45Å; V153-H157 WeakPolarHBondContact CG1-CE1 3.4Å; V153-H157 PolarHBondContact O-N 3.33Å; H157-V160 VanDerWaalsContact O-CG1 3.31Å; H157-V160 WeakPolarHBondContact O-CG1 3.37Å; H157-L161 WeakPolarHBondContact O-CB 3.24Å; H157-L161 WeakPolarHBondContact O-CG 3.29Å; H157-L161 PolarHBondContact O-N 2.66Å; H157-L161 VanDerWaalsContact O-N 3.07Å; H157-F239 HydrophobicContact CB-CD1 3.87Å; H157-F239 HydrophobicContact CB-CE1 3.47Å; H157-F239 VanDerWaalsContact CB-CE1 3.47Å; H157-F239 HydrophobicContact CB-CE2 4.37Å; H157-F239 HydrophobicContact CB-CG 4.47Å; H157-F239 HydrophobicContact CB-CZ 3.76Å; H157-F239 AromaticContact CD2-CD1 3.63Å; H157-F239 AromaticContact CD2-CD2 3.86Å; H157-F239 AromaticContact CD2-CG 3.5Å; H157-F239 VanDerWaalsContact CD2-CG 3.5Å; H157-F239 WeakPolarHBondContact CD2-CG 3.24Å; H157-F239 AromaticContact CE1-CD2 3.52Å; H157-F239 AromaticContact CE1-CE2 3.79Å; H157-F239 AromaticContact CE1-CG 3.96Å; H157-F239 AromaticContact CG-CD1 3.68Å; H157-F239 AromaticContact CG-CD2 3.87Å; H157-F239 AromaticContact CG-CE1 3.65Å; H157-F239 AromaticContact CG-CE2 3.86Å; H157-F239 AromaticContact CG-CG 3.8Å; H157-F239 AromaticContact CG-CZ 3.75Å; H157-F239 AromaticContact ND1-CD2 3.67Å; H157-F239 AromaticContact ND1-CE2 3.51Å; H157-F239 AromaticContact ND1-CZ 3.77Å; H157-F239 AromaticContact NE2-CD2 3.63Å; H157-F239 AromaticContact NE2-CG 3.61Å
158	L	98.3	Very high	97.8	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-64.1	-45.5	176.4	175.3	59.7	0	0	0	111.2	F46 I50 L58 L112 I119 P154 C155 Q156 L161 L162	F46-L158 HydrophobicContact CE1-CD2 3.97Å; F46-L158 HydrophobicContact CE2-CD2 4.15Å; F46-L158 HydrophobicContact CZ-CD2 3.36Å; I50-L158 HydrophobicContact CD1-CB 3.92Å; I50-L158 HydrophobicContact CG1-CB 4.42Å; L58-L158 HydrophobicContact CD1-CD1 3.37Å; L58-L158 HydrophobicContact CD2-CD1 4.02Å; L58-L158 HydrophobicContact CG-CD1 4.34Å; L112-L158 HydrophobicContact CD2-CD2 3.98Å; I119-L158 HydrophobicContact CD1-CD2 3.73Å; I119-L158 HydrophobicContact CD1-CG 4.3Å; P154-L158 WeakPolarHBondContact O-CB 3.44Å; P154-L158 PolarHBondContact O-N 3Å; C155-L158 PolarHBondContact O-N 3.44Å; Q156-L158 VanDerWaalsContact C-N 3.34Å; Q156-L158 PolarHBondContact O-N 3.23Å; L158-L161 WeakPolarHBondContact O-CB 3.32Å; L158-L161 PolarHBondContact O-N 3.15Å; L158-L162 HydrophobicContact CD1-CD1 4.01Å; L158-L162 HydrophobicContact CD1-CG 4.25Å; L158-L162 HydrophobicContact CG-CD1 3.98Å; L158-L162 VanDerWaalsContact O-CG 3.31Å; L158-L162 WeakPolarHBondContact O-CG 3.26Å; L158-L162 PolarHBondContact O-N 3.23Å
159	L	98.5	Very high	97.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.5	-44.7	-179.8	-70.5	169.9	0	0	0	111.7	I119 F120 F148 L151 C155 Q156 L161 L162 F163 L193 F232	I119-L159 HydrophobicContact CD1-CD2 3.84Å; I119-L159 HydrophobicContact CD1-CG 4Å; I119-L159 HydrophobicContact CG2-CD2 4.49Å; F120-L159 HydrophobicContact CD1-CD1 4.46Å; F120-L159 HydrophobicContact CE1-CD1 3.61Å; F120-L159 HydrophobicContact CE1-CD2 3.91Å; F120-L159 HydrophobicContact CE1-CG 4.44Å; F120-L159 HydrophobicContact CZ-CD1 4.27Å; F120-L159 HydrophobicContact CZ-CD2 3.69Å; F148-L159 HydrophobicContact CD1-CD1 4.15Å; F148-L159 HydrophobicContact CE1-CD1 4.36Å; L151-L159 HydrophobicContact CD1-CD1 3.36Å; C155-L159 WeakPolarHBondContact O-CB 3.46Å; C155-L159 VanDerWaalsContact O-CG 3.24Å; C155-L159 WeakPolarHBondContact O-CG 3.48Å; C155-L159 PolarHBondContact O-N 3.39Å; Q156-L159 PolarHBondContact O-N 3.48Å; L159-L161 VanDerWaalsContact C-N 3.31Å; L159-L161 PolarHBondContact O-N 2.91Å; L159-L162 PolarHBondContact O-N 2.86Å; L159-F163 HydrophobicContact CB-CD2 4.38Å; L159-F163 HydrophobicContact CD2-CE2 4.07Å; L159-F163 WeakPolarHBondContact O-CB 3.09Å; L159-F163 VanDerWaalsContact O-CD2 3.29Å; L159-F163 WeakPolarHBondContact O-CD2 3.4Å; L159-F163 PolarHBondContact O-N 3.2Å; L159-L193 HydrophobicContact CD2-CD2 4.43Å; L159-F232 HydrophobicContact CB-CE1 4.19Å
160	V	97.9	Very high	97.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.4	-35.8	177.9	74.5	0	0	0	0	111.4	Q156 H157 G164 F226 F232 N236 Y237 F239 Y240	Q156-V160 PolarHBondContact O-N 3.44Å; H157-V160 VanDerWaalsContact O-CG1 3.31Å; H157-V160 WeakPolarHBondContact O-CG1 3.37Å; V160-G164 WeakPolarHBondContact O-CA 3.31Å; V160-G164 PolarHBondContact O-N 3.34Å; V160-F226 HydrophobicContact CG2-CE2 3.84Å; V160-F226 HydrophobicContact CG2-CZ 3.93Å; V160-F232 HydrophobicContact CB-CD1 4.01Å; V160-F232 HydrophobicContact CB-CE1 3.93Å; V160-F232 HydrophobicContact CB-CZ 4.46Å; V160-F232 HydrophobicContact CG2-CD1 4.16Å; V160-F232 HydrophobicContact CG2-CE1 4.38Å; V160-F232 HydrophobicContact CG2-CG 4.28Å; V160-N236 HydrophobicContact CB-CB 4.18Å; V160-N236 HydrophobicContact CG1-CB 4.16Å; V160-N236 WeakPolarHBondContact CG1-O 3.41Å; V160-N236 HydrophobicContact CG2-CB 4.21Å; V160-Y237 HydrophobicContact CG2-CD1 4.15Å; V160-Y237 HydrophobicContact CG2-CE1 4.41Å; V160-F239 HydrophobicContact CG1-CD1 4.06Å; V160-Y240 HydrophobicContact CG2-CD2 4.49Å; V160-Y240 HydrophobicContact CG2-CG 4.47Å; V160-Y240 VanDerWaalsContact O-CD2 3.27Å; V160-Y240 WeakPolarHBondContact O-CD2 3.37Å
161	L	98.2	Very high	97.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.4	-46.3	171.3	-83.8	171.8	0	0	0	112.6	I50 L55 L58 L59 H157 L158 L159 T165 F239 Y240 I243 T244	I50-L161 HydrophobicContact CD1-CD1 4.13Å; L55-L161 HydrophobicContact CD1-CD1 3.55Å; L58-L161 HydrophobicContact CD1-CD1 4.36Å; L59-L161 HydrophobicContact CD2-CD2 4.21Å; H157-L161 WeakPolarHBondContact O-CB 3.24Å; H157-L161 WeakPolarHBondContact O-CG 3.29Å; H157-L161 PolarHBondContact O-N 2.66Å; H157-L161 VanDerWaalsContact O-N 3.07Å; L158-L161 WeakPolarHBondContact O-CB 3.32Å; L158-L161 PolarHBondContact O-N 3.15Å; L159-L161 VanDerWaalsContact C-N 3.31Å; L159-L161 PolarHBondContact O-N 2.91Å; L161-T165 VanDerWaalsContact O-CB 3.24Å; L161-T165 WeakPolarHBondContact O-CB 3.48Å; L161-T165 PolarHBondContact O-N 2.9Å; L161-T165 PolarHBondContact O-OG1 2.97Å; L161-F239 HydrophobicContact CD1-CE1 3.83Å; L161-F239 HydrophobicContact CD1-CZ 4.33Å; L161-F239 HydrophobicContact CG-CE1 3.97Å; L161-Y240 HydrophobicContact CD2-CD2 4.18Å; L161-Y240 HydrophobicContact CD2-CE2 4.46Å; L161-I243 HydrophobicContact CD2-CG2 3.53Å; L161-I243 HydrophobicContact CG-CG2 4.32Å; L161-T244 HydrophobicContact CD2-CG2 3.94Å
162	L	98.6	Very high	97.5	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-65.1	-57	178.9	-74.4	167.2	0	0	0	111.3	L58 W72 I108 L112 L158 L159 G164 T165 F166 L193	L58-L162 HydrophobicContact CD2-CD2 3.58Å; L58-L162 HydrophobicContact CD2-CG 4.02Å; W72-L162 HydrophobicContact CH2-CD2 3.92Å; W72-L162 HydrophobicContact CZ2-CD2 4.43Å; I108-L162 HydrophobicContact CG2-CD2 3.93Å; L112-L162 HydrophobicContact CD1-CD1 3.81Å; L112-L162 HydrophobicContact CD2-CD1 4.31Å; L158-L162 HydrophobicContact CD1-CD1 4.01Å; L158-L162 HydrophobicContact CD1-CG 4.25Å; L158-L162 HydrophobicContact CG-CD1 3.98Å; L158-L162 VanDerWaalsContact O-CG 3.31Å; L158-L162 WeakPolarHBondContact O-CG 3.26Å; L158-L162 PolarHBondContact O-N 3.23Å; L159-L162 PolarHBondContact O-N 2.86Å; L162-G164 VanDerWaalsContact C-N 3.35Å; L162-G164 PolarHBondContact O-N 3.47Å; L162-T165 WeakPolarHBondContact O-CA 3.39Å; L162-T165 WeakPolarHBondContact O-CB 3.34Å; L162-T165 PolarHBondContact O-N 3.25Å; L162-T165 VanDerWaalsContact O-N 3.09Å; L162-F166 HydrophobicContact CB-CE2 4.06Å; L162-F166 HydrophobicContact CB-CZ 4.13Å; L162-F166 HydrophobicContact CD2-CZ 4.13Å; L162-F166 WeakPolarHBondContact O-CD1 3.48Å; L162-F166 WeakPolarHBondContact O-CD2 3.48Å; L162-F166 WeakPolarHBondContact O-CG 3.21Å; L162-F166 PolarHBondContact O-N 2.91Å; L162-L193 HydrophobicContact CD1-CD2 4.41Å
163	F	98.5	Very high	97.3	Very high	1 Å²	1	19 Å²	19	0%	0.004	10%	0.102	C	C	.	.	H	α-helix	trans	-65.6	-36.6	-177	-77.4	-70.3	0	0	0	112.7	F148 L159 T165 F166 R167 L193 V219 V222 V223 F226 F232	F148-F163 HydrophobicContact CZ-CD2 4.49Å; F148-F163 AromaticContact CZ-CE2 3.98Å; F148-F163 HydrophobicContact CZ-CE2 3.98Å; L159-F163 HydrophobicContact CB-CD2 4.38Å; L159-F163 HydrophobicContact CD2-CE2 4.07Å; L159-F163 WeakPolarHBondContact O-CB 3.09Å; L159-F163 VanDerWaalsContact O-CD2 3.29Å; L159-F163 WeakPolarHBondContact O-CD2 3.4Å; L159-F163 PolarHBondContact O-N 3.2Å; F163-T165 VanDerWaalsContact C-N 3.34Å; F163-F166 AromaticContact CD1-CD2 3.88Å; F163-F166 HydrophobicContact CD1-CD2 3.88Å; F163-F166 HydrophobicContact CD1-CE2 4.39Å; F163-F166 HydrophobicContact CE1-CD2 4.34Å; F163-F166 HydrophobicContact CG-CD2 4.41Å; F163-F166 PolarHBondContact O-N 3.41Å; F163-R167 WeakPolarHBondContact O-CB 3.27Å; F163-R167 PolarHBondContact O-N 3.12Å; F163-L193 HydrophobicContact CZ-CD1 4.29Å; F163-V219 HydrophobicContact CE1-CG1 4.02Å; F163-V222 HydrophobicContact CB-CG1 4.2Å; F163-V222 HydrophobicContact CD1-CB 3.83Å; F163-V222 HydrophobicContact CD1-CG1 3.36Å; F163-V222 HydrophobicContact CD2-CG1 3.85Å; F163-V222 HydrophobicContact CE1-CB 3.59Å; F163-V222 HydrophobicContact CE1-CG1 3.51Å; F163-V222 HydrophobicContact CE1-CG2 4.42Å; F163-V222 HydrophobicContact CE2-CG1 3.98Å; F163-V222 HydrophobicContact CG-CB 4.49Å; F163-V222 HydrophobicContact CG-CG1 3.54Å; F163-V222 HydrophobicContact CZ-CB 4.06Å; F163-V222 HydrophobicContact CZ-CG1 3.83Å; F163-V222 HydrophobicContact CZ-CG2 4.46Å; F163-V223 HydrophobicContact CD1-CG2 3.93Å; F163-V223 HydrophobicContact CE1-CG2 4.38Å; F163-F226 HydrophobicContact CB-CD2 3.88Å; F163-F226 HydrophobicContact CB-CE2 4.11Å; F163-F232 HydrophobicContact CB-CE2 4.36Å; F163-F232 HydrophobicContact CB-CZ 4.26Å; F163-F232 AromaticContact CD2-CZ 3.94Å; F163-F232 HydrophobicContact CD2-CZ 3.94Å; F163-F232 HydrophobicContact CG-CZ 4.42Å
164	G	97.5	Very high	97	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.5	-37	172.3	0	0	0	0	0	112.2	V160 L162 R167 L168 F226 Y240	V160-G164 WeakPolarHBondContact O-CA 3.31Å; V160-G164 PolarHBondContact O-N 3.34Å; L162-G164 VanDerWaalsContact C-N 3.35Å; L162-G164 PolarHBondContact O-N 3.47Å; G164-R167 PolarHBondContact O-N 3.26Å; G164-L168 WeakPolarHBondContact O-CG 3.5Å; G164-L168 PolarHBondContact O-N 2.92Å; G164-L168 VanDerWaalsContact O-N 3.08Å; G164-F226 VanDerWaalsContact CA-CE1 3.49Å; G164-F226 VanDerWaalsContact CA-CE2 3.48Å; G164-F226 VanDerWaalsContact N-CE2 3.27Å; G164-Y240 PolarHBondContact O-OH 3.19Å; G164-Y240 VanDerWaalsContact O-OH 3.13Å
165	T	97.8	Very high	96.8	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.018	15%	0.151	C	C	.	.	H	α-helix	trans	-64.9	-41.9	172.7	-61.1	0	0	0	0	111.9	V61 N62 L161 L162 F163 L168 I169	V61-T165 HydrophobicContact CG1-CG2 4.14Å; N62-T165 HydrophobicContact CB-CG2 4.27Å; N62-T165 WeakPolarHBondContact CB-OG1 3.42Å; N62-T165 PolarHBondContact ND2-OG1 3.19Å; L161-T165 VanDerWaalsContact O-CB 3.24Å; L161-T165 WeakPolarHBondContact O-CB 3.48Å; L161-T165 PolarHBondContact O-N 2.9Å; L161-T165 PolarHBondContact O-OG1 2.97Å; L162-T165 WeakPolarHBondContact O-CA 3.39Å; L162-T165 WeakPolarHBondContact O-CB 3.34Å; L162-T165 PolarHBondContact O-N 3.25Å; L162-T165 VanDerWaalsContact O-N 3.09Å; F163-T165 VanDerWaalsContact C-N 3.34Å; T165-L168 PolarHBondContact O-N 3.15Å; T165-I169 HydrophobicContact CG2-CD1 3.89Å; T165-I169 WeakPolarHBondContact O-CD1 3.27Å; T165-I169 VanDerWaalsContact O-CG1 3.32Å; T165-I169 WeakPolarHBondContact O-CG1 3.45Å; T165-I169 PolarHBondContact O-N 3.19Å
166	F	98.4	Very high	96.5	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.009	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-45.6	175.8	-61.4	-25.4	0	0	0	111.5	W72 L162 F163 L168 I169 T170 I185 V189 V223	W72-F166 AromaticContact CD2-CE1 3.76Å; W72-F166 HydrophobicContact CD2-CE1 3.76Å; W72-F166 AromaticContact CE2-CE1 3.47Å; W72-F166 VanDerWaalsContact CE2-CE1 3.47Å; W72-F166 HydrophobicContact CE3-CE1 4.23Å; W72-F166 HydrophobicContact CG-CE1 4.17Å; W72-F166 HydrophobicContact CH2-CE1 4.18Å; W72-F166 AromaticContact CZ2-CE1 3.69Å; W72-F166 HydrophobicContact CZ2-CE1 3.69Å; W72-F166 HydrophobicContact CZ3-CE1 4.43Å; W72-F166 AromaticContact NE1-CD1 3.85Å; W72-F166 AromaticContact NE1-CE1 3.69Å; L162-F166 HydrophobicContact CB-CE2 4.06Å; L162-F166 HydrophobicContact CB-CZ 4.13Å; L162-F166 HydrophobicContact CD2-CZ 4.13Å; L162-F166 WeakPolarHBondContact O-CD1 3.48Å; L162-F166 WeakPolarHBondContact O-CD2 3.48Å; L162-F166 WeakPolarHBondContact O-CG 3.21Å; L162-F166 PolarHBondContact O-N 2.91Å; F163-F166 AromaticContact CD1-CD2 3.88Å; F163-F166 HydrophobicContact CD1-CD2 3.88Å; F163-F166 HydrophobicContact CD1-CE2 4.39Å; F163-F166 HydrophobicContact CE1-CD2 4.34Å; F163-F166 HydrophobicContact CG-CD2 4.41Å; F163-F166 PolarHBondContact O-N 3.41Å; F166-L168 VanDerWaalsContact C-N 3.32Å; F166-L168 PolarHBondContact O-N 3.41Å; F166-I169 PolarHBondContact O-N 2.91Å; F166-I169 VanDerWaalsContact O-N 3.14Å; F166-T170 WeakPolarHBondContact O-CG2 3.44Å; F166-T170 PolarHBondContact O-N 2.86Å; F166-T170 PolarHBondContact O-OG1 3.37Å; F166-I185 HydrophobicContact CB-CG2 3.98Å; F166-I185 HydrophobicContact CD1-CD1 4.49Å; F166-I185 HydrophobicContact CD1-CG2 4.04Å; F166-I185 HydrophobicContact CD2-CG2 4.07Å; F166-I185 HydrophobicContact CG-CG2 3.76Å; F166-V189 HydrophobicContact CE1-CG1 4.16Å; F166-V189 HydrophobicContact CE2-CG2 3.98Å; F166-V189 HydrophobicContact CZ-CB 4.26Å; F166-V189 HydrophobicContact CZ-CG1 4.01Å; F166-V189 HydrophobicContact CZ-CG2 4.03Å; F166-V223 HydrophobicContact CB-CG1 4.43Å; F166-V223 HydrophobicContact CB-CG2 3.66Å; F166-V223 HydrophobicContact CD2-CG2 4.13Å; F166-V223 HydrophobicContact CG-CG2 4.36Å
