A0A5K4FDE4_SCHMA Loading...

Homeobox domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FDE4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 731 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	40.1	Very low	54.6	Low	184 Å²	184	110.3 Å²	110.3	91%	0.906	59%	0.587	S	S	*	*				0	-53.1	0	-143.1	173.5	87.3	0	0	111.9	T3 A4 N5	M1-T3 VanDerWaalsContact C-N 3.34Å; M1-T3 PolarHBondContact O-N 3.37Å; M1-A4 WeakPolarHBondContact O-CB 3.39Å; M1-A4 PolarHBondContact O-N 3.2Å; M1-A4 VanDerWaalsContact O-N 3.11Å; M1-N5 PolarHBondContact O-N 3.11Å
2	Q	42.4	Very low	54.8	Low	176 Å²	176	106.4 Å²	106.4	82%	0.822	57%	0.574	S	S	*	*	H	α-helix	trans	-58.5	-41	175.5	-71.5	174.9	-13.6	0	0	113.5	A4 N5 Y6	Q2-A4 VanDerWaalsContact C-N 3.34Å; Q2-A4 PolarHBondContact O-N 3.34Å; Q2-N5 PolarHBondContact O-N 3.23Å; Q2-Y6 WeakPolarHBondContact O-CB 3.37Å; Q2-Y6 PolarHBondContact O-N 2.87Å
3	T	47.5	Very low	55.7	Low	106 Å²	106	108.2 Å²	108.2	65%	0.65	57%	0.573	S	S	*	*	H	α-helix	trans	-65	-34.8	174.1	2.9	0	0	0	0	113.1	M1 Y6 L7	M1-T3 VanDerWaalsContact C-N 3.34Å; M1-T3 PolarHBondContact O-N 3.37Å; T3-Y6 PolarHBondContact O-N 3.46Å; T3-L7 VanDerWaalsContact O-CG 3.31Å; T3-L7 WeakPolarHBondContact O-CG 3.42Å; T3-L7 PolarHBondContact O-N 3.24Å
4	A	46.7	Very low	55.7	Low	52 Å²	52	105.7 Å²	105.7	43%	0.43	56%	0.56	S	S	.	*	H	α-helix	trans	-69.7	-45	175.7	0	0	0	0	0	110.6	M1 Q2 Y6 L7 T8	M1-A4 WeakPolarHBondContact O-CB 3.39Å; M1-A4 PolarHBondContact O-N 3.2Å; M1-A4 VanDerWaalsContact O-N 3.11Å; Q2-A4 VanDerWaalsContact C-N 3.34Å; Q2-A4 PolarHBondContact O-N 3.34Å; A4-Y6 VanDerWaalsContact C-N 3.3Å; A4-Y6 PolarHBondContact O-N 3.32Å; A4-L7 PolarHBondContact O-N 2.61Å; A4-T8 PolarHBondContact O-N 3.12Å; A4-T8 PolarHBondContact O-OG1 3Å
5	N	55.7	Low	55.9	Low	100 Å²	100	103.1 Å²	103.1	54%	0.535	55%	0.554	S	S	.	*	H	α-helix	trans	-61.3	-37.7	174.1	-73.5	-2.6	0	0	0	112.2	M1 Q2 T8 D9	M1-N5 PolarHBondContact O-N 3.11Å; Q2-N5 PolarHBondContact O-N 3.23Å; N5-T8 PolarHBondContact O-N 3.34Å; N5-D9 WeakPolarHBondContact O-CB 3.24Å; N5-D9 PolarHBondContact O-N 2.86Å
6	Y	56	Low	55.7	Low	160 Å²	160	104.7 Å²	104.7	63%	0.627	56%	0.557	S	S	*	*	H	α-helix	trans	-67	-38.7	176.6	-164.9	-102.1	0	0	0	112.4	Q2 T3 A4 D9 I10	Q2-Y6 WeakPolarHBondContact O-CB 3.37Å; Q2-Y6 PolarHBondContact O-N 2.87Å; T3-Y6 PolarHBondContact O-N 3.46Å; A4-Y6 VanDerWaalsContact C-N 3.3Å; A4-Y6 PolarHBondContact O-N 3.32Å; Y6-D9 PolarHBondContact O-N 3.11Å; Y6-I10 HydrophobicContact CD1-CD1 3.67Å; Y6-I10 HydrophobicContact CE1-CD1 3.47Å; Y6-I10 VanDerWaalsContact CE1-CD1 3.47Å; Y6-I10 HydrophobicContact CE1-CG1 4.4Å; Y6-I10 WeakPolarHBondContact O-CG1 3.47Å; Y6-I10 PolarHBondContact O-N 3.34Å
7	L	58.9	Low	55	Low	114 Å²	114	105.2 Å²	105.2	60%	0.597	56%	0.559	S	S	*	*	H	α-helix	trans	-70.3	-35.3	174.2	-71	170.5	0	0	0	112.2	T3 A4 I10 S11	T3-L7 VanDerWaalsContact O-CG 3.31Å; T3-L7 WeakPolarHBondContact O-CG 3.42Å; T3-L7 PolarHBondContact O-N 3.24Å; A4-L7 PolarHBondContact O-N 2.61Å; L7-I10 PolarHBondContact O-N 3.43Å; L7-S11 WeakPolarHBondContact O-CB 3.36Å; L7-S11 PolarHBondContact O-N 3.28Å
8	T	65.9	Low	54.4	Low	81 Å²	81	105.7 Å²	105.7	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-64.8	-42.3	172	-48.6	0	0	0	0	111.3	A4 N5 I10 S11 C12	A4-T8 PolarHBondContact O-N 3.12Å; A4-T8 PolarHBondContact O-OG1 3Å; N5-T8 PolarHBondContact O-N 3.34Å; T8-I10 PolarHBondContact O-N 3.06Å; T8-S11 PolarHBondContact O-N 2.98Å; T8-C12 PolarHBondContact O-N 2.9Å; T8-C12 PolarHBondContact O-SG 2.97Å; T8-C12 VanDerWaalsContact O-SG 3.37Å