167	R	97.3	Very high	96.2	Very high	74 Å²	74	31 Å²	31	28%	0.279	18%	0.179	S	C	.	.	H	α-helix	trans	-57.2	-44.7	175.6	179.6	56	170.1	147.7	12.1	111.9	F163 G164 I169 T170 D171 V223 F226	F163-R167 WeakPolarHBondContact O-CB 3.27Å; F163-R167 PolarHBondContact O-N 3.12Å; G164-R167 PolarHBondContact O-N 3.26Å; R167-I169 VanDerWaalsContact C-N 3.32Å; R167-I169 PolarHBondContact O-N 3.03Å; R167-T170 PolarHBondContact O-N 3.43Å; R167-T170 PolarHBondContact O-OG1 2.84Å; R167-D171 IonicContact CZ-OD1 2.82Å; R167-D171 IonicContact CZ-OD2 2.85Å; R167-D171 IonicContact NE-OD1 2.72Å; R167-D171 IonicContact NE-OD2 3.54Å; R167-D171 PolarHBondContact NE-OD2 3.47Å; R167-D171 IonicContact NH1-OD1 3.53Å; R167-D171 PolarHBondContact NH1-OD1 3.24Å; R167-D171 IonicContact NH1-OD2 2.67Å; R167-D171 IonicContact NH2-OD1 3.04Å; R167-D171 PolarHBondContact NH2-OD1 3.04Å; R167-D171 IonicContact NH2-OD2 3.62Å; R167-D171 WeakPolarHBondContact O-CB 3.45Å; R167-D171 PolarHBondContact O-N 3.39Å; R167-V223 WeakPolarHBondContact CD-O 3.49Å; R167-F226 HydrophobicContact CB-CB 3.92Å; R167-F226 HydrophobicContact CB-CD1 3.99Å; R167-F226 HydrophobicContact CB-CG 4.07Å; R167-F226 HydrophobicContact CG-CB 4Å; R167-F226 HydrophobicContact CG-CD1 4.03Å; R167-F226 HydrophobicContact CG-CG 4.35Å
168	L	95.9	Very high	95.9	Very high	49 Å²	49	29.9 Å²	29.9	26%	0.257	18%	0.175	S	C	.	.	H	α-helix	trans	-65.3	-34.3	177.3	-70.9	178.9	0	0	0	113.6	P66 G164 T165 F166 A172 Y240 R246	P66-L168 HydrophobicContact CG-CB 4.2Å; G164-L168 WeakPolarHBondContact O-CG 3.5Å; G164-L168 PolarHBondContact O-N 2.92Å; G164-L168 VanDerWaalsContact O-N 3.08Å; T165-L168 PolarHBondContact O-N 3.15Å; F166-L168 VanDerWaalsContact C-N 3.32Å; F166-L168 PolarHBondContact O-N 3.41Å; L168-A172 WeakPolarHBondContact O-CB 3.39Å; L168-A172 PolarHBondContact O-N 3.38Å; L168-Y240 WeakPolarHBondContact CD1-OH 3.38Å; L168-R246 VanDerWaalsContact CD1-CD 3.48Å; L168-R246 VanDerWaalsContact CD1-CZ 3.49Å
169	I	97.2	Very high	95.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.7	-41.6	175.3	-70.7	162.6	0	0	0	110.4	P66 I71 T165 F166 R167 A172 A173 M180 I185	P66-I169 HydrophobicContact CG-CG1 4.18Å; I71-I169 HydrophobicContact CG1-CD1 4.49Å; I71-I169 HydrophobicContact CG2-CD1 3.81Å; I71-I169 HydrophobicContact CG2-CG1 4.17Å; I71-I169 HydrophobicContact CG2-CG2 3.7Å; T165-I169 HydrophobicContact CG2-CD1 3.89Å; T165-I169 WeakPolarHBondContact O-CD1 3.27Å; T165-I169 VanDerWaalsContact O-CG1 3.32Å; T165-I169 WeakPolarHBondContact O-CG1 3.45Å; T165-I169 PolarHBondContact O-N 3.19Å; F166-I169 PolarHBondContact O-N 2.91Å; F166-I169 VanDerWaalsContact O-N 3.14Å; R167-I169 VanDerWaalsContact C-N 3.32Å; R167-I169 PolarHBondContact O-N 3.03Å; I169-A172 PolarHBondContact O-N 2.91Å; I169-A173 PolarHBondContact O-N 2.86Å; I169-M180 HydrophobicContact CG2-CB 3.6Å; I169-M180 HydrophobicContact CG2-CG 4.07Å; I169-I185 HydrophobicContact CG2-CD1 4.15Å
170	T	96.9	Very high	95.4	Very high	14 Å²	14	39.8 Å²	39.8	9%	0.086	21%	0.212	C	C	.	.	H	α-helix	trans	-71	-38.4	179.7	59.7	0	0	0	0	112.1	F166 R167 A172 A173 M180 P182 I185 V223	F166-T170 WeakPolarHBondContact O-CG2 3.44Å; F166-T170 PolarHBondContact O-N 2.86Å; F166-T170 PolarHBondContact O-OG1 3.37Å; R167-T170 PolarHBondContact O-N 3.43Å; R167-T170 PolarHBondContact O-OG1 2.84Å; T170-A172 VanDerWaalsContact C-N 3.29Å; T170-A172 PolarHBondContact O-N 3.04Å; T170-A173 VanDerWaalsContact O-CB 3.22Å; T170-A173 WeakPolarHBondContact O-CB 3.43Å; T170-A173 PolarHBondContact O-N 2.87Å; T170-A173 VanDerWaalsContact O-N 3.15Å; T170-M180 WeakPolarHBondContact CA-O 3.22Å; T170-M180 WeakPolarHBondContact CG2-O 3.37Å; T170-P182 HydrophobicContact CG2-CB 4.38Å; T170-P182 HydrophobicContact CG2-CG 3.89Å; T170-I185 HydrophobicContact CG2-CG1 3.9Å; T170-V223 HydrophobicContact CG2-CG1 3.92Å
171	D	94.8	Very high	95.3	Very high	82 Å²	82	41.9 Å²	41.9	44%	0.439	23%	0.227	S	C	.	.	H	α-helix	trans	-65.5	-31.6	175.5	-75.3	-20.9	0	0	0	112.9	R167 A173	R167-D171 IonicContact CZ-OD1 2.82Å; R167-D171 IonicContact CZ-OD2 2.85Å; R167-D171 IonicContact NE-OD1 2.72Å; R167-D171 IonicContact NE-OD2 3.54Å; R167-D171 PolarHBondContact NE-OD2 3.47Å; R167-D171 IonicContact NH1-OD1 3.53Å; R167-D171 PolarHBondContact NH1-OD1 3.24Å; R167-D171 IonicContact NH1-OD2 2.67Å; R167-D171 IonicContact NH2-OD1 3.04Å; R167-D171 PolarHBondContact NH2-OD1 3.04Å; R167-D171 IonicContact NH2-OD2 3.62Å; R167-D171 WeakPolarHBondContact O-CB 3.45Å; R167-D171 PolarHBondContact O-N 3.39Å; D171-A173 VanDerWaalsContact C-N 3.34Å
172	A	95.2	Very high	95.3	Very high	18 Å²	18	43 Å²	43	15%	0.149	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-5.9	176	0	0	0	0	0	113.5	P66 L168 I169 T170 D174 T175 C176	P66-A172 HydrophobicContact CB-CB 3.72Å; L168-A172 WeakPolarHBondContact O-CB 3.39Å; L168-A172 PolarHBondContact O-N 3.38Å; I169-A172 PolarHBondContact O-N 2.91Å; T170-A172 VanDerWaalsContact C-N 3.29Å; T170-A172 PolarHBondContact O-N 3.04Å; A172-D174 PolarHBondContact O-N 3.25Å; A172-T175 PolarHBondContact O-N 3.38Å; A172-C176 VanDerWaalsContact O-CB 3.27Å; A172-C176 WeakPolarHBondContact O-CB 3.41Å; A172-C176 PolarHBondContact O-N 3.14Å
173	A	94.1	Very high	95.3	Very high	7 Å²	7	47.3 Å²	47.3	6%	0.058	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-42	-164.9	0	0	0	0	0	113.6	I169 T170 D171 G177 T178 M180	I169-A173 PolarHBondContact O-N 2.86Å; T170-A173 VanDerWaalsContact O-CB 3.22Å; T170-A173 WeakPolarHBondContact O-CB 3.43Å; T170-A173 PolarHBondContact O-N 2.87Å; T170-A173 VanDerWaalsContact O-N 3.15Å; D171-A173 VanDerWaalsContact C-N 3.34Å; A173-G177 CarbonylContact O-C 3.57Å; A173-G177 WeakPolarHBondContact O-CA 3.39Å; A173-G177 PolarHBondContact O-N 2.54Å; A173-T178 WeakPolarHBondContact CA-OG1 3.43Å; A173-T178 PolarHBondContact O-N 2.99Å; A173-M180 WeakPolarHBondContact CB-O 3.48Å
174	D	91.1	Very high	95.2	Very high	156 Å²	156	48 Å²	48	83%	0.834	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-51.7	179.2	-66.1	-25.4	0	0	0	110.6	A172 C176 G177	A172-D174 PolarHBondContact O-N 3.25Å; D174-C176 VanDerWaalsContact C-N 3.31Å; D174-C176 PolarHBondContact O-N 3.08Å; D174-G177 PolarHBondContact O-N 3.32Å; D174-G177 VanDerWaalsContact O-N 3.15Å
175	T	92.8	Very high	95.2	Very high	130 Å²	130	48 Å²	48	80%	0.798	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-37.7	-178.6	-50.2	0	0	0	0	112.9	A172	A172-T175 PolarHBondContact O-N 3.38Å
176	C	92.1	Very high	95.2	Very high	52 Å²	52	47.8 Å²	47.8	35%	0.351	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-0.2	-179.9	-62.7	0	0	0	0	113.5	A172 D174 T178	A172-C176 VanDerWaalsContact O-CB 3.27Å; A172-C176 WeakPolarHBondContact O-CB 3.41Å; A172-C176 PolarHBondContact O-N 3.14Å; D174-C176 VanDerWaalsContact C-N 3.31Å; D174-C176 PolarHBondContact O-N 3.08Å; C176-T178 HydrophobicContact CB-CG2 3.78Å; C176-T178 PolarHBondContact O-N 2.78Å
177	G	92	Very high	95.2	Very high	35 Å²	35	50.6 Å²	50.6	36%	0.361	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	32.7	-179	0	0	0	0	0	114.1	A173 D174	A173-G177 CarbonylContact O-C 3.57Å; A173-G177 WeakPolarHBondContact O-CA 3.39Å; A173-G177 PolarHBondContact O-N 2.54Å; D174-G177 PolarHBondContact O-N 3.32Å; D174-G177 VanDerWaalsContact O-N 3.15Å
178	T	91.8	Very high	95.2	Very high	2 Å²	2	48 Å²	48	1%	0.012	27%	0.266	C	S	.	.			trans	-83.5	-18.6	-176.6	66.3	0	0	0	0	113.5	P66 A173 C176 M180	P66-T178 WeakPolarHBondContact O-CG2 3.49Å; A173-T178 WeakPolarHBondContact CA-OG1 3.43Å; A173-T178 PolarHBondContact O-N 2.99Å; C176-T178 HydrophobicContact CB-CG2 3.78Å; C176-T178 PolarHBondContact O-N 2.78Å; T178-M180 VanDerWaalsContact C-N 3.28Å; T178-M180 PolarHBondContact O-N 3.47Å
179	R	89.2	Confident	95.3	Very high	209 Å²	209	45.8 Å²	45.8	79%	0.789	26%	0.255	S	S	*	.			trans	57	38.8	179.3	-53.9	-179	176.6	-149.7	-1.7	113.1	R73	R73-R179 PolarHBondContact NH1-O 3.43Å; R73-R179 PolarHBondContact NH2-O 3.35Å; R73-R179 VanDerWaalsContact NH2-O 3.16Å
180	M	95.9	Very high	95.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.255	C	S	.	.			trans	-106	86.8	174.7	-70.1	-55.4	-56.6	0	0	110.2	I71 R73 I169 T170 A173 T178 A184 I185	I71-M180 HydrophobicContact CG2-CG 4.23Å; I71-M180 WeakPolarHBondContact O-CE 3.39Å; R73-M180 HydrophobicContact CB-CE 4.27Å; R73-M180 HydrophobicContact CB-SD 4.18Å; R73-M180 PolarHBondContact NH1-SD 3.29Å; I169-M180 HydrophobicContact CG2-CB 3.6Å; I169-M180 HydrophobicContact CG2-CG 4.07Å; T170-M180 WeakPolarHBondContact CA-O 3.22Å; T170-M180 WeakPolarHBondContact CG2-O 3.37Å; A173-M180 WeakPolarHBondContact CB-O 3.48Å; T178-M180 VanDerWaalsContact C-N 3.28Å; T178-M180 PolarHBondContact O-N 3.47Å; M180-A184 HydrophobicContact CE-CB 4.34Å; M180-I185 HydrophobicContact CE-CD1 3.33Å; M180-I185 HydrophobicContact CE-CG1 3.82Å
181	S	96.7	Very high	95.2	Very high	45 Å²	45	45.2 Å²	45.2	32%	0.315	25%	0.251	S	S	.	.			trans	-77.4	164.3	173.2	81	0	0	0	0	111.9	E183 A184 I185	S181-E183 WeakPolarHBondContact CB-OE2 3.39Å; S181-E183 PolarHBondContact O-N 2.82Å; S181-E183 PolarHBondContact OG-N 3.21Å; S181-E183 PolarHBondContact OG-OE2 3.34Å; S181-A184 PolarHBondContact O-N 3.48Å; S181-A184 VanDerWaalsContact O-N 3.12Å; S181-A184 PolarHBondContact OG-N 2.97Å; S181-A184 VanDerWaalsContact OG-N 3.17Å; S181-I185 WeakPolarHBondContact O-CG1 3.5Å; S181-I185 PolarHBondContact O-N 2.88Å
182	P	97.7	Very high	95.3	Very high	22 Å²	22	41.4 Å²	41.4	14%	0.143	23%	0.231	C	C	.	.	H	α-helix	trans	-53.7	-35.7	172.6	-27.9	37.1	0	0	0	114	T170 G186 T220 V223 E224	T170-P182 HydrophobicContact CG2-CB 4.38Å; T170-P182 HydrophobicContact CG2-CG 3.89Å; P182-G186 PolarHBondContact O-N 2.99Å; P182-T220 HydrophobicContact CB-CG2 3.9Å; P182-T220 PolarHBondContact O-OG1 3.02Å; P182-V223 HydrophobicContact CB-CB 4.48Å; P182-V223 HydrophobicContact CB-CG1 4.12Å; P182-V223 HydrophobicContact CG-CG1 4.33Å; P182-E224 HydrophobicContact CB-CG 3.87Å; P182-E224 HydrophobicContact CG-CG 4.01Å
183	E	97.6	Very high	95.4	Very high	92 Å²	92	40.6 Å²	40.6	43%	0.43	22%	0.224	S	C	.	.	H	α-helix	trans	-69	-45.3	175.1	-56.8	75.4	-167.1	0	0	111.3	S181 I185 G186 L187 T220	S181-E183 WeakPolarHBondContact CB-OE2 3.39Å; S181-E183 PolarHBondContact O-N 2.82Å; S181-E183 PolarHBondContact OG-N 3.21Å; S181-E183 PolarHBondContact OG-OE2 3.34Å; E183-I185 VanDerWaalsContact C-N 3.3Å; E183-I185 PolarHBondContact O-N 3.28Å; E183-G186 PolarHBondContact O-N 3.46Å; E183-G186 VanDerWaalsContact O-N 3.15Å; E183-L187 WeakPolarHBondContact O-CG 3.19Å; E183-L187 PolarHBondContact O-N 2.89Å; E183-T220 WeakPolarHBondContact CA-OG1 3.32Å; E183-T220 HydrophobicContact CG-CG2 4.21Å
184	A	97.2	Very high	95.6	Very high	15 Å²	15	40.3 Å²	40.3	12%	0.124	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-39	177.9	0	0	0	0	0	111.7	M180 S181 S188	M180-A184 HydrophobicContact CE-CB 4.34Å; S181-A184 PolarHBondContact O-N 3.48Å; S181-A184 VanDerWaalsContact O-N 3.12Å; S181-A184 PolarHBondContact OG-N 2.97Å; S181-A184 VanDerWaalsContact OG-N 3.17Å; A184-S188 WeakPolarHBondContact O-CB 3.38Å; A184-S188 PolarHBondContact O-N 3.39Å; A184-S188 PolarHBondContact O-OG 2.81Å
185	I	98.2	Very high	95.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-50.9	170.8	-68.4	-73.8	0	0	0	110	W72 F166 I169 T170 M180 S181 E183 L187 S188 V189 V219 V223	W72-I185 HydrophobicContact CB-CD1 4.42Å; F166-I185 HydrophobicContact CB-CG2 3.98Å; F166-I185 HydrophobicContact CD1-CD1 4.49Å; F166-I185 HydrophobicContact CD1-CG2 4.04Å; F166-I185 HydrophobicContact CD2-CG2 4.07Å; F166-I185 HydrophobicContact CG-CG2 3.76Å; I169-I185 HydrophobicContact CG2-CD1 4.15Å; T170-I185 HydrophobicContact CG2-CG1 3.9Å; M180-I185 HydrophobicContact CE-CD1 3.33Å; M180-I185 HydrophobicContact CE-CG1 3.82Å; S181-I185 WeakPolarHBondContact O-CG1 3.5Å; S181-I185 PolarHBondContact O-N 2.88Å; E183-I185 VanDerWaalsContact C-N 3.3Å; E183-I185 PolarHBondContact O-N 3.28Å; I185-L187 VanDerWaalsContact C-N 3.35Å; I185-L187 PolarHBondContact O-N 2.9Å; I185-S188 WeakPolarHBondContact O-CA 3.13Å; I185-S188 WeakPolarHBondContact O-CB 3.2Å; I185-S188 PolarHBondContact O-N 3.33Å; I185-V189 HydrophobicContact CG2-CG2 4.17Å; I185-V189 WeakPolarHBondContact O-CG2 3.2Å; I185-V189 PolarHBondContact O-N 3.01Å; I185-V219 HydrophobicContact CG2-CG1 4.34Å; I185-V223 HydrophobicContact CG2-CG2 4.41Å
186	G	98.1	Very high	95.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-50.7	-52	179.9	0	0	0	0	0	112.8	P182 E183 S188 V189 A190	P182-G186 PolarHBondContact O-N 2.99Å; E183-G186 PolarHBondContact O-N 3.46Å; E183-G186 VanDerWaalsContact O-N 3.15Å; G186-S188 VanDerWaalsContact C-N 3.25Å; G186-S188 PolarHBondContact O-N 3Å; G186-V189 PolarHBondContact O-N 3.49Å; G186-A190 WeakPolarHBondContact O-CB 3.27Å; G186-A190 PolarHBondContact O-N 2.98Å
187	L	97.1	Very high	95.7	Very high	61 Å²	61	28 Å²	28	32%	0.319	15%	0.148	S	C	.	.	H	α-helix	trans	-60.6	-33.1	176.7	-68.2	170.1	0	0	0	113.1	E183 I185 F212	E183-L187 WeakPolarHBondContact O-CG 3.19Å; E183-L187 PolarHBondContact O-N 2.89Å; I185-L187 VanDerWaalsContact C-N 3.35Å; I185-L187 PolarHBondContact O-N 2.9Å; L187-F212 HydrophobicContact CD2-CE1 3.72Å; L187-F212 HydrophobicContact CD2-CZ 3.84Å
188	S	97.3	Very high	95.2	Very high	19 Å²	19	28.5 Å²	28.5	13%	0.133	14%	0.141	C	C	.	.	H	α-helix	trans	-81.6	-27.9	-173.7	-60.2	0	0	0	0	114	R73 A184 I185 G186	R73-S188 WeakPolarHBondContact CB-OG 3.49Å; A184-S188 WeakPolarHBondContact O-CB 3.38Å; A184-S188 PolarHBondContact O-N 3.39Å; A184-S188 PolarHBondContact O-OG 2.81Å; I185-S188 WeakPolarHBondContact O-CA 3.13Å; I185-S188 WeakPolarHBondContact O-CB 3.2Å; I185-S188 PolarHBondContact O-N 3.33Å; G186-S188 VanDerWaalsContact C-N 3.25Å; G186-S188 PolarHBondContact O-N 3Å
189	V	98.1	Very high	94.4	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-118.3	-18.3	-171	-51.8	0	0	0	0	114.2	W72 K109 F166 I185 G186 P191 S192 L193 V219	W72-V189 HydrophobicContact CB-CG1 3.88Å; W72-V189 HydrophobicContact CD2-CG1 4.2Å; W72-V189 HydrophobicContact CE3-CG1 3.95Å; W72-V189 HydrophobicContact CG-CG1 4.19Å; K109-V189 HydrophobicContact CD-CG1 4.44Å; F166-V189 HydrophobicContact CE1-CG1 4.16Å; F166-V189 HydrophobicContact CE2-CG2 3.98Å; F166-V189 HydrophobicContact CZ-CB 4.26Å; F166-V189 HydrophobicContact CZ-CG1 4.01Å; F166-V189 HydrophobicContact CZ-CG2 4.03Å; I185-V189 HydrophobicContact CG2-CG2 4.17Å; I185-V189 WeakPolarHBondContact O-CG2 3.2Å; I185-V189 PolarHBondContact O-N 3.01Å; G186-V189 PolarHBondContact O-N 3.49Å; V189-P191 VanDerWaalsContact C-CD 3.41Å; V189-P191 VanDerWaalsContact C-N 3.34Å; V189-S192 PolarHBondContact O-N 2.89Å; V189-L193 HydrophobicContact CG2-CD1 4.02Å; V189-L193 PolarHBondContact O-N 3.4Å; V189-V219 HydrophobicContact CG2-CG1 3.69Å; V189-V219 HydrophobicContact CG2-CG2 4.37Å
190	A	97.7	Very high	93.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-51.5	-42.9	-179.2	0	0	0	0	0	114.2	G186 S192 L193 F194 F212 A215 V219	G186-A190 WeakPolarHBondContact O-CB 3.27Å; G186-A190 PolarHBondContact O-N 2.98Å; A190-S192 VanDerWaalsContact C-N 3.25Å; A190-S192 PolarHBondContact O-N 3.24Å; A190-L193 PolarHBondContact O-N 3.2Å; A190-L193 VanDerWaalsContact O-N 3.08Å; A190-F194 PolarHBondContact O-N 3.28Å; A190-F212 HydrophobicContact CB-CE2 4.46Å; A190-A215 HydrophobicContact CB-CB 4.07Å; A190-V219 HydrophobicContact CB-CG2 4.2Å
191	P	95.1	Very high	91.9	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.013	18%	0.178	C	C	.	.	H	α-helix	trans	-61.9	-32.4	179	-23.8	35.7	0	0	0	113.1	V189 L193 I198 F212 F374	V189-P191 VanDerWaalsContact C-CD 3.41Å; V189-P191 VanDerWaalsContact C-N 3.34Å; P191-L193 VanDerWaalsContact C-N 3.33Å; P191-I198 HydrophobicContact CB-CD1 3.79Å; P191-I198 HydrophobicContact CB-CG1 3.94Å; P191-I198 WeakPolarHBondContact O-CD1 3.4Å; P191-F212 HydrophobicContact CG-CD2 4.06Å; P191-F212 HydrophobicContact CG-CE2 3.63Å; P191-F374 HydrophobicContact CB-CD2 4.36Å; P191-F374 HydrophobicContact CB-CE2 3.57Å; P191-F374 HydrophobicContact CB-CZ 3.98Å; P191-F374 HydrophobicContact CG-CE2 4.24Å
192	S	97	Very high	90.4	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-74.5	-25.1	178.3	-55.4	0	0	0	0	113.1	K109 L112 S113 V189 A190 F374	K109-S192 WeakPolarHBondContact CB-OG 3.34Å; K109-S192 WeakPolarHBondContact O-CB 3.35Å; K109-S192 PolarHBondContact O-OG 2.98Å; L112-S192 CarbonylContact C-O 3.16Å; L112-S192 VanDerWaalsContact C-O 3.29Å; L112-S192 VanDerWaalsContact CB-O 3.27Å; L112-S192 WeakPolarHBondContact CB-O 3.28Å; S113-S192 PolarHBondContact N-O 3.18Å; V189-S192 PolarHBondContact O-N 2.89Å; A190-S192 VanDerWaalsContact C-N 3.25Å; A190-S192 PolarHBondContact O-N 3.24Å; S192-F374 VanDerWaalsContact OG-CE1 3.25Å; S192-F374 WeakPolarHBondContact OG-CE1 3.4Å; S192-F374 WeakPolarHBondContact OG-CZ 3.46Å
193	L	97.7	Very high	89.2	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-96.4	-36.3	-175.7	-72	172	0	0	0	113	L112 I119 F120 L159 L162 F163 V189 A190 P191 V219	L112-L193 HydrophobicContact CD1-CD2 3.95Å; L112-L193 HydrophobicContact CD2-CD2 4.46Å; I119-L193 HydrophobicContact CG2-CD2 4.32Å; F120-L193 WeakPolarHBondContact CD2-O 3.27Å; F120-L193 HydrophobicContact CE2-CB 4.21Å; L159-L193 HydrophobicContact CD2-CD2 4.43Å; L162-L193 HydrophobicContact CD1-CD2 4.41Å; F163-L193 HydrophobicContact CZ-CD1 4.29Å; V189-L193 HydrophobicContact CG2-CD1 4.02Å; V189-L193 PolarHBondContact O-N 3.4Å; A190-L193 PolarHBondContact O-N 3.2Å; A190-L193 VanDerWaalsContact O-N 3.08Å; P191-L193 VanDerWaalsContact C-N 3.33Å; L193-V219 HydrophobicContact CD1-CG2 4.04Å
194	F	97.4	Very high	88.1	Confident	1 Å²	1	45.5 Å²	45.5	0%	0.004	24%	0.237	C	C	.	.			trans	-114.6	100.1	-174.1	-65.5	-91.2	0	0	0	110.4	F120 E125 L128 F129 A190 T196 C197 A215 V218 V219	F120-F194 HydrophobicContact CD2-CD1 4.25Å; F120-F194 HydrophobicContact CD2-CE1 4.01Å; F120-F194 HydrophobicContact CD2-CZ 4.25Å; F120-F194 HydrophobicContact CE2-CD1 4.48Å; F120-F194 AromaticContact CE2-CE1 3.99Å; F120-F194 HydrophobicContact CE2-CE1 3.99Å; F120-F194 HydrophobicContact CE2-CE2 4.07Å; F120-F194 AromaticContact CE2-CZ 3.76Å; F120-F194 HydrophobicContact CE2-CZ 3.76Å; F120-F194 HydrophobicContact CZ-CZ 4.49Å; E125-F194 HydrophobicContact CB-CD1 4.23Å; E125-F194 HydrophobicContact CG-CD1 3.75Å; E125-F194 HydrophobicContact CG-CE1 4.39Å; E125-F194 WeakPolarHBondContact OE1-CA 3.29Å; L128-F194 HydrophobicContact CB-CE1 4.22Å; L128-F194 HydrophobicContact CD1-CE1 3.77Å; L128-F194 HydrophobicContact CD1-CZ 4.18Å; F129-F194 HydrophobicContact CD1-CD1 4.49Å; F129-F194 AromaticContact CE1-CD1 3.45Å; F129-F194 HydrophobicContact CE1-CD1 3.45Å; F129-F194 VanDerWaalsContact CE1-CD1 3.45Å; F129-F194 AromaticContact CE1-CE1 3.84Å; F129-F194 HydrophobicContact CE1-CE1 3.84Å; F129-F194 HydrophobicContact CE1-CG 4.14Å; F129-F194 HydrophobicContact CZ-CB 4.37Å; F129-F194 AromaticContact CZ-CD1 3.84Å; F129-F194 HydrophobicContact CZ-CD1 3.84Å; F129-F194 HydrophobicContact CZ-CG 4.4Å; A190-F194 PolarHBondContact O-N 3.28Å; F194-T196 VanDerWaalsContact C-N 3.33Å; F194-T196 PolarHBondContact O-N 3.19Å; F194-C197 HydrophobicContact CB-CB 4.17Å; F194-C197 PolarHBondContact O-N 2.86Å; F194-C197 PolarHBondContact O-SG 3.42Å; F194-A215 HydrophobicContact CB-CB 3.8Å; F194-A215 HydrophobicContact CD1-CB 4.35Å; F194-A215 HydrophobicContact CD2-CB 3.85Å; F194-A215 HydrophobicContact CG-CB 3.73Å; F194-V218 HydrophobicContact CE1-CG1 4.27Å; F194-V218 HydrophobicContact CZ-CB 4.06Å; F194-V218 HydrophobicContact CZ-CG1 3.65Å; F194-V219 HydrophobicContact CD2-CG2 4.3Å; F194-V219 HydrophobicContact CE2-CG2 3.65Å
195	H	94.9	Very high	87.4	Confident	48 Å²	48	51.4 Å²	51.4	22%	0.222	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-74.5	-26.9	-174.6	-75.6	-148.8	0	0	0	111.8	L112 L115 E125 C197 I198	L112-H195 PolarHBondContact O-NE2 3.22Å; L115-H195 PolarHBondContact O-CE1 2.93Å; L115-H195 PolarHBondContact O-ND1 2.9Å; E125-H195 PolarHBondContact OE1-N 3.2Å; E125-H195 PolarHBondContact OE2-N 3.46Å; H195-C197 PolarHBondContact O-N 3.3Å; H195-I198 PolarHBondContact O-N 2.87Å
196	T	93.2	Very high	86.8	Confident	32 Å²	32	56.6 Å²	56.6	20%	0.196	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-75.6	-9.2	177.9	70.1	0	0	0	0	113.6	A122 E125 F129 F194 R211	A122-T196 HydrophobicContact CB-CG2 3.9Å; E125-T196 HydrophobicContact CB-CG2 4.5Å; E125-T196 WeakPolarHBondContact OE2-CB 3.42Å; E125-T196 VanDerWaalsContact OE2-CG2 3.28Å; E125-T196 WeakPolarHBondContact OE2-CG2 3.45Å; E125-T196 PolarHBondContact OE2-N 2.99Å; E125-T196 PolarHBondContact OE2-OG1 3.35Å; F129-T196 WeakPolarHBondContact CE2-OG1 3.4Å; F194-T196 VanDerWaalsContact C-N 3.33Å; F194-T196 PolarHBondContact O-N 3.19Å; T196-R211 WeakPolarHBondContact O-CD 3.37Å
197	C	89.8	Confident	86.3	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.007	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-90.1	-9.2	175.7	91	0	0	0	0	113.7	F194 H195 R211 A215	F194-C197 HydrophobicContact CB-CB 4.17Å; F194-C197 PolarHBondContact O-N 2.86Å; F194-C197 PolarHBondContact O-SG 3.42Å; H195-C197 PolarHBondContact O-N 3.3Å; C197-R211 HydrophobicContact CB-CB 4.22Å; C197-A215 HydrophobicContact CB-CB 3.75Å
198	I	82.3	Confident	85.8	Confident	45 Å²	45	58.7 Å²	58.7	23%	0.231	29%	0.292	C	S	.	.	S	Bend	trans	-96.7	139.8	172.9	-57.4	167.1	0	0	0	108.7	P191 H195	P191-I198 HydrophobicContact CB-CD1 3.79Å; P191-I198 HydrophobicContact CB-CG1 3.94Å; P191-I198 WeakPolarHBondContact O-CD1 3.4Å; H195-I198 PolarHBondContact O-N 2.87Å
199	H	75.3	Confident	85.5	Confident	45 Å²	45	58.1 Å²	58.1	21%	0.208	29%	0.287	C	S	.	.			trans	-84.5	140.2	176.1	69.6	107.2	0	0	0	111.2	G201 D208 W367	H199-G201 PolarHBondContact CE1-O 2.98Å; H199-G201 PolarHBondContact ND1-O 3.09Å; H199-D208 HydrophobicContact CB-CB 4.21Å; H199-D208 WeakPolarHBondContact CB-OD2 3.26Å; H199-W367 HydrophobicContact CB-CZ2 4.42Å; H199-W367 AromaticContact CD2-CH2 2.98Å; H199-W367 WeakPolarHBondContact CD2-CH2 3.5Å; H199-W367 AromaticContact CD2-CZ2 3.16Å; H199-W367 WeakPolarHBondContact CD2-CZ2 3.37Å; H199-W367 AromaticContact CG-CH2 3.7Å; H199-W367 AromaticContact CG-CZ2 3.95Å; H199-W367 AromaticContact NE2-CH2 3.21Å; H199-W367 WeakPolarHBondContact NE2-CH2 3.32Å; H199-W367 AromaticContact NE2-CZ2 3.83Å; H199-W367 AromaticContact NE2-CZ3 3.85Å
200	N	67.5	Low	85.2	Confident	172 Å²	172	61.3 Å²	61.3	92%	0.92	30%	0.303	S	S	*	.	S	Bend	trans	-88.6	3.1	177.1	-69.8	-17.4	0	0	0	113.8
201	G	64.8	Low	85	Confident	43 Å²	43	65.9 Å²	65.9	44%	0.443	32%	0.321	S	S	.	.	S	Bend	trans	-116.7	169.3	-170.2	0	0	0	0	0	115	H199 R203	H199-G201 PolarHBondContact CE1-O 2.98Å; H199-G201 PolarHBondContact ND1-O 3.09Å; G201-R203 VanDerWaalsContact C-N 3.26Å; G201-R203 PolarHBondContact O-N 3.38Å
202	H	65	Low	84.9	Confident	205 Å²	205	66 Å²	66	95%	0.949	32%	0.321	S	S	*	.	S	Bend	trans	-67.2	-18.3	179.9	-77.8	-70.8	0	0	0	115.4
203	R	71.7	Confident	84.9	Confident	220 Å²	220	68.7 Å²	68.7	83%	0.83	33%	0.331	S	S	*	.	S	Bend	trans	-126.5	130.2	-178.3	-69.5	-172.8	-178	178.8	1.6	111.5	G201	G201-R203 VanDerWaalsContact C-N 3.26Å; G201-R203 PolarHBondContact O-N 3.38Å
204	A	74.3	Confident	84.8	Confident	42 Å²	42	70 Å²	70	35%	0.347	34%	0.339	S	S	.	.			trans	-63	130.1	168.8	0	0	0	0	0	111.3	W367	A204-W367 HydrophobicContact CB-CE3 4.08Å; A204-W367 HydrophobicContact CB-CH2 3.2Å; A204-W367 HydrophobicContact CB-CZ2 4.36Å; A204-W367 HydrophobicContact CB-CZ3 3.08Å
205	R	82.8	Confident	84.8	Confident	138 Å²	138	70 Å²	70	52%	0.521	34%	0.339	S	S	.	.			trans	-101.3	158.9	167.6	-62	179.9	-65.3	158	6.8	110	E207 D208 V209	R205-E207 IonicContact CZ-OE2 3.55Å; R205-E207 IonicContact NH1-OE2 3.74Å; R205-E207 IonicContact NH2-OE2 2.6Å; R205-E207 PolarHBondContact O-N 3.37Å; R205-D208 WeakPolarHBondContact CB-OD2 3.49Å; R205-D208 PolarHBondContact N-OD2 2.98Å; R205-D208 IonicContact NE-OD2 2.79Å; R205-D208 IonicContact NH2-OD1 3.72Å; R205-D208 WeakPolarHBondContact O-CB 3.44Å; R205-D208 PolarHBondContact O-N 2.72Å; R205-V209 PolarHBondContact O-N 3.34Å
206	L	86.9	Confident	85	Confident	110 Å²	110	68 Å²	68	58%	0.576	33%	0.33	S	S	*	.	H	α-helix	trans	-55.6	-37.9	174.9	179.8	62.2	0	0	0	111.7	D208 V209 I210 V359	L206-D208 VanDerWaalsContact C-N 3.27Å; L206-D208 PolarHBondContact O-N 2.82Å; L206-V209 PolarHBondContact O-N 2.82Å; L206-I210 HydrophobicContact CG-CD1 4.12Å; L206-I210 WeakPolarHBondContact O-CG1 3.44Å; L206-I210 PolarHBondContact O-N 3.17Å; L206-V359 HydrophobicContact CD1-CB 4.43Å; L206-V359 HydrophobicContact CD1-CG2 4Å
207	E	87.4	Confident	85.2	Confident	99 Å²	99	73.2 Å²	73.2	46%	0.463	35%	0.347	S	S	.	.	H	α-helix	trans	-56.5	-39.8	174.9	-66.2	172.6	-166.8	0	0	112.6	R205 V209 I210 R211	R205-E207 IonicContact CZ-OE2 3.55Å; R205-E207 IonicContact NH1-OE2 3.74Å; R205-E207 IonicContact NH2-OE2 2.6Å; R205-E207 PolarHBondContact O-N 3.37Å; E207-V209 VanDerWaalsContact C-N 3.35Å; E207-I210 PolarHBondContact O-N 3.4Å; E207-R211 WeakPolarHBondContact O-CG 3.38Å; E207-R211 PolarHBondContact O-N 2.99Å
208	D	87	Confident	85.6	Confident	6 Å²	6	73.4 Å²	73.4	3%	0.032	35%	0.348	C	S	.	.	H	α-helix	trans	-68.7	-38.6	-179.1	-52.1	-41.7	0	0	0	110.2	H199 R205 L206 R211 F212 W367	H199-D208 HydrophobicContact CB-CB 4.21Å; H199-D208 WeakPolarHBondContact CB-OD2 3.26Å; R205-D208 WeakPolarHBondContact CB-OD2 3.49Å; R205-D208 PolarHBondContact N-OD2 2.98Å; R205-D208 IonicContact NE-OD2 2.79Å; R205-D208 IonicContact NH2-OD1 3.72Å; R205-D208 WeakPolarHBondContact O-CB 3.44Å; R205-D208 PolarHBondContact O-N 2.72Å; L206-D208 VanDerWaalsContact C-N 3.27Å; L206-D208 PolarHBondContact O-N 2.82Å; D208-R211 PolarHBondContact O-N 3.2Å; D208-F212 WeakPolarHBondContact O-CB 3.37Å; D208-F212 PolarHBondContact O-N 3.25Å; D208-W367 HydrophobicContact CB-CH2 4.42Å; D208-W367 HydrophobicContact CB-CZ2 3.79Å
209	V	89.7	Confident	86.4	Confident	6 Å²	6	71.2 Å²	71.2	4%	0.036	34%	0.337	C	S	.	.	H	α-helix	trans	-64.9	-41.3	174.5	-178.4	0	0	0	0	111.2	R205 L206 E207 F212 R213 V359	R205-V209 PolarHBondContact O-N 3.34Å; L206-V209 PolarHBondContact O-N 2.82Å; E207-V209 VanDerWaalsContact C-N 3.35Å; V209-F212 PolarHBondContact O-N 3.15Å; V209-R213 WeakPolarHBondContact O-CG 3.43Å; V209-R213 PolarHBondContact O-N 3.3Å; V209-V359 HydrophobicContact CG1-CG1 3.77Å; V209-V359 HydrophobicContact CG1-CG2 4.46Å
210	I	92	Very high	87.5	Confident	69 Å²	69	69.9 Å²	69.9	35%	0.354	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-48.4	175.8	-67.4	167.4	0	0	0	110	L206 E207 F212 R213 T214	L206-I210 HydrophobicContact CG-CD1 4.12Å; L206-I210 WeakPolarHBondContact O-CG1 3.44Å; L206-I210 PolarHBondContact O-N 3.17Å; E207-I210 PolarHBondContact O-N 3.4Å; I210-F212 PolarHBondContact O-N 2.99Å; I210-R213 PolarHBondContact O-N 3.31Å; I210-T214 PolarHBondContact O-N 3.45Å; I210-T214 PolarHBondContact O-OG1 3Å
211	R	92.6	Very high	89	Confident	96 Å²	96	62.2 Å²	62.2	36%	0.362	29%	0.29	S	S	.	.	H	α-helix	trans	-60.9	-43	177.9	-71.7	179.1	-170.7	174.9	4	112.3	T196 C197 E207 D208 R213 T214 A215	T196-R211 WeakPolarHBondContact O-CD 3.37Å; C197-R211 HydrophobicContact CB-CB 4.22Å; E207-R211 WeakPolarHBondContact O-CG 3.38Å; E207-R211 PolarHBondContact O-N 2.99Å; D208-R211 PolarHBondContact O-N 3.2Å; R211-R213 PolarHBondContact O-N 3.35Å; R211-T214 WeakPolarHBondContact O-CB 3.17Å; R211-T214 PolarHBondContact O-N 3.23Å; R211-A215 WeakPolarHBondContact O-CB 3.35Å; R211-A215 PolarHBondContact O-N 3.05Å
212	F	94.6	Very high	90.6	Very high	6 Å²	6	60.2 Å²	60.2	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-43.3	175.4	168.1	-106.7	0	0	0	112.6	L187 A190 P191 D208 V209 I210 T214 A215 S216 W367	L187-F212 HydrophobicContact CD2-CE1 3.72Å; L187-F212 HydrophobicContact CD2-CZ 3.84Å; A190-F212 HydrophobicContact CB-CE2 4.46Å; P191-F212 HydrophobicContact CG-CD2 4.06Å; P191-F212 HydrophobicContact CG-CE2 3.63Å; D208-F212 WeakPolarHBondContact O-CB 3.37Å; D208-F212 PolarHBondContact O-N 3.25Å; V209-F212 PolarHBondContact O-N 3.15Å; I210-F212 PolarHBondContact O-N 2.99Å; F212-T214 VanDerWaalsContact C-N 3.34Å; F212-A215 PolarHBondContact O-N 3.38Å; F212-S216 WeakPolarHBondContact O-CB 3.35Å; F212-S216 PolarHBondContact O-N 3.24Å; F212-S216 PolarHBondContact O-OG 3.42Å; F212-W367 VanDerWaalsContact CB-CD1 3.47Å; F212-W367 HydrophobicContact CD1-CB 4.19Å; F212-W367 AromaticContact CD1-CD1 3.43Å; F212-W367 VanDerWaalsContact CD1-CD1 3.43Å; F212-W367 HydrophobicContact CD1-CG 4.13Å; F212-W367 AromaticContact CD2-CD1 3.67Å; F212-W367 HydrophobicContact CE1-CB 4.21Å; F212-W367 AromaticContact CG-CD1 3.22Å; F212-W367 HydrophobicContact CG-CG 4.3Å; F212-W367 AromaticContact CG-NE1 3.81Å
213	R	95.4	Very high	92.2	Very high	57 Å²	57	50.4 Å²	50.4	22%	0.215	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-42.5	174.9	-73.9	178.9	-175	-152.8	-3	111.7	V209 I210 R211 S216 R217 H358 V359 D363	V209-R213 WeakPolarHBondContact O-CG 3.43Å; V209-R213 PolarHBondContact O-N 3.3Å; I210-R213 PolarHBondContact O-N 3.31Å; R211-R213 PolarHBondContact O-N 3.35Å; R213-S216 PolarHBondContact O-N 3.16Å; R213-R217 WeakPolarHBondContact O-CB 3.4Å; R213-R217 VanDerWaalsContact O-CG 3.27Å; R213-R217 WeakPolarHBondContact O-CG 3.4Å; R213-R217 PolarHBondContact O-N 2.66Å; R213-H358 PolarHBondContact NH1-O 3.45Å; R213-V359 VanDerWaalsContact NH2-CA 3.26Å; R213-D363 IonicContact CZ-OD2 3.6Å; R213-D363 IonicContact NH2-OD1 3.41Å; R213-D363 IonicContact NH2-OD2 3.62Å; R213-D363 PolarHBondContact NH2-OD2 2.81Å
214	T	96.9	Very high	93.4	Very high	29 Å²	29	44.1 Å²	44.1	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-48.5	176.1	-59.8	0	0	0	0	110.6	F129 L132 I210 R211 F212 S216 R217 V218	F129-T214 HydrophobicContact CB-CG2 3.64Å; F129-T214 HydrophobicContact CD1-CG2 3.7Å; F129-T214 HydrophobicContact CD2-CG2 4.44Å; F129-T214 HydrophobicContact CG-CG2 3.66Å; L132-T214 HydrophobicContact CD1-CG2 3.93Å; I210-T214 PolarHBondContact O-N 3.45Å; I210-T214 PolarHBondContact O-OG1 3Å; R211-T214 WeakPolarHBondContact O-CB 3.17Å; R211-T214 PolarHBondContact O-N 3.23Å; F212-T214 VanDerWaalsContact C-N 3.34Å; T214-S216 PolarHBondContact O-N 3.25Å; T214-R217 WeakPolarHBondContact O-CB 3.34Å; T214-R217 PolarHBondContact O-N 3.23Å; T214-V218 WeakPolarHBondContact O-CG2 3.39Å; T214-V218 PolarHBondContact O-N 2.83Å
215	A	97.8	Very high	94.4	Very high	0 Å²	0	43 Å²	43	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59	-44.9	175.4	0	0	0	0	0	112.5	F129 A190 F194 C197 R211 F212 R217 V218 V219	F129-A215 HydrophobicContact CE1-CB 3.78Å; F129-A215 HydrophobicContact CZ-CB 4.13Å; A190-A215 HydrophobicContact CB-CB 4.07Å; F194-A215 HydrophobicContact CB-CB 3.8Å; F194-A215 HydrophobicContact CD1-CB 4.35Å; F194-A215 HydrophobicContact CD2-CB 3.85Å; F194-A215 HydrophobicContact CG-CB 3.73Å; C197-A215 HydrophobicContact CB-CB 3.75Å; R211-A215 WeakPolarHBondContact O-CB 3.35Å; R211-A215 PolarHBondContact O-N 3.05Å; F212-A215 PolarHBondContact O-N 3.38Å; A215-R217 VanDerWaalsContact C-N 3.32Å; A215-R217 PolarHBondContact O-N 2.93Å; A215-V218 WeakPolarHBondContact O-CB 3.35Å; A215-V218 PolarHBondContact O-N 3.34Å; A215-V219 PolarHBondContact O-N 3.34Å
216	S	98.1	Very high	95.1	Very high	6 Å²	6	37 Å²	37	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-59.7	-42.8	176.1	-58.6	0	0	0	0	111.6	F212 R213 T214 V218 V219 T220	F212-S216 WeakPolarHBondContact O-CB 3.35Å; F212-S216 PolarHBondContact O-N 3.24Å; F212-S216 PolarHBondContact O-OG 3.42Å; R213-S216 PolarHBondContact O-N 3.16Å; T214-S216 PolarHBondContact O-N 3.25Å; S216-V218 PolarHBondContact O-N 2.88Å; S216-V219 PolarHBondContact O-N 3Å; S216-T220 PolarHBondContact O-N 3.04Å; S216-T220 PolarHBondContact O-OG1 3.04Å; S216-T220 VanDerWaalsContact O-OG1 3.04Å
217	R	98.2	Very high	95.4	Very high	143 Å²	143	32.2 Å²	32.2	54%	0.54	15%	0.147	S	C	.	.	H	α-helix	trans	-65.9	-34.4	176.1	-73.7	173.1	67.1	-154.5	-1.5	113	L132 R213 T214 A215 F221	L132-R217 HydrophobicContact CD1-CB 3.6Å; L132-R217 HydrophobicContact CD2-CB 4.48Å; R213-R217 WeakPolarHBondContact O-CB 3.4Å; R213-R217 VanDerWaalsContact O-CG 3.27Å; R213-R217 WeakPolarHBondContact O-CG 3.4Å; R213-R217 PolarHBondContact O-N 2.66Å; T214-R217 WeakPolarHBondContact O-CB 3.34Å; T214-R217 PolarHBondContact O-N 3.23Å; A215-R217 VanDerWaalsContact C-N 3.32Å; A215-R217 PolarHBondContact O-N 2.93Å; R217-F221 WeakPolarHBondContact O-CB 3.44Å; R217-F221 PolarHBondContact O-N 3.06Å
218	V	98.4	Very high	95.7	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.024	14%	0.14	C	C	.	.	H	α-helix	trans	-62.8	-49.3	171.8	174.4	0	0	0	0	109.9	L128 F129 L132 F194 T214 A215 S216 T220 F221 V222	L128-V218 HydrophobicContact CB-CG1 4.19Å; L128-V218 HydrophobicContact CD2-CG1 4.43Å; L128-V218 WeakPolarHBondContact O-CG2 3.26Å; F129-V218 HydrophobicContact CD1-CG2 4.07Å; L132-V218 HydrophobicContact CD1-CG2 3.94Å; L132-V218 HydrophobicContact CD2-CG2 4.24Å; L132-V218 HydrophobicContact CG-CG2 3.97Å; F194-V218 HydrophobicContact CE1-CG1 4.27Å; F194-V218 HydrophobicContact CZ-CB 4.06Å; F194-V218 HydrophobicContact CZ-CG1 3.65Å; T214-V218 WeakPolarHBondContact O-CG2 3.39Å; T214-V218 PolarHBondContact O-N 2.83Å; A215-V218 WeakPolarHBondContact O-CB 3.35Å; A215-V218 PolarHBondContact O-N 3.34Å; S216-V218 PolarHBondContact O-N 2.88Å; V218-T220 PolarHBondContact O-N 3.23Å; V218-F221 PolarHBondContact O-N 3.49Å; V218-V222 HydrophobicContact CG1-CG2 4.4Å; V218-V222 WeakPolarHBondContact O-CG2 3.38Å; V218-V222 PolarHBondContact O-N 3.03Å
219	V	98.7	Very high	95.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-57.4	-49.5	177.4	176.3	0	0	0	0	110.9	F163 I185 V189 A190 L193 F194 A215 S216 F221 V222 V223	F163-V219 HydrophobicContact CE1-CG1 4.02Å; I185-V219 HydrophobicContact CG2-CG1 4.34Å; V189-V219 HydrophobicContact CG2-CG1 3.69Å; V189-V219 HydrophobicContact CG2-CG2 4.37Å; A190-V219 HydrophobicContact CB-CG2 4.2Å; L193-V219 HydrophobicContact CD1-CG2 4.04Å; F194-V219 HydrophobicContact CD2-CG2 4.3Å; F194-V219 HydrophobicContact CE2-CG2 3.65Å; A215-V219 PolarHBondContact O-N 3.34Å; S216-V219 PolarHBondContact O-N 3Å; V219-F221 VanDerWaalsContact C-N 3.34Å; V219-F221 PolarHBondContact O-N 2.94Å; V219-V222 PolarHBondContact O-N 3.07Å; V219-V223 HydrophobicContact CG1-CG2 4.31Å; V219-V223 WeakPolarHBondContact O-CG2 3.42Å; V219-V223 PolarHBondContact O-N 3.39Å
220	T	98.5	Very high	95.8	Very high	16 Å²	16	33.2 Å²	33.2	10%	0.098	15%	0.154	C	C	.	.	H	α-helix	trans	-54.5	-49.7	177	-62.6	0	0	0	0	111.3	P182 E183 S216 V218 V222 V223 E224	P182-T220 HydrophobicContact CB-CG2 3.9Å; P182-T220 PolarHBondContact O-OG1 3.02Å; E183-T220 WeakPolarHBondContact CA-OG1 3.32Å; E183-T220 HydrophobicContact CG-CG2 4.21Å; S216-T220 PolarHBondContact O-N 3.04Å; S216-T220 PolarHBondContact O-OG1 3.04Å; S216-T220 VanDerWaalsContact O-OG1 3.04Å; V218-T220 PolarHBondContact O-N 3.23Å; T220-V222 PolarHBondContact O-N 3.35Å; T220-V223 PolarHBondContact O-N 3.01Å; T220-E224 HydrophobicContact CG2-CG 4.37Å; T220-E224 WeakPolarHBondContact O-CG 3.08Å; T220-E224 PolarHBondContact O-N 3.4Å
221	F	98.2	Very high	96	Very high	12 Å²	12	29.9 Å²	29.9	5%	0.053	14%	0.137	C	C	.	.	H	α-helix	trans	-57.7	-45.9	178.4	172.5	-101.3	0	0	0	112.5	L132 R140 R141 V144 R217 V218 V219 V223 E224 N225	L132-F221 HydrophobicContact CD2-CB 4.47Å; R140-F221 HydrophobicContact CB-CE1 4.44Å; R140-F221 HydrophobicContact CB-CE2 4.45Å; R140-F221 HydrophobicContact CB-CZ 3.86Å; R140-F221 VanDerWaalsContact CD-CZ 3.48Å; R140-F221 HydrophobicContact CG-CD1 4.46Å; R140-F221 HydrophobicContact CG-CE1 3.74Å; R140-F221 HydrophobicContact CG-CE2 4.1Å; R140-F221 HydrophobicContact CG-CZ 3.54Å; R141-F221 HydrophobicContact CG-CE1 4.33Å; R141-F221 HydrophobicContact CG-CZ 3.73Å; V144-F221 HydrophobicContact CG2-CD1 4.3Å; V144-F221 HydrophobicContact CG2-CE1 3.96Å; R217-F221 WeakPolarHBondContact O-CB 3.44Å; R217-F221 PolarHBondContact O-N 3.06Å; V218-F221 PolarHBondContact O-N 3.49Å; V219-F221 VanDerWaalsContact C-N 3.34Å; V219-F221 PolarHBondContact O-N 2.94Å; F221-V223 VanDerWaalsContact C-N 3.34Å; F221-E224 PolarHBondContact O-N 3.3Å; F221-N225 VanDerWaalsContact CD2-ND2 3.29Å; F221-N225 WeakPolarHBondContact CD2-ND2 3.49Å; F221-N225 WeakPolarHBondContact CE2-ND2 3.22Å; F221-N225 WeakPolarHBondContact O-CB 3.48Å; F221-N225 PolarHBondContact O-N 2.93Å; F221-N225 PolarHBondContact O-ND2 3.02Å
222	V	98.4	Very high	96.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-65.9	-38.8	179.8	179.4	0	0	0	0	111.1	V144 F148 F163 V218 V219 T220 F226 L231 F232	V144-V222 HydrophobicContact CG1-CG2 4.02Å; F148-V222 HydrophobicContact CE2-CG1 3.96Å; F148-V222 HydrophobicContact CZ-CG1 4.09Å; F148-V222 HydrophobicContact CZ-CG2 4.17Å; F163-V222 HydrophobicContact CB-CG1 4.2Å; F163-V222 HydrophobicContact CD1-CB 3.83Å; F163-V222 HydrophobicContact CD1-CG1 3.36Å; F163-V222 HydrophobicContact CD2-CG1 3.85Å; F163-V222 HydrophobicContact CE1-CB 3.59Å; F163-V222 HydrophobicContact CE1-CG1 3.51Å; F163-V222 HydrophobicContact CE1-CG2 4.42Å; F163-V222 HydrophobicContact CE2-CG1 3.98Å; F163-V222 HydrophobicContact CG-CB 4.49Å; F163-V222 HydrophobicContact CG-CG1 3.54Å; F163-V222 HydrophobicContact CZ-CB 4.06Å; F163-V222 HydrophobicContact CZ-CG1 3.83Å; F163-V222 HydrophobicContact CZ-CG2 4.46Å; V218-V222 HydrophobicContact CG1-CG2 4.4Å; V218-V222 WeakPolarHBondContact O-CG2 3.38Å; V218-V222 PolarHBondContact O-N 3.03Å; V219-V222 PolarHBondContact O-N 3.07Å; T220-V222 PolarHBondContact O-N 3.35Å; V222-F226 PolarHBondContact O-N 2.91Å; V222-L231 HydrophobicContact CG1-CD2 4.09Å; V222-L231 WeakPolarHBondContact O-CD2 3.17Å; V222-F232 HydrophobicContact CG1-CE2 4.14Å
223	V	97.9	Very high	96.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.6	-49.1	175.2	172.8	0	0	0	0	110.9	F163 F166 R167 T170 P182 I185 V219 T220 F221 N225 F226	F163-V223 HydrophobicContact CD1-CG2 3.93Å; F163-V223 HydrophobicContact CE1-CG2 4.38Å; F166-V223 HydrophobicContact CB-CG1 4.43Å; F166-V223 HydrophobicContact CB-CG2 3.66Å; F166-V223 HydrophobicContact CD2-CG2 4.13Å; F166-V223 HydrophobicContact CG-CG2 4.36Å; R167-V223 WeakPolarHBondContact CD-O 3.49Å; T170-V223 HydrophobicContact CG2-CG1 3.92Å; P182-V223 HydrophobicContact CB-CB 4.48Å; P182-V223 HydrophobicContact CB-CG1 4.12Å; P182-V223 HydrophobicContact CG-CG1 4.33Å; I185-V223 HydrophobicContact CG2-CG2 4.41Å; V219-V223 HydrophobicContact CG1-CG2 4.31Å; V219-V223 WeakPolarHBondContact O-CG2 3.42Å; V219-V223 PolarHBondContact O-N 3.39Å; T220-V223 PolarHBondContact O-N 3.01Å; F221-V223 VanDerWaalsContact C-N 3.34Å; V223-N225 VanDerWaalsContact C-N 3.26Å; V223-N225 PolarHBondContact O-N 3.26Å; V223-F226 WeakPolarHBondContact O-CB 3.46Å; V223-F226 PolarHBondContact O-N 3.48Å
224	E	96.9	Very high	95.9	Very high	88 Å²	88	26.4 Å²	26.4	41%	0.411	13%	0.127	S	C	.	.	H	α-helix	trans	-63.9	-30.1	-179.5	-70.1	175.8	144.4	0	0	113.4	P182 T220 F221	P182-E224 HydrophobicContact CB-CG 3.87Å; P182-E224 HydrophobicContact CG-CG 4.01Å; T220-E224 HydrophobicContact CG2-CG 4.37Å; T220-E224 WeakPolarHBondContact O-CG 3.08Å; T220-E224 PolarHBondContact O-N 3.4Å; F221-E224 PolarHBondContact O-N 3.3Å
225	N	96.7	Very high	95.8	Very high	18 Å²	18	30.8 Å²	30.8	10%	0.096	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	8.1	-178.9	-70.6	-99.9	0	0	0	112.6	R141 F221 V223 G227 F228 L231	R141-N225 WeakPolarHBondContact CD-OD1 3.49Å; R141-N225 HydrophobicContact CG-CB 4.09Å; R141-N225 PolarHBondContact NH1-OD1 2.74Å; F221-N225 VanDerWaalsContact CD2-ND2 3.29Å; F221-N225 WeakPolarHBondContact CD2-ND2 3.49Å; F221-N225 WeakPolarHBondContact CE2-ND2 3.22Å; F221-N225 WeakPolarHBondContact O-CB 3.48Å; F221-N225 PolarHBondContact O-N 2.93Å; F221-N225 PolarHBondContact O-ND2 3.02Å; V223-N225 VanDerWaalsContact C-N 3.26Å; V223-N225 PolarHBondContact O-N 3.26Å; N225-G227 PolarHBondContact O-N 3.48Å; N225-F228 HydrophobicContact CB-CD2 4.3Å; N225-F228 VanDerWaalsContact O-CD2 3.22Å; N225-F228 WeakPolarHBondContact O-CD2 3.25Å; N225-F228 PolarHBondContact O-N 3.09Å; N225-L231 VanDerWaalsContact C-CD2 3.41Å; N225-L231 HydrophobicContact CB-CD2 4.01Å; N225-L231 WeakPolarHBondContact O-CD2 3.46Å
226	F	96.5	Very high	95.7	Very high	13 Å²	13	31 Å²	31	6%	0.057	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	127.3	176.2	-168.6	-86.5	0	0	0	110.3	V160 F163 G164 R167 V222 V223 F232 Y237 Y240 L248	V160-F226 HydrophobicContact CG2-CE2 3.84Å; V160-F226 HydrophobicContact CG2-CZ 3.93Å; F163-F226 HydrophobicContact CB-CD2 3.88Å; F163-F226 HydrophobicContact CB-CE2 4.11Å; G164-F226 VanDerWaalsContact CA-CE1 3.49Å; G164-F226 VanDerWaalsContact CA-CE2 3.48Å; G164-F226 VanDerWaalsContact N-CE2 3.27Å; R167-F226 HydrophobicContact CB-CB 3.92Å; R167-F226 HydrophobicContact CB-CD1 3.99Å; R167-F226 HydrophobicContact CB-CG 4.07Å; R167-F226 HydrophobicContact CG-CB 4Å; R167-F226 HydrophobicContact CG-CD1 4.03Å; R167-F226 HydrophobicContact CG-CG 4.35Å; V222-F226 PolarHBondContact O-N 2.91Å; V223-F226 WeakPolarHBondContact O-CB 3.46Å; V223-F226 PolarHBondContact O-N 3.48Å; F226-F232 HydrophobicContact CD2-CD2 4.34Å; F226-F232 AromaticContact CD2-CE2 3.99Å; F226-F232 HydrophobicContact CD2-CE2 3.99Å; F226-F232 HydrophobicContact CE2-CD2 4.3Å; F226-F232 HydrophobicContact CE2-CE2 4.07Å; F226-Y237 HydrophobicContact CD1-CE1 4.28Å; F226-Y237 HydrophobicContact CD2-CE1 4.18Å; F226-Y237 HydrophobicContact CE1-CD1 4.32Å; F226-Y237 AromaticContact CE1-CE1 3.84Å; F226-Y237 HydrophobicContact CE1-CE1 3.84Å; F226-Y237 HydrophobicContact CE2-CD1 4.46Å; F226-Y237 AromaticContact CE2-CE1 3.74Å; F226-Y237 HydrophobicContact CE2-CE1 3.74Å; F226-Y237 HydrophobicContact CG-CE1 4.44Å; F226-Y237 AromaticContact CZ-CD1 3.96Å; F226-Y237 HydrophobicContact CZ-CD1 3.96Å; F226-Y237 AromaticContact CZ-CE1 3.56Å; F226-Y237 HydrophobicContact CZ-CE1 3.56Å; F226-Y240 HydrophobicContact CZ-CD2 4.46Å; F226-Y240 HydrophobicContact CZ-CG 4.43Å; F226-L248 HydrophobicContact CE1-CD1 3.95Å; F226-L248 HydrophobicContact CE1-CD2 4.24Å
227	G	92.9	Very high	95.5	Very high	9 Å²	9	30.7 Å²	30.7	9%	0.093	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.6	10.6	-172.7	0	0	0	0	0	113.6	N225 Y237 V250 E251	N225-G227 PolarHBondContact O-N 3.48Å; G227-Y237 PolarHBondContact N-OH 3.26Å; G227-Y237 VanDerWaalsContact N-OH 3.09Å; G227-V250 CarbonylContact O-C 3.58Å; G227-V250 WeakPolarHBondContact O-CA 3.4Å; G227-V250 WeakPolarHBondContact O-CG1 3.2Å; G227-E251 PolarHBondContact O-N 2.93Å
228	F	93.5	Very high	95.2	Very high	75 Å²	75	26.1 Å²	26.1	33%	0.329	13%	0.129	S	C	.	.			trans	-95	137.2	166.6	-74.7	-105	0	0	0	110.1	R141 N225 N230 L231 Y237 E251	R141-F228 VanDerWaalsContact CZ-CD1 3.49Å; N225-F228 HydrophobicContact CB-CD2 4.3Å; N225-F228 VanDerWaalsContact O-CD2 3.22Å; N225-F228 WeakPolarHBondContact O-CD2 3.25Å; N225-F228 PolarHBondContact O-N 3.09Å; F228-N230 PolarHBondContact O-N 3.37Å; F228-N230 VanDerWaalsContact O-N 3.08Å; F228-L231 PolarHBondContact O-N 3.21Å; F228-L231 VanDerWaalsContact O-N 3.13Å; F228-Y237 WeakPolarHBondContact O-CE2 3.28Å; F228-Y237 PolarHBondContact O-OH 3.47Å; F228-E251 HydrophobicContact CD1-CG 4.02Å; F228-E251 WeakPolarHBondContact CD1-OE1 3.35Å; F228-E251 HydrophobicContact CG-CG 4.44Å
229	S	88.7	Confident	95.1	Very high	32 Å²	32	26.7 Å²	26.7	22%	0.224	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.1	-169.9	63.5	0	0	0	0	113.5	E251	S229-E251 WeakPolarHBondContact CB-OE2 3.42Å; S229-E251 PolarHBondContact N-OE1 3.5Å; S229-E251 PolarHBondContact OG-OE2 2.59Å
230	N	91.6	Very high	94.9	Very high	24 Å²	24	26.9 Å²	26.9	13%	0.128	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	19.2	-178.3	70.1	-25	0	0	0	113.9	Q138 R141 E142 C145 F228	Q138-N230 WeakPolarHBondContact CG-ND2 3.44Å; Q138-N230 PolarHBondContact O-ND2 3.28Å; R141-N230 CarbonylContact C-O 3.52Å; R141-N230 WeakPolarHBondContact CD-OD1 3.03Å; R141-N230 PolarHBondContact NE-OD1 3.45Å; R141-N230 VanDerWaalsContact O-O 3.12Å; E142-N230 HydrophobicContact CG-CB 4.09Å; E142-N230 PolarHBondContact N-O 3.28Å; C145-N230 VanDerWaalsContact CB-O 3.29Å; C145-N230 WeakPolarHBondContact CB-O 3.43Å; F228-N230 PolarHBondContact O-N 3.37Å; F228-N230 VanDerWaalsContact O-N 3.08Å
231	L	96.2	Very high	94.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-42.2	172.9	-177.2	69.5	0	0	0	112.9	R141 V144 C145 V222 N225 F228	R141-L231 HydrophobicContact CB-CD1 4.37Å; R141-L231 HydrophobicContact CG-CD1 4.31Å; V144-L231 HydrophobicContact CB-CD1 3.99Å; V144-L231 HydrophobicContact CG1-CD1 3.72Å; C145-L231 WeakPolarHBondContact CA-O 3.5Å; C145-L231 WeakPolarHBondContact CB-O 3.34Å; V222-L231 HydrophobicContact CG1-CD2 4.09Å; V222-L231 WeakPolarHBondContact O-CD2 3.17Å; N225-L231 VanDerWaalsContact C-CD2 3.41Å; N225-L231 HydrophobicContact CB-CD2 4.01Å; N225-L231 WeakPolarHBondContact O-CD2 3.46Å; F228-L231 PolarHBondContact O-N 3.21Å; F228-L231 VanDerWaalsContact O-N 3.13Å
232	F	95.9	Very high	94.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	-125.7	147.4	171.2	-77.1	-94.3	0	0	0	109.3	F148 L159 V160 F163 V222 F226 N236 Y237	F148-F232 AromaticContact CD2-CD1 3.76Å; F148-F232 HydrophobicContact CD2-CD1 3.76Å; F148-F232 HydrophobicContact CD2-CD2 4.31Å; F148-F232 AromaticContact CD2-CE1 3.33Å; F148-F232 HydrophobicContact CD2-CE1 3.33Å; F148-F232 AromaticContact CD2-CE2 3.94Å; F148-F232 HydrophobicContact CD2-CE2 3.94Å; F148-F232 HydrophobicContact CD2-CG 4.23Å; F148-F232 AromaticContact CD2-CZ 3.44Å; F148-F232 HydrophobicContact CD2-CZ 3.44Å; F148-F232 VanDerWaalsContact CD2-CZ 3.44Å; F148-F232 HydrophobicContact CE2-CD1 4.39Å; F148-F232 HydrophobicContact CE2-CD2 4.38Å; F148-F232 AromaticContact CE2-CE1 3.66Å; F148-F232 HydrophobicContact CE2-CE1 3.66Å; F148-F232 AromaticContact CE2-CE2 3.64Å; F148-F232 HydrophobicContact CE2-CE2 3.64Å; F148-F232 AromaticContact CE2-CZ 3.22Å; F148-F232 HydrophobicContact CE2-CZ 3.22Å; F148-F232 HydrophobicContact CG-CE1 4.14Å; F148-F232 HydrophobicContact CZ-CZ 4.2Å; L159-F232 HydrophobicContact CB-CE1 4.19Å; V160-F232 HydrophobicContact CB-CD1 4.01Å; V160-F232 HydrophobicContact CB-CE1 3.93Å; V160-F232 HydrophobicContact CB-CZ 4.46Å; V160-F232 HydrophobicContact CG2-CD1 4.16Å; V160-F232 HydrophobicContact CG2-CE1 4.38Å; V160-F232 HydrophobicContact CG2-CG 4.28Å; F163-F232 HydrophobicContact CB-CE2 4.36Å; F163-F232 HydrophobicContact CB-CZ 4.26Å; F163-F232 AromaticContact CD2-CZ 3.94Å; F163-F232 HydrophobicContact CD2-CZ 3.94Å; F163-F232 HydrophobicContact CG-CZ 4.42Å; V222-F232 HydrophobicContact CG1-CE2 4.14Å; F226-F232 HydrophobicContact CD2-CD2 4.34Å; F226-F232 AromaticContact CD2-CE2 3.99Å; F226-F232 HydrophobicContact CD2-CE2 3.99Å; F226-F232 HydrophobicContact CE2-CD2 4.3Å; F226-F232 HydrophobicContact CE2-CE2 4.07Å; F232-N236 HydrophobicContact CB-CB 4.28Å; F232-N236 HydrophobicContact CD1-CB 4.32Å; F232-Y237 HydrophobicContact CB-CD2 4.21Å; F232-Y237 HydrophobicContact CB-CE1 4.21Å; F232-Y237 HydrophobicContact CB-CE2 3.78Å; F232-Y237 HydrophobicContact CD2-CE1 4.24Å
233	P	92.8	Very high	93.9	Very high	24 Å²	24	35.9 Å²	35.9	16%	0.156	17%	0.167	C	C	.	.			trans	-49.9	148.5	166.3	-27.7	32.9	0	0	0	112.7	S149 E235 N236 Y237	S149-P233 WeakPolarHBondContact OG-CG 3.43Å; P233-E235 VanDerWaalsContact C-N 3.25Å; P233-E235 WeakPolarHBondContact CB-OE2 3.42Å; P233-E235 PolarHBondContact O-N 2.91Å; P233-N236 WeakPolarHBondContact CD-ND2 3.39Å; P233-N236 WeakPolarHBondContact O-CB 3.49Å; P233-N236 PolarHBondContact O-N 3.43Å; P233-Y237 PolarHBondContact O-N 3.48Å
234	R	92.2	Very high	93.7	Very high	62 Å²	62	37.1 Å²	37.1	23%	0.234	18%	0.175	C	C	.	.	H	α-helix	trans	-55.5	-42.4	-179	-179.1	177.5	161.8	160.4	-0.6	112.2	N236 Y237 E238 W254 F256	R234-N236 PolarHBondContact O-N 3.35Å; R234-Y237 PolarHBondContact O-N 3.48Å; R234-Y237 VanDerWaalsContact O-N 3.09Å; R234-E238 HydrophobicContact CG-CG 4.43Å; R234-E238 IonicContact CZ-OE1 3.4Å; R234-E238 IonicContact NE-OE1 2.78Å; R234-E238 PolarHBondContact NE-OE1 3.31Å; R234-E238 IonicContact NH2-OE1 3.12Å; R234-E238 PolarHBondContact NH2-OE1 3.24Å; R234-E238 VanDerWaalsContact NH2-OE1 3.12Å; R234-E238 PolarHBondContact O-N 2.85Å; R234-W254 HydrophobicContact CB-CE3 4.26Å; R234-W254 HydrophobicContact CB-CH2 3.64Å; R234-W254 HydrophobicContact CB-CZ2 4.4Å; R234-W254 HydrophobicContact CB-CZ3 3.54Å; R234-W254 HydrophobicContact CG-CD2 4.43Å; R234-W254 HydrophobicContact CG-CE3 3.97Å; R234-W254 HydrophobicContact CG-CH2 4.05Å; R234-W254 HydrophobicContact CG-CZ2 4.47Å; R234-W254 HydrophobicContact CG-CZ3 3.77Å; R234-F256 HydrophobicContact CG-CZ 4.37Å
235	E	93.2	Very high	93.3	Very high	121 Å²	121	35.4 Å²	35.4	57%	0.565	18%	0.181	S	C	*	.	H	α-helix	trans	-61	-31.9	-178.1	-59.5	70.8	-153.1	0	0	111.4	P233 F239	P233-E235 VanDerWaalsContact C-N 3.25Å; P233-E235 WeakPolarHBondContact CB-OE2 3.42Å; P233-E235 PolarHBondContact O-N 2.91Å; E235-F239 VanDerWaalsContact O-CB 3.28Å; E235-F239 WeakPolarHBondContact O-CB 3.42Å; E235-F239 PolarHBondContact O-N 3.46Å
236	N	95.7	Very high	92.6	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-72.8	-40.5	176.9	-68.7	-25.9	0	0	0	111.4	Q156 V160 F232 P233 R234 F239 Y240	Q156-N236 PolarHBondContact OE1-ND2 3.35Å; V160-N236 HydrophobicContact CB-CB 4.18Å; V160-N236 HydrophobicContact CG1-CB 4.16Å; V160-N236 WeakPolarHBondContact CG1-O 3.41Å; V160-N236 HydrophobicContact CG2-CB 4.21Å; F232-N236 HydrophobicContact CB-CB 4.28Å; F232-N236 HydrophobicContact CD1-CB 4.32Å; P233-N236 WeakPolarHBondContact CD-ND2 3.39Å; P233-N236 WeakPolarHBondContact O-CB 3.49Å; P233-N236 PolarHBondContact O-N 3.43Å; R234-N236 PolarHBondContact O-N 3.35Å; N236-F239 PolarHBondContact O-N 3.14Å; N236-Y240 WeakPolarHBondContact O-CB 3.42Å; N236-Y240 PolarHBondContact O-N 2.89Å
237	Y	95	Very high	91.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.1	-39.7	173.6	-75.1	-48.7	0	0	0	112.2	V160 F226 G227 F228 F232 P233 R234 Y240 A241 L248 V250	V160-Y237 HydrophobicContact CG2-CD1 4.15Å; V160-Y237 HydrophobicContact CG2-CE1 4.41Å; F226-Y237 HydrophobicContact CD1-CE1 4.28Å; F226-Y237 HydrophobicContact CD2-CE1 4.18Å; F226-Y237 HydrophobicContact CE1-CD1 4.32Å; F226-Y237 AromaticContact CE1-CE1 3.84Å; F226-Y237 HydrophobicContact CE1-CE1 3.84Å; F226-Y237 HydrophobicContact CE2-CD1 4.46Å; F226-Y237 AromaticContact CE2-CE1 3.74Å; F226-Y237 HydrophobicContact CE2-CE1 3.74Å; F226-Y237 HydrophobicContact CG-CE1 4.44Å; F226-Y237 AromaticContact CZ-CD1 3.96Å; F226-Y237 HydrophobicContact CZ-CD1 3.96Å; F226-Y237 AromaticContact CZ-CE1 3.56Å; F226-Y237 HydrophobicContact CZ-CE1 3.56Å; G227-Y237 PolarHBondContact N-OH 3.26Å; G227-Y237 VanDerWaalsContact N-OH 3.09Å; F228-Y237 WeakPolarHBondContact O-CE2 3.28Å; F228-Y237 PolarHBondContact O-OH 3.47Å; F232-Y237 HydrophobicContact CB-CD2 4.21Å; F232-Y237 HydrophobicContact CB-CE1 4.21Å; F232-Y237 HydrophobicContact CB-CE2 3.78Å; F232-Y237 HydrophobicContact CD2-CE1 4.24Å; P233-Y237 PolarHBondContact O-N 3.48Å; R234-Y237 PolarHBondContact O-N 3.48Å; R234-Y237 VanDerWaalsContact O-N 3.09Å; Y237-Y240 PolarHBondContact O-N 3.16Å; Y237-A241 WeakPolarHBondContact O-CB 3.05Å; Y237-A241 PolarHBondContact O-N 3.27Å; Y237-L248 HydrophobicContact CD1-CD2 3.42Å; Y237-L248 VanDerWaalsContact CD1-CD2 3.42Å; Y237-L248 HydrophobicContact CE1-CD2 4.19Å; Y237-L248 HydrophobicContact CG-CD2 3.96Å; Y237-V250 HydrophobicContact CD1-CG2 4.19Å; Y237-V250 HydrophobicContact CD2-CB 4.49Å; Y237-V250 HydrophobicContact CD2-CG1 3.85Å; Y237-V250 HydrophobicContact CD2-CG2 3.82Å; Y237-V250 HydrophobicContact CE2-CG1 3.77Å; Y237-V250 HydrophobicContact CE2-CG2 4.24Å; Y237-V250 HydrophobicContact CG-CG2 3.79Å
238	E	92.2	Very high	91.3	Very high	47 Å²	47	41.7 Å²	41.7	22%	0.22	21%	0.211	C	C	.	.	H	α-helix	trans	-60.1	-46.3	171.8	-77.7	-179.5	-176.2	0	0	111.5	R234 Y240 A241 R242 F256	R234-E238 HydrophobicContact CG-CG 4.43Å; R234-E238 IonicContact CZ-OE1 3.4Å; R234-E238 IonicContact NE-OE1 2.78Å; R234-E238 PolarHBondContact NE-OE1 3.31Å; R234-E238 IonicContact NH2-OE1 3.12Å; R234-E238 PolarHBondContact NH2-OE1 3.24Å; R234-E238 VanDerWaalsContact NH2-OE1 3.12Å; R234-E238 PolarHBondContact O-N 2.85Å; E238-Y240 PolarHBondContact O-N 3.24Å; E238-A241 PolarHBondContact O-N 3.49Å; E238-R242 VanDerWaalsContact O-CB 3.25Å; E238-R242 WeakPolarHBondContact O-CB 3.34Å; E238-R242 PolarHBondContact O-N 3.2Å; E238-F256 HydrophobicContact CB-CE1 4.38Å; E238-F256 HydrophobicContact CG-CD1 3.85Å; E238-F256 HydrophobicContact CG-CE1 3.14Å; E238-F256 HydrophobicContact CG-CZ 3.58Å
239	F	94.6	Very high	90.7	Very high	16 Å²	16	47.4 Å²	47.4	7%	0.07	23%	0.23	C	C	.	.	H	α-helix	trans	-57.4	-48.5	174.3	172.8	-93.1	0	0	0	111.3	H157 V160 L161 E235 N236 R242 I243	H157-F239 HydrophobicContact CB-CD1 3.87Å; H157-F239 HydrophobicContact CB-CE1 3.47Å; H157-F239 VanDerWaalsContact CB-CE1 3.47Å; H157-F239 HydrophobicContact CB-CE2 4.37Å; H157-F239 HydrophobicContact CB-CG 4.47Å; H157-F239 HydrophobicContact CB-CZ 3.76Å; H157-F239 AromaticContact CD2-CD1 3.63Å; H157-F239 AromaticContact CD2-CD2 3.86Å; H157-F239 AromaticContact CD2-CG 3.5Å; H157-F239 VanDerWaalsContact CD2-CG 3.5Å; H157-F239 WeakPolarHBondContact CD2-CG 3.24Å; H157-F239 AromaticContact CE1-CD2 3.52Å; H157-F239 AromaticContact CE1-CE2 3.79Å; H157-F239 AromaticContact CE1-CG 3.96Å; H157-F239 AromaticContact CG-CD1 3.68Å; H157-F239 AromaticContact CG-CD2 3.87Å; H157-F239 AromaticContact CG-CE1 3.65Å; H157-F239 AromaticContact CG-CE2 3.86Å; H157-F239 AromaticContact CG-CG 3.8Å; H157-F239 AromaticContact CG-CZ 3.75Å; H157-F239 AromaticContact ND1-CD2 3.67Å; H157-F239 AromaticContact ND1-CE2 3.51Å; H157-F239 AromaticContact ND1-CZ 3.77Å; H157-F239 AromaticContact NE2-CD2 3.63Å; H157-F239 AromaticContact NE2-CG 3.61Å; V160-F239 HydrophobicContact CG1-CD1 4.06Å; L161-F239 HydrophobicContact CD1-CE1 3.83Å; L161-F239 HydrophobicContact CD1-CZ 4.33Å; L161-F239 HydrophobicContact CG-CE1 3.97Å; E235-F239 VanDerWaalsContact O-CB 3.28Å; E235-F239 WeakPolarHBondContact O-CB 3.42Å; E235-F239 PolarHBondContact O-N 3.46Å; N236-F239 PolarHBondContact O-N 3.14Å; F239-R242 PolarHBondContact O-N 3.41Å; F239-I243 HydrophobicContact CD1-CG2 4.3Å; F239-I243 HydrophobicContact CE1-CG2 3.97Å; F239-I243 HydrophobicContact CZ-CB 4.34Å; F239-I243 HydrophobicContact CZ-CG1 4.33Å; F239-I243 HydrophobicContact CZ-CG2 4.26Å; F239-I243 WeakPolarHBondContact O-CB 3.18Å; F239-I243 VanDerWaalsContact O-CG2 3.24Å; F239-I243 WeakPolarHBondContact O-CG2 3.16Å; F239-I243 PolarHBondContact O-N 3.47Å
240	Y	95.4	Very high	90.1	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-58.1	-51	178.4	179	-89.7	0	0	0	112.1	N62 V160 L161 G164 L168 F226 N236 Y237 E238 R242 I243 T244 L248	N62-Y240 PolarHBondContact ND2-OH 3.44Å; V160-Y240 HydrophobicContact CG2-CD2 4.49Å; V160-Y240 HydrophobicContact CG2-CG 4.47Å; V160-Y240 VanDerWaalsContact O-CD2 3.27Å; V160-Y240 WeakPolarHBondContact O-CD2 3.37Å; L161-Y240 HydrophobicContact CD2-CD2 4.18Å; L161-Y240 HydrophobicContact CD2-CE2 4.46Å; G164-Y240 PolarHBondContact O-OH 3.19Å; G164-Y240 VanDerWaalsContact O-OH 3.13Å; L168-Y240 WeakPolarHBondContact CD1-OH 3.38Å; F226-Y240 HydrophobicContact CZ-CD2 4.46Å; F226-Y240 HydrophobicContact CZ-CG 4.43Å; N236-Y240 WeakPolarHBondContact O-CB 3.42Å; N236-Y240 PolarHBondContact O-N 2.89Å; Y237-Y240 PolarHBondContact O-N 3.16Å; E238-Y240 PolarHBondContact O-N 3.24Å; Y240-R242 VanDerWaalsContact C-N 3.34Å; Y240-R242 PolarHBondContact O-N 3.41Å; Y240-I243 PolarHBondContact O-N 3.01Å; Y240-T244 HydrophobicContact CD2-CG2 4.22Å; Y240-T244 HydrophobicContact CE1-CG2 4.4Å; Y240-T244 HydrophobicContact CE2-CG2 3.97Å; Y240-T244 WeakPolarHBondContact O-CB 3.45Å; Y240-T244 VanDerWaalsContact O-CG2 3.32Å; Y240-T244 WeakPolarHBondContact O-CG2 3.21Å; Y240-T244 PolarHBondContact O-N 3.14Å; Y240-T244 VanDerWaalsContact O-N 3.1Å; Y240-T244 PolarHBondContact O-OG1 3.42Å; Y240-L248 HydrophobicContact CD1-CD2 4.1Å
241	A	92.3	Very high	89.1	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59	-48.1	178.9	0	0	0	0	0	110.4	Y237 E238 G245 R246 L248 F256 F258	Y237-A241 WeakPolarHBondContact O-CB 3.05Å; Y237-A241 PolarHBondContact O-N 3.27Å; E238-A241 PolarHBondContact O-N 3.49Å; A241-G245 WeakPolarHBondContact O-CA 3.43Å; A241-G245 PolarHBondContact O-N 2.73Å; A241-R246 PolarHBondContact O-N 2.92Å; A241-L248 HydrophobicContact CB-CB 4.44Å; A241-F256 HydrophobicContact CB-CB 3.81Å; A241-F256 HydrophobicContact CB-CG 4.3Å; A241-F258 HydrophobicContact CB-CE2 4.31Å; A241-F258 HydrophobicContact CB-CZ 4.36Å; A241-F258 WeakPolarHBondContact O-CE2 3.23Å; A241-F258 WeakPolarHBondContact O-CZ 3.45Å
242	R	90.7	Very high	87.4	Confident	159 Å²	159	52.2 Å²	52.2	60%	0.6	27%	0.265	S	S	*	.	H	α-helix	trans	-57.9	-52.4	179.6	-172.9	168.5	50.1	-165.6	-8.6	112.7	E238 F239 Y240 T244 G245 M297	E238-R242 VanDerWaalsContact O-CB 3.25Å; E238-R242 WeakPolarHBondContact O-CB 3.34Å; E238-R242 PolarHBondContact O-N 3.2Å; F239-R242 PolarHBondContact O-N 3.41Å; Y240-R242 VanDerWaalsContact C-N 3.34Å; Y240-R242 PolarHBondContact O-N 3.41Å; R242-T244 VanDerWaalsContact C-N 3.35Å; R242-G245 PolarHBondContact O-N 2.63Å; R242-M297 HydrophobicContact CB-CE 3.48Å; R242-M297 VanDerWaalsContact CB-CE 3.48Å; R242-M297 HydrophobicContact CG-CE 4.07Å
243	I	91.8	Very high	85.7	Confident	58 Å²	58	55.3 Å²	55.3	30%	0.297	28%	0.281	S	S	.	.	H	α-helix	trans	-76.4	-26.7	-169.9	-160.1	67.4	0	0	0	112.2	L55 L59 L161 F239 Y240	L55-I243 HydrophobicContact CD1-CG1 4.33Å; L55-I243 HydrophobicContact CD2-CD1 4.34Å; L59-I243 HydrophobicContact CD1-CG1 4.31Å; L59-I243 HydrophobicContact CD2-CG1 4.2Å; L59-I243 HydrophobicContact CD2-CG2 4.31Å; L59-I243 WeakPolarHBondContact CD2-O 3.23Å; L161-I243 HydrophobicContact CD2-CG2 3.53Å; L161-I243 HydrophobicContact CG-CG2 4.32Å; F239-I243 HydrophobicContact CD1-CG2 4.3Å; F239-I243 HydrophobicContact CE1-CG2 3.97Å; F239-I243 HydrophobicContact CZ-CB 4.34Å; F239-I243 HydrophobicContact CZ-CG1 4.33Å; F239-I243 HydrophobicContact CZ-CG2 4.26Å; F239-I243 WeakPolarHBondContact O-CB 3.18Å; F239-I243 VanDerWaalsContact O-CG2 3.24Å; F239-I243 WeakPolarHBondContact O-CG2 3.16Å; F239-I243 PolarHBondContact O-N 3.47Å; Y240-I243 PolarHBondContact O-N 3.01Å
244	T	93	Very high	84.2	Confident	27 Å²	27	56.3 Å²	56.3	17%	0.166	28%	0.282	C	S	.	.	H	α-helix	trans	-92.1	-15.6	177.5	63.9	0	0	0	0	113.1	L59 N62 L161 Y240 R242 R246	L59-T244 HydrophobicContact CD2-CG2 4.11Å; N62-T244 WeakPolarHBondContact OD1-CB 3.21Å; N62-T244 VanDerWaalsContact OD1-CG2 3.26Å; N62-T244 WeakPolarHBondContact OD1-CG2 2.98Å; L161-T244 HydrophobicContact CD2-CG2 3.94Å; Y240-T244 HydrophobicContact CD2-CG2 4.22Å; Y240-T244 HydrophobicContact CE1-CG2 4.4Å; Y240-T244 HydrophobicContact CE2-CG2 3.97Å; Y240-T244 WeakPolarHBondContact O-CB 3.45Å; Y240-T244 VanDerWaalsContact O-CG2 3.32Å; Y240-T244 WeakPolarHBondContact O-CG2 3.21Å; Y240-T244 PolarHBondContact O-N 3.14Å; Y240-T244 VanDerWaalsContact O-N 3.1Å; Y240-T244 PolarHBondContact O-OG1 3.42Å; R242-T244 VanDerWaalsContact C-N 3.35Å; T244-R246 PolarHBondContact O-N 2.6Å; T244-R246 PolarHBondContact OG1-N 3.44Å
245	G	87.7	Confident	82.9	Confident	52 Å²	52	55.9 Å²	55.9	54%	0.536	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	19.6	-172.7	0	0	0	0	0	113.3	A241 R242	A241-G245 WeakPolarHBondContact O-CA 3.43Å; A241-G245 PolarHBondContact O-N 2.73Å; R242-G245 PolarHBondContact O-N 2.63Å
246	R	83	Confident	81.8	Confident	69 Å²	69	50.1 Å²	50.1	26%	0.26	26%	0.256	S	S	.	.			trans	-101.1	141.7	-177.2	-71	-173.4	164.7	140.2	-8.9	111.6	N62 L168 A241 T244 L248 F258	N62-R246 PolarHBondContact ND2-NH1 3.28Å; N62-R246 PolarHBondContact O-NH1 3.22Å; N62-R246 PolarHBondContact O-NH2 3.1Å; N62-R246 PolarHBondContact OD1-NH1 3.39Å; L168-R246 VanDerWaalsContact CD1-CD 3.48Å; L168-R246 VanDerWaalsContact CD1-CZ 3.49Å; A241-R246 PolarHBondContact O-N 2.92Å; T244-R246 PolarHBondContact O-N 2.6Å; T244-R246 PolarHBondContact OG1-N 3.44Å; R246-L248 PolarHBondContact O-N 3.27Å; R246-F258 WeakPolarHBondContact O-CE2 3.47Å
247	T	80.7	Confident	80.3	Confident	81 Å²	81	50.2 Å²	50.2	50%	0.497	26%	0.257	S	S	.	.			trans	-70.2	128.6	169.2	-62.9	0	0	0	0	109.1	H255 F256	T247-H255 WeakPolarHBondContact CG2-NE2 3.46Å; T247-F256 CarbonylContact C-O 3.37Å; T247-F256 WeakPolarHBondContact CA-O 2.91Å; T247-F256 WeakPolarHBondContact CG2-O 3Å
248	L	81.9	Confident	78.8	Confident	22 Å²	22	52.9 Å²	52.9	12%	0.115	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.4	178.3	-178	67.5	0	0	0	109.4	F226 Y237 Y240 A241 R246 V250 F256	F226-L248 HydrophobicContact CE1-CD1 3.95Å; F226-L248 HydrophobicContact CE1-CD2 4.24Å; Y237-L248 HydrophobicContact CD1-CD2 3.42Å; Y237-L248 VanDerWaalsContact CD1-CD2 3.42Å; Y237-L248 HydrophobicContact CE1-CD2 4.19Å; Y237-L248 HydrophobicContact CG-CD2 3.96Å; Y240-L248 HydrophobicContact CD1-CD2 4.1Å; A241-L248 HydrophobicContact CB-CB 4.44Å; R246-L248 PolarHBondContact O-N 3.27Å; L248-V250 HydrophobicContact CD2-CG2 3.74Å; L248-V250 HydrophobicContact CG-CG2 3.83Å; L248-F256 HydrophobicContact CB-CD2 4.41Å; L248-F256 PolarHBondContact N-O 2.82Å; L248-F256 VanDerWaalsContact N-O 3.07Å; L248-F256 PolarHBondContact O-N 3.42Å
249	R	79.3	Confident	77.2	Confident	195 Å²	195	55.8 Å²	55.8	74%	0.736	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.1	169.9	-68.7	178.4	81.1	166	5.4	108.2
250	V	76.9	Confident	75.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	102.9	176.2	-177.4	0	0	0	0	108.7	G227 Y237 L248 W254 F256	G227-V250 CarbonylContact O-C 3.58Å; G227-V250 WeakPolarHBondContact O-CA 3.4Å; G227-V250 WeakPolarHBondContact O-CG1 3.2Å; Y237-V250 HydrophobicContact CD1-CG2 4.19Å; Y237-V250 HydrophobicContact CD2-CB 4.49Å; Y237-V250 HydrophobicContact CD2-CG1 3.85Å; Y237-V250 HydrophobicContact CD2-CG2 3.82Å; Y237-V250 HydrophobicContact CE2-CG1 3.77Å; Y237-V250 HydrophobicContact CE2-CG2 4.24Å; Y237-V250 HydrophobicContact CG-CG2 3.79Å; L248-V250 HydrophobicContact CD2-CG2 3.74Å; L248-V250 HydrophobicContact CG-CG2 3.83Å; V250-W254 HydrophobicContact CB-CB 4.2Å; V250-W254 HydrophobicContact CB-CE3 4.19Å; V250-W254 HydrophobicContact CG1-CE3 3.83Å; V250-W254 HydrophobicContact CG1-CZ3 4.32Å; V250-W254 PolarHBondContact N-O 3.49Å; V250-W254 PolarHBondContact O-N 2.89Å; V250-F256 HydrophobicContact CG2-CD2 4.31Å; V250-F256 HydrophobicContact CG2-CE2 3.94Å
251	E	71.8	Confident	73.1	Confident	61 Å²	61	64.7 Å²	64.7	29%	0.285	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	-171.3	-165.9	-84.2	168.5	-170.4	0	0	112.6	G227 F228 S229 N253	G227-E251 PolarHBondContact O-N 2.93Å; F228-E251 HydrophobicContact CD1-CG 4.02Å; F228-E251 WeakPolarHBondContact CD1-OE1 3.35Å; F228-E251 HydrophobicContact CG-CG 4.44Å; S229-E251 WeakPolarHBondContact CB-OE2 3.42Å; S229-E251 PolarHBondContact N-OE1 3.5Å; S229-E251 PolarHBondContact OG-OE2 2.59Å; E251-N253 PolarHBondContact O-N 3.34Å
252	A	58.9	Low	71	Confident	96 Å²	96	68.5 Å²	68.5	79%	0.793	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-6.1	168.6	0	0	0	0	0	112.4
253	N	59.8	Low	68.8	Low	65 Å²	65	68.9 Å²	68.9	35%	0.348	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-41.6	-167.6	-64.6	-25.1	0	0	0	113	E251 D301 S302	E251-N253 PolarHBondContact O-N 3.34Å; N253-D301 VanDerWaalsContact O-CA 3.24Å; N253-D301 WeakPolarHBondContact O-CA 3.22Å; N253-S302 PolarHBondContact O-N 3.29Å; N253-S302 PolarHBondContact OD1-OG 2.91Å
254	W	63.1	Low	66.3	Low	45 Å²	45	73 Å²	73	17%	0.17	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.1	-177.8	-48.3	-30.8	0	0	0	112	R234 V250 F256 L300	R234-W254 HydrophobicContact CB-CE3 4.26Å; R234-W254 HydrophobicContact CB-CH2 3.64Å; R234-W254 HydrophobicContact CB-CZ2 4.4Å; R234-W254 HydrophobicContact CB-CZ3 3.54Å; R234-W254 HydrophobicContact CG-CD2 4.43Å; R234-W254 HydrophobicContact CG-CE3 3.97Å; R234-W254 HydrophobicContact CG-CH2 4.05Å; R234-W254 HydrophobicContact CG-CZ2 4.47Å; R234-W254 HydrophobicContact CG-CZ3 3.77Å; V250-W254 HydrophobicContact CB-CB 4.2Å; V250-W254 HydrophobicContact CB-CE3 4.19Å; V250-W254 HydrophobicContact CG1-CE3 3.83Å; V250-W254 HydrophobicContact CG1-CZ3 4.32Å; V250-W254 PolarHBondContact N-O 3.49Å; V250-W254 PolarHBondContact O-N 2.89Å; W254-F256 HydrophobicContact CB-CE2 3.98Å; W254-F256 HydrophobicContact CB-CZ 4.08Å; W254-F256 HydrophobicContact CE3-CZ 4.47Å; W254-L300 WeakPolarHBondContact CA-O 3.47Å
255	H	63.4	Low	63.6	Low	52 Å²	52	75 Å²	75	24%	0.241	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	120.1	171.1	-177.4	-122.1	0	0	0	109.8	T247 S257 V299 L300	T247-H255 WeakPolarHBondContact CG2-NE2 3.46Å; H255-S257 VanDerWaalsContact CE1-CB 3.49Å; H255-S257 WeakPolarHBondContact CE1-CB 3.49Å; H255-V299 WeakPolarHBondContact O-CA 3.35Å; H255-L300 HydrophobicContact CB-CB 4.17Å; H255-L300 PolarHBondContact N-O 3.23Å; H255-L300 PolarHBondContact O-N 2.87Å
256	F	71.1	Confident	60.9	Low	0 Å²	0	76.8 Å²	76.8	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	106.6	173	-57	-75.9	0	0	0	108.2	R234 E238 A241 T247 L248 V250 W254 M297 V299	R234-F256 HydrophobicContact CG-CZ 4.37Å; E238-F256 HydrophobicContact CB-CE1 4.38Å; E238-F256 HydrophobicContact CG-CD1 3.85Å; E238-F256 HydrophobicContact CG-CE1 3.14Å; E238-F256 HydrophobicContact CG-CZ 3.58Å; A241-F256 HydrophobicContact CB-CB 3.81Å; A241-F256 HydrophobicContact CB-CG 4.3Å; T247-F256 CarbonylContact C-O 3.37Å; T247-F256 WeakPolarHBondContact CA-O 2.91Å; T247-F256 WeakPolarHBondContact CG2-O 3Å; L248-F256 HydrophobicContact CB-CD2 4.41Å; L248-F256 PolarHBondContact N-O 2.82Å; L248-F256 VanDerWaalsContact N-O 3.07Å; L248-F256 PolarHBondContact O-N 3.42Å; V250-F256 HydrophobicContact CG2-CD2 4.31Å; V250-F256 HydrophobicContact CG2-CE2 3.94Å; W254-F256 HydrophobicContact CB-CE2 3.98Å; W254-F256 HydrophobicContact CB-CZ 4.08Å; W254-F256 HydrophobicContact CE3-CZ 4.47Å; F256-M297 HydrophobicContact CD1-SD 4.1Å; F256-V299 HydrophobicContact CD1-CB 4.33Å; F256-V299 HydrophobicContact CD1-CG1 3.95Å; F256-V299 HydrophobicContact CD1-CG2 3.69Å; F256-V299 HydrophobicContact CE1-CB 4.23Å; F256-V299 HydrophobicContact CE1-CG1 3.5Å; F256-V299 HydrophobicContact CE1-CG2 3.72Å; F256-V299 HydrophobicContact CZ-CG1 4.24Å
257	S	64	Low	58.5	Low	6 Å²	6	82.8 Å²	82.8	4%	0.042	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	156	173.2	57.1	0	0	0	0	111.7	H255 H259 M297 V298	H255-S257 VanDerWaalsContact CE1-CB 3.49Å; H255-S257 WeakPolarHBondContact CE1-CB 3.49Å; S257-H259 PolarHBondContact OG-CD2 2.97Å; S257-H259 PolarHBondContact OG-NE2 2.76Å; S257-M297 CarbonylContact O-C 3.55Å; S257-M297 WeakPolarHBondContact O-CA 3.23Å; S257-V298 PolarHBondContact N-O 3.17Å; S257-V298 PolarHBondContact O-N 3.07Å
258	F	64.2	Low	56.1	Low	56 Å²	56	85.4 Å²	85.4	25%	0.246	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.4	174.9	-63.4	-88.9	0	0	0	109	A241 R246 V296 M297	A241-F258 HydrophobicContact CB-CE2 4.31Å; A241-F258 HydrophobicContact CB-CZ 4.36Å; A241-F258 WeakPolarHBondContact O-CE2 3.23Å; A241-F258 WeakPolarHBondContact O-CZ 3.45Å; R246-F258 WeakPolarHBondContact O-CE2 3.47Å; F258-V296 WeakPolarHBondContact CA-O 3.42Å; F258-M297 HydrophobicContact CD1-CB 4.2Å; F258-M297 HydrophobicContact CE1-CB 3.92Å; F258-M297 HydrophobicContact CE1-CE 3.66Å; F258-M297 HydrophobicContact CE1-CG 4.09Å; F258-M297 HydrophobicContact CZ-CE 3.55Å; F258-M297 HydrophobicContact CZ-CG 4.27Å
259	H	58.3	Low	53.7	Low	107 Å²	107	90 Å²	90	50%	0.495	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.5	173.6	-65.3	-73.5	0	0	0	109.4	S257 V296	S257-H259 PolarHBondContact OG-CD2 2.97Å; S257-H259 PolarHBondContact OG-NE2 2.76Å; H259-V296 PolarHBondContact N-O 2.95Å; H259-V296 PolarHBondContact O-N 2.97Å
260	Y	50.5	Low	51.6	Low	141 Å²	141	87.1 Å²	87.1	55%	0.553	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-73.3	135.3	159.8	-74.2	-89.1	0	0	0	107.7	A262 P295	Y260-A262 PolarHBondContact O-N 3.01Å; Y260-A262 VanDerWaalsContact O-N 3.17Å; Y260-P295 HydrophobicContact CD1-CB 4.27Å; Y260-P295 HydrophobicContact CD2-CB 4.48Å; Y260-P295 HydrophobicContact CE1-CB 4.01Å; Y260-P295 HydrophobicContact CE1-CG 4.14Å; Y260-P295 HydrophobicContact CE2-CB 4.21Å
261	P	52.5	Low	49.5	Very low	66 Å²	66	91.9 Å²	91.9	43%	0.429	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-53.5	123.9	168.7	-20.9	31	0	0	0	108.7	N263 A293 L294 V296	P261-N263 PolarHBondContact O-N 3.46Å; P261-A293 HydrophobicContact CB-CB 4.21Å; P261-A293 HydrophobicContact CG-CB 3.92Å; P261-L294 WeakPolarHBondContact CD-O 3.38Å; P261-V296 HydrophobicContact CG-CG2 4.3Å
262	A	49.4	Very low	47.6	Very low	81 Å²	81	96.4 Å²	96.4	67%	0.669	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-62	128.2	174.1	0	0	0	0	0	108.6	Y260 N264	Y260-A262 PolarHBondContact O-N 3.01Å; Y260-A262 VanDerWaalsContact O-N 3.17Å; A262-N264 VanDerWaalsContact C-N 3.27Å; A262-N264 PolarHBondContact O-N 2.81Å
263	N	43	Very low	46.5	Very low	166 Å²	166	98 Å²	98	89%	0.888	57%	0.574	S	S	*	*			trans	-75.1	86.7	171.9	-156	27.8	0	0	0	106.9	P261 G265	P261-N263 PolarHBondContact O-N 3.46Å; N263-G265 PolarHBondContact O-N 3.39Å
264	N	40.4	Very low	45.3	Very low	146 Å²	146	100.1 Å²	100.1	78%	0.781	60%	0.595	S	S	*	*			trans	-72.7	81.7	175.3	-73.9	0.5	0	0	0	108.7	A262 A266	A262-N264 VanDerWaalsContact C-N 3.27Å; A262-N264 PolarHBondContact O-N 2.81Å; N264-A266 PolarHBondContact O-N 3.44Å
265	G	34.9	Very low	43.8	Very low	69 Å²	69	109.4 Å²	109.4	71%	0.711	63%	0.63	S	S	*	*			trans	-63.8	117.5	154	0	0	0	0	0	107.8	N263 E267	N263-G265 PolarHBondContact O-N 3.39Å; G265-E267 PolarHBondContact O-N 2.8Å
266	A	31.3	Very low	42.3	Very low	89 Å²	89	111.5 Å²	111.5	74%	0.736	65%	0.651	S	S	*	*			trans	-63.9	117.5	-179.3	0	0	0	0	0	111.2	N264	N264-A266 PolarHBondContact O-N 3.44Å
267	E	32.9	Very low	40.6	Very low	195 Å²	195	121 Å²	121	91%	0.911	69%	0.692	S	S	*	*			trans	-124.1	94.3	150.6	-76.5	-171.7	172	0	0	108.1	G265 S269	G265-E267 PolarHBondContact O-N 2.8Å; E267-S269 PolarHBondContact O-N 2.82Å
268	T	30.2	Very low	39.1	Very low	135 Å²	135	127.1 Å²	127.1	83%	0.828	73%	0.731	S	S	*	*			trans	-74	113.1	170.3	-17.5	0	0	0	0	108
269	S	33	Very low	37.5	Very low	120 Å²	120	128.5 Å²	128.5	84%	0.839	75%	0.753	S	S	*	*			trans	-137.5	138.8	152.8	65.1	0	0	0	0	109.5	E267	E267-S269 PolarHBondContact O-N 2.82Å
270	V	33.6	Very low	36.3	Very low	134 Å²	134	128.5 Å²	128.5	81%	0.812	77%	0.772	S	S	*	*			trans	-94.4	128.6	-158.1	169.2	0	0	0	0	109.7
271	S	32.7	Very low	35.2	Very low	100 Å²	100	127.7 Å²	127.7	70%	0.699	78%	0.781	S	S	*	*			trans	179.1	137	138.3	48.4	0	0	0	0	112.6
272	D	32.5	Very low	34.2	Very low	156 Å²	156	129.2 Å²	129.2	83%	0.834	80%	0.799	S	S	*	*			trans	83.1	108.2	161.8	-59.9	-17.2	0	0	0	120.5
273	P	35.7	Very low	33.3	Very low	128 Å²	128	132.7 Å²	132.7	83%	0.831	81%	0.805	S	S	*	*			trans	-100.6	121.1	166.9	34	-22.6	0	0	0	111.4
274	S	34.7	Very low	32.5	Very low	111 Å²	111	129 Å²	129	78%	0.776	80%	0.798	S	S	*	*			trans	-150.3	130.5	152	77.5	0	0	0	0	111.8
275	W	32.2	Very low	32	Very low	239 Å²	239	128.7 Å²	128.7	91%	0.905	80%	0.801	S	S	*	*			trans	74.5	94.4	162.7	-81.5	48	0	0	0	120.6
276	S	31.9	Very low	31.7	Very low	97 Å²	97	130.5 Å²	130.5	68%	0.678	81%	0.809	S	S	*	*				59.2	91	118.4	-46.7	0	0	0	0	119.7
277	K	34.1	Very low	31.7	Very low	200 Å²	200	130.3 Å²	130.3	87%	0.87	81%	0.808	S	S	*	*			trans	-174.4	145.4	138.5	-99.5	158.5	-170.5	-177.5	0	108.9	A279	K277-A279 PolarHBondContact O-N 3.23Å; K277-A279 VanDerWaalsContact O-N 3.12Å
278	P	32.3	Very low	31.5	Very low	133 Å²	133	129.1 Å²	129.1	86%	0.864	81%	0.808	S	S	*	*			trans	-70.7	113.2	-166	28.4	-32.4	0	0	0	110.8
279	A	31.9	Very low	31.7	Very low	86 Å²	86	128.4 Å²	128.4	71%	0.711	80%	0.803	S	S	*	*			trans	-73.7	119.5	163.1	0	0	0	0	0	108.2	K277 V281	K277-A279 PolarHBondContact O-N 3.23Å; K277-A279 VanDerWaalsContact O-N 3.12Å; A279-V281 PolarHBondContact O-N 2.94Å
280	A	32.4	Very low	31.7	Very low	107 Å²	107	132.4 Å²	132.4	88%	0.884	81%	0.809	S	S	*	*			trans	-67.3	100.2	166.5	0	0	0	0	0	108.2	A282	A280-A282 PolarHBondContact O-N 2.69Å
281	V	28.3	Very low	31.9	Very low	123 Å²	123	130.8 Å²	130.8	75%	0.745	80%	0.803	S	S	*	*			trans	-68.8	116	169.3	174.2	0	0	0	0	108	A279 I283	A279-V281 PolarHBondContact O-N 2.94Å; V281-I283 HydrophobicContact CG1-CG1 4.11Å
282	A	30.6	Very low	32.2	Very low	98 Å²	98	131.6 Å²	131.6	81%	0.81	81%	0.808	S	S	*	*			trans	-103.3	112.8	161.9	0	0	0	0	0	108	A280	A280-A282 PolarHBondContact O-N 2.69Å
283	I	30.5	Very low	32.8	Very low	155 Å²	155	126.3 Å²	126.3	80%	0.795	79%	0.785	S	S	*	*			trans	-69.1	127.7	176	-64.4	171.5	0	0	0	108.5	V281	V281-I283 HydrophobicContact CG1-CG1 4.11Å
284	A	27.1	Very low	33.3	Very low	89 Å²	89	124 Å²	124	74%	0.736	77%	0.766	S	S	*	*			trans	-71.8	142.6	176.1	0	0	0	0	0	111.7
285	T	29.6	Very low	33.8	Very low	139 Å²	139	121.6 Å²	121.6	85%	0.853	75%	0.747	S	S	*	*			trans	-125	115.9	149.2	52.4	0	0	0	0	107.2
286	A	27.4	Very low	34.8	Very low	106 Å²	106	112 Å²	112	88%	0.876	72%	0.715	S	S	*	*			trans	-57.4	133.3	179.2	0	0	0	0	0	111.9
287	A	31.5	Very low	36.1	Very low	85 Å²	85	108.8 Å²	108.8	70%	0.702	69%	0.69	S	S	*	*			trans	-157.8	109.4	152.6	0	0	0	0	0	107.2	T289	A287-T289 PolarHBondContact O-N 3.48Å; A287-T289 VanDerWaalsContact O-N 3.07Å
288	D	28.5	Very low	37	Very low	171 Å²	171	100.3 Å²	100.3	91%	0.914	66%	0.655	S	S	*	*			trans	-51.3	110.7	173.4	-67.1	-45.3	0	0	0	110.3
289	T	35.3	Very low	38.2	Very low	120 Å²	120	94 Å²	94	74%	0.736	61%	0.614	S	S	*	*			trans	-159.4	124.8	159.9	19.9	0	0	0	0	107.2	A287 S291	A287-T289 PolarHBondContact O-N 3.48Å; A287-T289 VanDerWaalsContact O-N 3.07Å; T289-S291 VanDerWaalsContact C-N 3.31Å; T289-S291 PolarHBondContact O-N 3.33Å
290	E	32.6	Very low	39.2	Very low	204 Å²	204	93.1 Å²	93.1	95%	0.953	60%	0.597	S	S	*	*			trans	-53.3	96.6	168.2	-72.8	178.1	131.5	0	0	108.9
291	S	38.3	Very low	40.1	Very low	100 Å²	100	91.2 Å²	91.2	70%	0.699	57%	0.572	S	S	*	*			trans	-92.7	111.3	179.6	-175.8	0	0	0	0	108	T289 A293	T289-S291 VanDerWaalsContact C-N 3.31Å; T289-S291 PolarHBondContact O-N 3.33Å; S291-A293 VanDerWaalsContact C-N 3.27Å; S291-A293 PolarHBondContact O-N 3.04Å
292	C	38.1	Very low	41.1	Very low	116 Å²	116	89.5 Å²	89.5	78%	0.784	57%	0.565	S	S	*	*			trans	-56.5	95	160.4	-82	0	0	0	0	108.5	L294	C292-L294 PolarHBondContact O-N 3.11Å
293	A	45.2	Very low	41.9	Very low	45 Å²	45	88.6 Å²	88.6	37%	0.372	57%	0.566	S	S	.	*			trans	-65.1	108.4	179.6	0	0	0	0	0	109.2	P261 S291	P261-A293 HydrophobicContact CB-CB 4.21Å; P261-A293 HydrophobicContact CG-CB 3.92Å; S291-A293 VanDerWaalsContact C-N 3.27Å; S291-A293 PolarHBondContact O-N 3.04Å
294	L	46	Very low	42.3	Very low	81 Å²	81	83.1 Å²	83.1	42%	0.424	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-69.4	143.6	176.4	-66.2	174.8	0	0	0	109.8	P261 C292 V296 M311	P261-L294 WeakPolarHBondContact CD-O 3.38Å; C292-L294 PolarHBondContact O-N 3.11Å; L294-V296 PolarHBondContact O-N 3.31Å; L294-M311 HydrophobicContact CD1-CB 4.35Å; L294-M311 HydrophobicContact CD1-SD 4.14Å
295	P	46.8	Very low	42.8	Very low	59 Å²	59	83.5 Å²	83.5	38%	0.383	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-62.3	135.2	174.6	26.4	-32.3	0	0	0	110	Y260	Y260-P295 HydrophobicContact CD1-CB 4.27Å; Y260-P295 HydrophobicContact CD2-CB 4.48Å; Y260-P295 HydrophobicContact CE1-CB 4.01Å; Y260-P295 HydrophobicContact CE1-CG 4.14Å; Y260-P295 HydrophobicContact CE2-CB 4.21Å
296	V	52.9	Low	43.3	Very low	37 Å²	37	85.9 Å²	85.9	22%	0.224	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.8	176.8	-179.5	0	0	0	0	108.5	F258 H259 P261 L294 V298	F258-V296 WeakPolarHBondContact CA-O 3.42Å; H259-V296 PolarHBondContact N-O 2.95Å; H259-V296 PolarHBondContact O-N 2.97Å; P261-V296 HydrophobicContact CG-CG2 4.3Å; L294-V296 PolarHBondContact O-N 3.31Å; V296-V298 HydrophobicContact CG1-CG2 4.44Å; V296-V298 PolarHBondContact O-N 3.4Å
297	M	58.5	Low	43.8	Very low	31 Å²	31	84.9 Å²	84.9	15%	0.153	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	119.9	168	-172.3	-171	-60.1	0	0	108.7	R242 F256 S257 F258	R242-M297 HydrophobicContact CB-CE 3.48Å; R242-M297 VanDerWaalsContact CB-CE 3.48Å; R242-M297 HydrophobicContact CG-CE 4.07Å; F256-M297 HydrophobicContact CD1-SD 4.1Å; S257-M297 CarbonylContact O-C 3.55Å; S257-M297 WeakPolarHBondContact O-CA 3.23Å; F258-M297 HydrophobicContact CD1-CB 4.2Å; F258-M297 HydrophobicContact CE1-CB 3.92Å; F258-M297 HydrophobicContact CE1-CE 3.66Å; F258-M297 HydrophobicContact CE1-CG 4.09Å; F258-M297 HydrophobicContact CZ-CE 3.55Å; F258-M297 HydrophobicContact CZ-CG 4.27Å
298	V	53.4	Low	44.4	Very low	21 Å²	21	83.3 Å²	83.3	13%	0.127	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.7	174	-177.2	0	0	0	0	108	S257 V296 L300 V305	S257-V298 PolarHBondContact N-O 3.17Å; S257-V298 PolarHBondContact O-N 3.07Å; V296-V298 HydrophobicContact CG1-CG2 4.44Å; V296-V298 PolarHBondContact O-N 3.4Å; V298-L300 HydrophobicContact CG1-CD2 3.91Å; V298-L300 HydrophobicContact CG1-CG 4.23Å; V298-V305 HydrophobicContact CG1-CG1 3.96Å
299	V	58.1	Low	44.9	Very low	2 Å²	2	80.2 Å²	80.2	1%	0.012	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	114.8	170.6	-167	0	0	0	0	108.1	H255 F256 R306	H255-V299 WeakPolarHBondContact O-CA 3.35Å; F256-V299 HydrophobicContact CD1-CB 4.33Å; F256-V299 HydrophobicContact CD1-CG1 3.95Å; F256-V299 HydrophobicContact CD1-CG2 3.69Å; F256-V299 HydrophobicContact CE1-CB 4.23Å; F256-V299 HydrophobicContact CE1-CG1 3.5Å; F256-V299 HydrophobicContact CE1-CG2 3.72Å; F256-V299 HydrophobicContact CZ-CG1 4.24Å; V299-R306 PolarHBondContact O-N 3.46Å; V299-R306 VanDerWaalsContact O-N 3.15Å
300	L	53.1	Low	44.7	Very low	66 Å²	66	78.3 Å²	78.3	35%	0.346	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.1	170.7	-54.2	171.8	0	0	0	107.6	W254 H255 V298 V305	W254-L300 WeakPolarHBondContact CA-O 3.47Å; H255-L300 HydrophobicContact CB-CB 4.17Å; H255-L300 PolarHBondContact N-O 3.23Å; H255-L300 PolarHBondContact O-N 2.87Å; V298-L300 HydrophobicContact CG1-CD2 3.91Å; V298-L300 HydrophobicContact CG1-CG 4.23Å; L300-V305 HydrophobicContact CD2-CB 4.01Å; L300-V305 HydrophobicContact CD2-CG1 3.9Å; L300-V305 HydrophobicContact CD2-CG2 3.45Å; L300-V305 VanDerWaalsContact CD2-CG2 3.45Å
301	D	49.9	Very low	44.7	Very low	67 Å²	67	75.4 Å²	75.4	36%	0.358	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	156.6	166.7	-163	-9.1	0	0	0	109.1	N253 G303 G304	N253-D301 VanDerWaalsContact O-CA 3.24Å; N253-D301 WeakPolarHBondContact O-CA 3.22Å; D301-G303 PolarHBondContact O-N 3.05Å; D301-G304 PolarHBondContact N-O 3.4Å; D301-G304 PolarHBondContact O-N 3.01Å
302	S	51	Low	44.4	Very low	87 Å²	87	79.2 Å²	79.2	61%	0.608	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-17.7	171.8	-54.6	0	0	0	0	112.8	N253	N253-S302 PolarHBondContact O-N 3.29Å; N253-S302 PolarHBondContact OD1-OG 2.91Å
303	G	46.5	Very low	44	Very low	80 Å²	80	82.9 Å²	82.9	83%	0.825	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	6	173.5	0	0	0	0	0	116.2	D301	D301-G303 PolarHBondContact O-N 3.05Å
304	G	39	Very low	43.5	Very low	39 Å²	39	86.2 Å²	86.2	40%	0.402	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.6	171.2	177.3	0	0	0	0	0	114.8	D301 R306	D301-G304 PolarHBondContact N-O 3.4Å; D301-G304 PolarHBondContact O-N 3.01Å; G304-R306 PolarHBondContact O-N 3.27Å
305	V	36.7	Very low	42.7	Very low	97 Å²	97	86.6 Å²	86.6	59%	0.588	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	119.3	176.7	-173	0	0	0	0	109.1	V298 L300	V298-V305 HydrophobicContact CG1-CG1 3.96Å; L300-V305 HydrophobicContact CD2-CB 4.01Å; L300-V305 HydrophobicContact CD2-CG1 3.9Å; L300-V305 HydrophobicContact CD2-CG2 3.45Å; L300-V305 VanDerWaalsContact CD2-CG2 3.45Å
306	R	41.6	Very low	41.7	Very low	189 Å²	189	92.5 Å²	92.5	71%	0.713	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	99.1	164.9	-159.5	178.1	-71.8	-164	-0.5	107.7	V299 G304 S308	V299-R306 PolarHBondContact O-N 3.46Å; V299-R306 VanDerWaalsContact O-N 3.15Å; G304-R306 PolarHBondContact O-N 3.27Å; R306-S308 PolarHBondContact O-N 3.02Å
307	C	37.8	Very low	40.6	Very low	85 Å²	85	99.3 Å²	99.3	57%	0.574	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-69.5	113.4	171	-69.5	0	0	0	0	108.6	S309	C307-S309 PolarHBondContact O-N 3.35Å
308	S	42.6	Very low	39	Very low	53 Å²	53	104.2 Å²	104.2	37%	0.371	60%	0.6	S	S	.	*			trans	-81.8	105.1	170.2	-64.7	0	0	0	0	108.5	R306	R306-S308 PolarHBondContact O-N 3.02Å
309	S	39.1	Very low	37.6	Very low	106 Å²	106	108.6 Å²	108.6	74%	0.741	63%	0.627	S	S	*	*			trans	29.5	113.6	164.9	42.4	0	0	0	0	118.9	C307 M311	C307-S309 PolarHBondContact O-N 3.35Å; S309-M311 PolarHBondContact O-N 2.95Å
310	S	32.7	Very low	36	Very low	79 Å²	79	113.8 Å²	113.8	55%	0.552	66%	0.663	S	S	*	*			trans	-53	129	150.3	-175.3	0	0	0	0	109	K312	S310-K312 VanDerWaalsContact C-N 3.29Å; S310-K312 PolarHBondContact O-N 3Å
311	M	30.8	Very low	34.9	Very low	144 Å²	144	118.2 Å²	118.2	71%	0.709	69%	0.686	S	S	*	*			trans	-62	92.9	169.3	-73.3	177	91.6	0	0	108.8	L294 S309	L294-M311 HydrophobicContact CD1-CB 4.35Å; L294-M311 HydrophobicContact CD1-SD 4.14Å; S309-M311 PolarHBondContact O-N 2.95Å
312	K	32.1	Very low	33.8	Very low	179 Å²	179	120.8 Å²	120.8	78%	0.778	71%	0.707	S	S	*	*			trans	-119.7	122.6	162.7	-71.2	-172.7	178.2	-176.3	0	106.5	S310	S310-K312 VanDerWaalsContact C-N 3.29Å; S310-K312 PolarHBondContact O-N 3Å
313	H	29.3	Very low	32.5	Very low	194 Å²	194	128 Å²	128	90%	0.898	72%	0.721	S	S	*	*			trans	-44.2	137.1	174.8	-99.5	-88.8	0	0	0	111.2
314	P	34.7	Very low	31.6	Very low	115 Å²	115	128.8 Å²	128.8	75%	0.747	72%	0.72	S	S	*	*			trans	-107.9	112.3	154.7	22.7	-5.8	0	0	0	108.9
315	A	30.3	Very low	31.1	Very low	88 Å²	88	135.7 Å²	135.7	73%	0.727	74%	0.735	S	S	*	*			trans	-57.4	135.6	148.7	0	0	0	0	0	108.4
316	Q	25.6	Very low	30.9	Very low	184 Å²	184	136.1 Å²	136.1	86%	0.86	74%	0.742	S	S	*	*			trans	49.3	91.4	157.1	-64.9	-175.5	-33.2	0	0	116.9
317	L	28.9	Very low	30.1	Very low	180 Å²	180	131.8 Å²	131.8	94%	0.942	74%	0.741	S	S	*	*			trans	-150.4	146.9	134.7	-106.3	142.8	0	0	0	109.9
318	D	25.4	Very low	29.9	Very low	134 Å²	134	132.1 Å²	132.1	72%	0.717	74%	0.742	S	S	*	*			trans	-76.4	147.7	-152.3	-145	-28.6	0	0	0	113
319	T	25	Very low	29.2	Very low	112 Å²	112	133.3 Å²	133.3	69%	0.687	75%	0.747	S	S	*	*	S	Bend	trans	47.4	115.4	153.5	32.9	0	0	0	0	121.9
320	S	24.3	Very low	28.7	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	74%	0.738	S	S	*	*			trans	93.2	42.7	141.2	78.5	0	0	0	0	121.6
321	I	28.6	Very low	28.5	Very low	159 Å²	159	135.5 Å²	135.5	82%	0.815	74%	0.735	S	S	*	*	S	Bend	trans	-140.2	119.2	156.2	-80	112.5	0	0	0	110.9
322	C	26.9	Very low	28.3	Very low	121 Å²	121	136 Å²	136	82%	0.818	73%	0.73	S	S	*	*			trans	36.7	84	157.2	-57.3	0	0	0	0	118.7	A324	C322-A324 PolarHBondContact O-N 3.14Å; C322-A324 VanDerWaalsContact O-N 3.13Å
323	R	23.7	Very low	28.3	Very low	238 Å²	238	132 Å²	132	90%	0.898	72%	0.722	S	S	*	*			trans	-71	94.2	152.8	-84.7	-178.5	175.5	162.3	-2.1	109.3	Y325	R323-Y325 HydrophobicContact CG-CE2 4.49Å
324	A	29.5	Very low	28.3	Very low	96 Å²	96	128 Å²	128	79%	0.793	71%	0.714	S	S	*	*			trans	-112.5	87.3	157.4	0	0	0	0	0	108	C322 S326	C322-A324 PolarHBondContact O-N 3.14Å; C322-A324 VanDerWaalsContact O-N 3.13Å; A324-S326 PolarHBondContact O-N 3.32Å
325	Y	27.4	Very low	27.8	Very low	185 Å²	185	130.6 Å²	130.6	73%	0.725	72%	0.721	S	S	*	*			trans	-75.4	102.8	165.3	-90.3	-96.4	0	0	0	108.1	R323	R323-Y325 HydrophobicContact CG-CE2 4.49Å
326	S	31.9	Very low	27.7	Very low	105 Å²	105	135.8 Å²	135.8	73%	0.734	73%	0.727	S	S	*	*			trans	-134.4	109.4	151.2	-86.9	0	0	0	0	106.5	A324	A324-S326 PolarHBondContact O-N 3.32Å
327	S	25.9	Very low	27.6	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	72%	0.721	S	S	*	*			trans	-47.6	140.7	174.4	-84.2	0	0	0	0	110.8	V329	S327-V329 PolarHBondContact O-N 3.42Å; S327-V329 VanDerWaalsContact O-N 3.11Å
328	P	32.4	Very low	27.6	Very low	92 Å²	92	130.9 Å²	130.9	60%	0.597	72%	0.718	S	S	*	*			trans	-63.6	118.3	171.7	26.7	-30.3	0	0	0	108.2	Q330	P328-Q330 PolarHBondContact O-N 3.23Å
329	V	29.7	Very low	27.5	Very low	78 Å²	78	130.1 Å²	130.1	47%	0.473	72%	0.724	S	S	.	*			trans	-64.8	105.1	165.1	-176.6	0	0	0	0	106.4	S327 F331	S327-V329 PolarHBondContact O-N 3.42Å; S327-V329 VanDerWaalsContact O-N 3.11Å; V329-F331 HydrophobicContact CB-CD2 4.21Å; V329-F331 HydrophobicContact CB-CE2 4.1Å; V329-F331 HydrophobicContact CG1-CD2 3.57Å; V329-F331 HydrophobicContact CG1-CE2 3.28Å; V329-F331 HydrophobicContact CG1-CZ 4.01Å; V329-F331 PolarHBondContact O-N 3.41Å
330	Q	26.8	Very low	27.7	Very low	118 Å²	118	129.9 Å²	129.9	55%	0.551	73%	0.733	S	S	*	*			trans	-66.8	99.3	173.2	-82.9	-175.4	-18.8	0	0	109.1	P328 Y332	P328-Q330 PolarHBondContact O-N 3.23Å; Q330-Y332 HydrophobicContact CB-CE2 4.09Å; Q330-Y332 PolarHBondContact OE1-OH 3.05Å
331	F	30.3	Very low	27.6	Very low	112 Å²	112	129.5 Å²	129.5	49%	0.491	73%	0.731	S	S	.	*			trans	-96.5	108.1	162.6	-80.5	-78.9	0	0	0	108.7	V329	V329-F331 HydrophobicContact CB-CD2 4.21Å; V329-F331 HydrophobicContact CB-CE2 4.1Å; V329-F331 HydrophobicContact CG1-CD2 3.57Å; V329-F331 HydrophobicContact CG1-CE2 3.28Å; V329-F331 HydrophobicContact CG1-CZ 4.01Å; V329-F331 PolarHBondContact O-N 3.41Å
332	Y	26.3	Very low	27.5	Very low	155 Å²	155	130.5 Å²	130.5	61%	0.608	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-77.1	125.7	168.2	-65.6	-88.2	0	0	0	109.3	Q330	Q330-Y332 HydrophobicContact CB-CE2 4.09Å; Q330-Y332 PolarHBondContact OE1-OH 3.05Å
333	P	30.5	Very low	27.5	Very low	94 Å²	94	128.7 Å²	128.7	61%	0.61	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-75.4	143.3	166.7	30.3	-31.2	0	0	0	110.1	L335	P333-L335 PolarHBondContact O-N 3.23Å
334	P	29.3	Very low	27.5	Very low	111 Å²	111	126.2 Å²	126.2	72%	0.721	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-70.1	126.3	169	28.7	-29.5	0	0	0	109.1	F336	P334-F336 PolarHBondContact O-N 3.43Å
335	L	25.1	Very low	27.4	Very low	170 Å²	170	128.7 Å²	128.7	89%	0.89	74%	0.741	S	S	*	*			trans	-62.9	108.6	166.7	-73.3	161.5	0	0	0	108.7	P333	P333-L335 PolarHBondContact O-N 3.23Å
336	F	28.2	Very low	27.3	Very low	197 Å²	197	123.1 Å²	123.1	86%	0.864	74%	0.74	S	S	*	*			trans	-140	106	153.7	-98.1	-82.3	0	0	0	107.5	P334	P334-F336 PolarHBondContact O-N 3.43Å
337	G	24.3	Very low	26.9	Very low	71 Å²	71	124 Å²	124	73%	0.732	75%	0.745	S	S	*	*			trans	-80.9	137.1	163.7	0	0	0	0	0	108.8
338	E	27.6	Very low	26.9	Very low	189 Å²	189	125 Å²	125	88%	0.883	75%	0.751	S	S	*	*			trans	-153.1	123.9	142.6	-116.8	172	143.9	0	0	108.8
339	S	24.9	Very low	26.6	Very low	119 Å²	119	127.8 Å²	127.8	83%	0.832	76%	0.757	S	S	*	*			trans	-62.8	132.5	173.6	40.7	0	0	0	0	111.9
340	A	27.2	Very low	26.4	Very low	107 Å²	107	131.4 Å²	131.4	88%	0.884	77%	0.768	S	S	*	*			trans	-142.9	112.6	155.6	0	0	0	0	0	109.8
341	S	23.5	Very low	26.3	Very low	104 Å²	104	136.8 Å²	136.8	73%	0.727	78%	0.784	S	S	*	*			trans	-92.8	149.3	177.4	54.6	0	0	0	0	112.1
342	L	26.1	Very low	26.3	Very low	180 Å²	180	138 Å²	138	94%	0.942	79%	0.789	S	S	*	*			trans	72.8	128.8	149.6	-69.9	156.8	0	0	0	119.5
343	G	26.4	Very low	26.2	Very low	82 Å²	82	139.7 Å²	139.7	85%	0.845	79%	0.794	S	S	*	*			trans	166.7	98.1	159.7	0	0	0	0	0	113.8
344	H	23.7	Very low	26.2	Very low	186 Å²	186	146 Å²	146	86%	0.861	81%	0.806	S	S	*	*			trans	-93.3	112	-171.6	179.4	-67.2	0	0	0	112.4
345	V	28.4	Very low	25.9	Very low	148 Å²	148	149.7 Å²	149.7	90%	0.897	81%	0.805	S	S	*	*			trans	-162.1	136.5	160	-170	0	0	0	0	106.1
346	G	25.8	Very low	26.2	Very low	68 Å²	68	144.8 Å²	144.8	70%	0.701	80%	0.796	S	S	*	*			cis	151.6	128.1	15.2	0	0	0	0	0	105.1
347	C	21.9	Very low	26.3	Very low	125 Å²	125	142.2 Å²	142.2	85%	0.845	79%	0.79	S	S	*	*			trans	-70.9	146.7	-167.7	-164.3	0	0	0	0	113.9
348	S	26.9	Very low	26.8	Very low	118 Å²	118	147 Å²	147	83%	0.825	79%	0.793	S	S	*	*			trans	-161.7	108.6	137	-153.9	0	0	0	0	113.9
349	H	26.3	Very low	27.4	Very low	152 Å²	152	140 Å²	140	70%	0.704	76%	0.763	S	S	*	*			trans	16.6	115.6	136.5	-110.8	-127.8	0	0	0	120.2
350	E	25.6	Very low	28.4	Very low	154 Å²	154	136.4 Å²	136.4	72%	0.72	74%	0.738	S	S	*	*			trans	-150.7	93.5	137	-113.4	-160.9	143.4	0	0	110.5	K352	E350-K352 PolarHBondContact O-N 2.9Å; E350-K352 WeakPolarHBondContact OE1-CE 3.25Å; E350-K352 IonicContact OE1-NZ 3.91Å; E350-K352 PolarHBondContact OE1-NZ 3.25Å; E350-K352 IonicContact OE2-NZ 3.41Å
351	R	24.5	Very low	29.3	Very low	231 Å²	231	137.8 Å²	137.8	87%	0.872	73%	0.726	S	S	*	*			trans	-85.2	100.2	163.9	-81.6	-176.1	-172.1	168.9	3.6	108.7	R353	R351-R353 PolarHBondContact O-N 3.5Å
352	K	30.2	Very low	30.6	Very low	138 Å²	138	139.5 Å²	139.5	60%	0.6	72%	0.723	S	S	*	*			trans	-89.5	101.9	163.2	-81.3	177.3	-178.7	138.3	0	110.2	E350 W354	E350-K352 PolarHBondContact O-N 2.9Å; E350-K352 WeakPolarHBondContact OE1-CE 3.25Å; E350-K352 IonicContact OE1-NZ 3.91Å; E350-K352 PolarHBondContact OE1-NZ 3.25Å; E350-K352 IonicContact OE2-NZ 3.41Å; K352-W354 PolarHBondContact O-N 2.97Å
353	R	23.9	Very low	31.2	Very low	190 Å²	190	133.2 Å²	133.2	72%	0.717	69%	0.69	S	S	*	*			trans	-67.5	103.7	170.4	-178.9	-174.8	-164.9	175.4	10.9	109.5	R351 R355	R351-R353 PolarHBondContact O-N 3.5Å; R353-R355 VanDerWaalsContact CZ-NH1 3.26Å; R353-R355 VanDerWaalsContact CZ-NH2 3.3Å; R353-R355 PolarHBondContact O-N 3.03Å
354	W	29.5	Very low	32	Very low	227 Å²	227	131.3 Å²	131.3	86%	0.86	66%	0.662	S	S	*	*			trans	-87.2	105.4	169.6	-70.7	94.2	0	0	0	110.2	K352	K352-W354 PolarHBondContact O-N 2.97Å
355	R	24.9	Very low	33.2	Very low	187 Å²	187	128.2 Å²	128.2	71%	0.706	65%	0.646	S	S	*	*			trans	-102.2	130.4	158	-82.9	-169.8	-74	-138.8	0	107.6	R353	R353-R355 VanDerWaalsContact CZ-NH1 3.26Å; R353-R355 VanDerWaalsContact CZ-NH2 3.3Å; R353-R355 PolarHBondContact O-N 3.03Å
356	G	31.3	Very low	33.9	Very low	67 Å²	67	125.5 Å²	125.5	69%	0.691	63%	0.626	S	S	*	*	S	Bend	trans	113.5	108.9	172.7	0	0	0	0	0	112.6	H358	G356-H358 PolarHBondContact O-N 3.24Å
357	L	29.2	Very low	34.6	Very low	144 Å²	144	122.4 Å²	122.4	75%	0.754	59%	0.593	S	S	*	*			trans	-63.8	95.7	167.2	-101.1	80.2	0	0	0	108.6
358	H	36.1	Very low	35.4	Very low	171 Å²	171	121.8 Å²	121.8	79%	0.792	58%	0.576	S	S	*	*			trans	-110	122.1	156.9	-136.8	-93.1	0	0	0	107	R213 G356	R213-H358 PolarHBondContact NH1-O 3.45Å; G356-H358 PolarHBondContact O-N 3.24Å
359	V	39.5	Very low	36.3	Very low	41 Å²	41	120.1 Å²	120.1	25%	0.248	56%	0.564	C	S	.	*			trans	-87.7	111.3	174	173	0	0	0	0	106.9	L206 V209 R213 V364	L206-V359 HydrophobicContact CD1-CB 4.43Å; L206-V359 HydrophobicContact CD1-CG2 4Å; V209-V359 HydrophobicContact CG1-CG1 3.77Å; V209-V359 HydrophobicContact CG1-CG2 4.46Å; R213-V359 VanDerWaalsContact NH2-CA 3.26Å; V359-V364 HydrophobicContact CG1-CG2 4.2Å
360	S	45.6	Very low	36.8	Very low	44 Å²	44	114 Å²	114	31%	0.308	54%	0.542	S	S	.	.			trans	-80.2	157.4	178	75.2	0	0	0	0	110.8	E362 D363 V364	S360-E362 PolarHBondContact O-N 3.14Å; S360-E362 PolarHBondContact OG-N 3.14Å; S360-D363 WeakPolarHBondContact CB-OD2 3.39Å; S360-D363 PolarHBondContact N-OD2 3.34Å; S360-D363 WeakPolarHBondContact O-CB 3.48Å; S360-D363 PolarHBondContact O-N 3.05Å; S360-D363 VanDerWaalsContact O-N 3.1Å; S360-D363 PolarHBondContact OG-N 3.38Å; S360-D363 PolarHBondContact OG-OD2 2.86Å; S360-V364 PolarHBondContact O-N 3.37Å
361	E	47.1	Very low	37.4	Very low	136 Å²	136	107.6 Å²	107.6	64%	0.636	51%	0.514	S	S	*	.	H	α-helix	trans	-60.9	-28.2	172.7	-163.2	-168.6	135.2	0	0	111.9	D363 V364 K365	E361-D363 VanDerWaalsContact C-N 3.32Å; E361-D363 PolarHBondContact O-N 3.14Å; E361-V364 PolarHBondContact O-N 3.07Å; E361-K365 WeakPolarHBondContact O-CG 3.08Å; E361-K365 PolarHBondContact O-N 3.24Å; E361-K365 WeakPolarHBondContact OE1-CE 3.5Å; E361-K365 IonicContact OE1-NZ 3.33Å; E361-K365 PolarHBondContact OE1-NZ 3.15Å
362	E	48.8	Very low	37.8	Very low	141 Å²	141	101.5 Å²	101.5	66%	0.659	51%	0.505	S	S	*	.	H	α-helix	trans	-64.6	-37.8	174.6	-60.9	-168.1	143.4	0	0	111.6	S360 V364 K365 L366	S360-E362 PolarHBondContact O-N 3.14Å; S360-E362 PolarHBondContact OG-N 3.14Å; E362-V364 VanDerWaalsContact C-N 3.29Å; E362-V364 PolarHBondContact O-N 2.76Å; E362-K365 WeakPolarHBondContact O-CB 3.37Å; E362-K365 PolarHBondContact O-N 3.48Å; E362-K365 VanDerWaalsContact O-N 3.14Å; E362-L366 WeakPolarHBondContact O-CB 3.46Å; E362-L366 PolarHBondContact O-N 2.81Å
363	D	39.9	Very low	38.1	Very low	48 Å²	48	98.8 Å²	98.8	26%	0.257	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-34.7	176.8	-60.9	-62.5	0	0	0	111.7	R213 S360 E361 W367	R213-D363 IonicContact CZ-OD2 3.6Å; R213-D363 IonicContact NH2-OD1 3.41Å; R213-D363 IonicContact NH2-OD2 3.62Å; R213-D363 PolarHBondContact NH2-OD2 2.81Å; S360-D363 WeakPolarHBondContact CB-OD2 3.39Å; S360-D363 PolarHBondContact N-OD2 3.34Å; S360-D363 WeakPolarHBondContact O-CB 3.48Å; S360-D363 PolarHBondContact O-N 3.05Å; S360-D363 VanDerWaalsContact O-N 3.1Å; S360-D363 PolarHBondContact OG-N 3.38Å; S360-D363 PolarHBondContact OG-OD2 2.86Å; E361-D363 VanDerWaalsContact C-N 3.32Å; E361-D363 PolarHBondContact O-N 3.14Å; D363-W367 VanDerWaalsContact O-CB 3.23Å; D363-W367 WeakPolarHBondContact O-CB 3.48Å; D363-W367 PolarHBondContact O-N 2.98Å
364	V	43.3	Very low	38.7	Very low	41 Å²	41	93.6 Å²	93.6	25%	0.248	48%	0.478	C	S	.	.	H	α-helix	trans	-69.3	-37.4	173.1	-179.2	0	0	0	0	110.7	V359 S360 E361 E362 W367 K368	V359-V364 HydrophobicContact CG1-CG2 4.2Å; S360-V364 PolarHBondContact O-N 3.37Å; E361-V364 PolarHBondContact O-N 3.07Å; E362-V364 VanDerWaalsContact C-N 3.29Å; E362-V364 PolarHBondContact O-N 2.76Å; V364-W367 PolarHBondContact O-N 3.05Å; V364-K368 WeakPolarHBondContact O-CB 3.48Å; V364-K368 WeakPolarHBondContact O-CG 3.5Å; V364-K368 PolarHBondContact O-N 3.37Å
365	K	49.3	Very low	39.2	Very low	121 Å²	121	86.9 Å²	86.9	53%	0.526	46%	0.458	S	S	.	.	H	α-helix	trans	-67	-44.3	174.8	-74.1	172.3	-175.5	160.2	0	111.9	E361 E362 W367 K368 C369	E361-K365 WeakPolarHBondContact O-CG 3.08Å; E361-K365 PolarHBondContact O-N 3.24Å; E361-K365 WeakPolarHBondContact OE1-CE 3.5Å; E361-K365 IonicContact OE1-NZ 3.33Å; E361-K365 PolarHBondContact OE1-NZ 3.15Å; E362-K365 WeakPolarHBondContact O-CB 3.37Å; E362-K365 PolarHBondContact O-N 3.48Å; E362-K365 VanDerWaalsContact O-N 3.14Å; K365-W367 VanDerWaalsContact C-N 3.34Å; K365-K368 PolarHBondContact O-N 2.95Å; K365-C369 WeakPolarHBondContact O-CB 3.42Å; K365-C369 PolarHBondContact O-N 3.2Å
366	L	43	Very low	39.9	Very low	91 Å²	91	81.6 Å²	81.6	48%	0.476	45%	0.445	S	S	.	.	H	α-helix	trans	-59.6	-44.8	173.4	-96	142.7	0	0	0	111.2	E362 C369 G370	E362-L366 WeakPolarHBondContact O-CB 3.46Å; E362-L366 PolarHBondContact O-N 2.81Å; L366-C369 PolarHBondContact O-N 3.29Å; L366-G370 PolarHBondContact O-N 2.84Å
367	W	40	Very low	40.4	Very low	3 Å²	3	82.4 Å²	82.4	1%	0.011	43%	0.432	C	S	.	.	H	α-helix	trans	-66	-40.7	176.9	179.6	73	0	0	0	112.9	H199 A204 D208 F212 D363 V364 K365 G370 S371	H199-W367 HydrophobicContact CB-CZ2 4.42Å; H199-W367 AromaticContact CD2-CH2 2.98Å; H199-W367 WeakPolarHBondContact CD2-CH2 3.5Å; H199-W367 AromaticContact CD2-CZ2 3.16Å; H199-W367 WeakPolarHBondContact CD2-CZ2 3.37Å; H199-W367 AromaticContact CG-CH2 3.7Å; H199-W367 AromaticContact CG-CZ2 3.95Å; H199-W367 AromaticContact NE2-CH2 3.21Å; H199-W367 WeakPolarHBondContact NE2-CH2 3.32Å; H199-W367 AromaticContact NE2-CZ2 3.83Å; H199-W367 AromaticContact NE2-CZ3 3.85Å; A204-W367 HydrophobicContact CB-CE3 4.08Å; A204-W367 HydrophobicContact CB-CH2 3.2Å; A204-W367 HydrophobicContact CB-CZ2 4.36Å; A204-W367 HydrophobicContact CB-CZ3 3.08Å; D208-W367 HydrophobicContact CB-CH2 4.42Å; D208-W367 HydrophobicContact CB-CZ2 3.79Å; F212-W367 VanDerWaalsContact CB-CD1 3.47Å; F212-W367 HydrophobicContact CD1-CB 4.19Å; F212-W367 AromaticContact CD1-CD1 3.43Å; F212-W367 VanDerWaalsContact CD1-CD1 3.43Å; F212-W367 HydrophobicContact CD1-CG 4.13Å; F212-W367 AromaticContact CD2-CD1 3.67Å; F212-W367 HydrophobicContact CE1-CB 4.21Å; F212-W367 AromaticContact CG-CD1 3.22Å; F212-W367 HydrophobicContact CG-CG 4.3Å; F212-W367 AromaticContact CG-NE1 3.81Å; D363-W367 VanDerWaalsContact O-CB 3.23Å; D363-W367 WeakPolarHBondContact O-CB 3.48Å; D363-W367 PolarHBondContact O-N 2.98Å; V364-W367 PolarHBondContact O-N 3.05Å; K365-W367 VanDerWaalsContact C-N 3.34Å; W367-G370 PolarHBondContact O-N 2.87Å; W367-S371 VanDerWaalsContact O-CB 3.23Å; W367-S371 WeakPolarHBondContact O-CB 3.36Å; W367-S371 PolarHBondContact O-N 3.45Å; W367-S371 PolarHBondContact O-OG 3.36Å
368	K	38	Very low	41	Very low	112 Å²	112	78.8 Å²	78.8	49%	0.487	41%	0.413	S	S	.	.	H	α-helix	trans	-64.2	-43.7	172.1	-77.9	-177.5	179.7	-179.6	0	111.3	V364 K365 G370 S371 C372	V364-K368 WeakPolarHBondContact O-CB 3.48Å; V364-K368 WeakPolarHBondContact O-CG 3.5Å; V364-K368 PolarHBondContact O-N 3.37Å; K365-K368 PolarHBondContact O-N 2.95Å; K368-G370 VanDerWaalsContact C-N 3.29Å; K368-G370 PolarHBondContact O-N 3.1Å; K368-S371 PolarHBondContact O-N 3.09Å; K368-C372 WeakPolarHBondContact O-CA 3.5Å; K368-C372 WeakPolarHBondContact O-CB 3.45Å; K368-C372 PolarHBondContact O-N 3.17Å; K368-C372 PolarHBondContact O-SG 2.79Å
369	C	46.2	Very low	41.4	Very low	84 Å²	84	73.1 Å²	73.1	57%	0.568	39%	0.389	S	S	*	.	H	α-helix	trans	-62.9	-39.1	178.2	-165.3	0	0	0	0	111.7	K365 L366	K365-C369 WeakPolarHBondContact O-CB 3.42Å; K365-C369 PolarHBondContact O-N 3.2Å; L366-C369 PolarHBondContact O-N 3.29Å
370	G	37.5	Very low	41.5	Very low	24 Å²	24	75.2 Å²	75.2	25%	0.247	40%	0.399	C	S	.	.	H	α-helix	trans	-65.9	-46.3	173.1	0	0	0	0	0	111.9	L366 W367 K368 F374	L366-G370 PolarHBondContact O-N 2.84Å; W367-G370 PolarHBondContact O-N 2.87Å; K368-G370 VanDerWaalsContact C-N 3.29Å; K368-G370 PolarHBondContact O-N 3.1Å; G370-F374 WeakPolarHBondContact O-CD2 3.34Å; G370-F374 WeakPolarHBondContact O-CE2 3.34Å
371	S	37.7	Very low	41.2	Very low	18 Å²	18	77.4 Å²	77.4	13%	0.126	41%	0.405	C	S	.	.	H	α-helix	trans	-78.4	-26.9	-174.4	-55.2	0	0	0	0	113.9	W367 K368 E373	W367-S371 VanDerWaalsContact O-CB 3.23Å; W367-S371 WeakPolarHBondContact O-CB 3.36Å; W367-S371 PolarHBondContact O-N 3.45Å; W367-S371 PolarHBondContact O-OG 3.36Å; K368-S371 PolarHBondContact O-N 3.09Å; S371-E373 VanDerWaalsContact C-N 3.34Å; S371-E373 PolarHBondContact O-N 2.93Å
372	C	33.8	Very low	40.7	Very low	103 Å²	103	72.9 Å²	72.9	70%	0.696	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-2.8	-177.1	-67.3	0	0	0	0	114.3	K368	K368-C372 WeakPolarHBondContact O-CA 3.5Å; K368-C372 WeakPolarHBondContact O-CB 3.45Å; K368-C372 PolarHBondContact O-N 3.17Å; K368-C372 PolarHBondContact O-SG 2.79Å
373	E	36.7	Very low	40.1	Very low	82 Å²	82	67.3 Å²	67.3	38%	0.383	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	11.8	172	-69.2	-162.3	147.6	0	0	114.2	P75 S371	P75-E373 WeakPolarHBondContact CB-OE1 3.17Å; P75-E373 WeakPolarHBondContact CG-OE1 3.38Å; S371-E373 VanDerWaalsContact C-N 3.34Å; S371-E373 PolarHBondContact O-N 2.93Å
374	F	35.4	Very low	40.1	Very low	80 Å²	80	69 Å²	69	35%	0.351	38%	0.375	S	S	.	.			trans	-107.2	0	-174.6	-73.9	-69.8	0	0	0	116.7	K114 P191 S192 G370	K114-F374 PolarHBondContact NZ-OXT 2.98Å; P191-F374 HydrophobicContact CB-CD2 4.36Å; P191-F374 HydrophobicContact CB-CE2 3.57Å; P191-F374 HydrophobicContact CB-CZ 3.98Å; P191-F374 HydrophobicContact CG-CE2 4.24Å; S192-F374 VanDerWaalsContact OG-CE1 3.25Å; S192-F374 WeakPolarHBondContact OG-CE1 3.4Å; S192-F374 WeakPolarHBondContact OG-CZ 3.46Å; G370-F374 WeakPolarHBondContact O-CD2 3.34Å; G370-F374 WeakPolarHBondContact O-CE2 3.34Å

Retrieved 374 of 374 residues in 469.3 ms (Link to these results)

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