9	D	63.2	Low	53.7	Low	93 Å²	93	104.5 Å²	104.5	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-63.4	-38.7	176.1	-111.9	25.3	0	0	0	112.4	N5 Y6 K13	N5-D9 WeakPolarHBondContact O-CB 3.24Å; N5-D9 PolarHBondContact O-N 2.86Å; Y6-D9 PolarHBondContact O-N 3.11Å; D9-K13 WeakPolarHBondContact O-CB 3.27Å; D9-K13 VanDerWaalsContact O-CG 3.32Å; D9-K13 WeakPolarHBondContact O-CG 3.43Å; D9-K13 PolarHBondContact O-N 3.09Å; D9-K13 VanDerWaalsContact O-N 3.07Å
10	I	65.2	Low	53.2	Low	69 Å²	69	104.4 Å²	104.4	35%	0.354	56%	0.561	S	S	.	*	H	α-helix	trans	-67.8	-40.7	173.7	-69.9	169.1	0	0	0	110.7	Y6 L7 T8 K13 L14	Y6-I10 HydrophobicContact CD1-CD1 3.67Å; Y6-I10 HydrophobicContact CE1-CD1 3.47Å; Y6-I10 VanDerWaalsContact CE1-CD1 3.47Å; Y6-I10 HydrophobicContact CE1-CG1 4.4Å; Y6-I10 WeakPolarHBondContact O-CG1 3.47Å; Y6-I10 PolarHBondContact O-N 3.34Å; L7-I10 PolarHBondContact O-N 3.43Å; T8-I10 PolarHBondContact O-N 3.06Å; I10-K13 PolarHBondContact O-N 3.14Å; I10-L14 HydrophobicContact CG2-CD1 3.83Å; I10-L14 HydrophobicContact CG2-CG 4.45Å; I10-L14 WeakPolarHBondContact O-CB 3.39Å; I10-L14 WeakPolarHBondContact O-CG 3.5Å; I10-L14 PolarHBondContact O-N 2.86Å
11	S	59.3	Low	52.6	Low	78 Å²	78	105.9 Å²	105.9	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-65.6	-39.5	177.8	-162.5	0	0	0	0	112.1	L7 T8 L14 S15	L7-S11 WeakPolarHBondContact O-CB 3.36Å; L7-S11 PolarHBondContact O-N 3.28Å; T8-S11 PolarHBondContact O-N 2.98Å; S11-L14 PolarHBondContact O-N 3.16Å; S11-S15 PolarHBondContact O-N 3.47Å; S11-S15 VanDerWaalsContact O-N 3.08Å
12	C	57.2	Low	52.6	Low	64 Å²	64	100.9 Å²	100.9	43%	0.432	55%	0.551	S	S	.	*	H	α-helix	trans	-64.5	-44.4	174.1	-72.1	0	0	0	0	111.4	T8 L14 S15 E16	T8-C12 PolarHBondContact O-N 2.9Å; T8-C12 PolarHBondContact O-SG 2.97Å; T8-C12 VanDerWaalsContact O-SG 3.37Å; C12-L14 PolarHBondContact O-N 2.81Å; C12-S15 PolarHBondContact O-N 2.69Å; C12-S15 PolarHBondContact O-OG 2.84Å; C12-E16 PolarHBondContact O-N 3.2Å
13	K	66.6	Low	52.5	Low	129 Å²	129	96.9 Å²	96.9	56%	0.561	54%	0.539	S	S	*	.	H	α-helix	trans	-67.1	-32	178	-73.8	174.9	-177.7	173.3	0	113.6	D9 I10 L17	D9-K13 WeakPolarHBondContact O-CB 3.27Å; D9-K13 VanDerWaalsContact O-CG 3.32Å; D9-K13 WeakPolarHBondContact O-CG 3.43Å; D9-K13 PolarHBondContact O-N 3.09Å; D9-K13 VanDerWaalsContact O-N 3.07Å; I10-K13 PolarHBondContact O-N 3.14Å; K13-L17 PolarHBondContact O-N 3.34Å
14	L	55.1	Low	52	Low	74 Å²	74	99 Å²	99	39%	0.387	55%	0.546	S	S	.	.	H	α-helix	trans	-70.8	-37.2	172.9	-77.3	165.9	0	0	0	111.7	I10 S11 C12 E16 L17 D18	I10-L14 HydrophobicContact CG2-CD1 3.83Å; I10-L14 HydrophobicContact CG2-CG 4.45Å; I10-L14 WeakPolarHBondContact O-CB 3.39Å; I10-L14 WeakPolarHBondContact O-CG 3.5Å; I10-L14 PolarHBondContact O-N 2.86Å; S11-L14 PolarHBondContact O-N 3.16Å; C12-L14 PolarHBondContact O-N 2.81Å; L14-E16 PolarHBondContact O-N 3Å; L14-L17 PolarHBondContact O-N 3.45Å; L14-D18 PolarHBondContact O-N 3.16Å; L14-D18 VanDerWaalsContact O-N 3.13Å
15	S	59.1	Low	51.4	Low	66 Å²	66	101.6 Å²	101.6	46%	0.462	56%	0.56	S	S	.	*	H	α-helix	trans	-68.1	-32.4	175.3	75.4	0	0	0	0	113.5	S11 C12 L17 C19	S11-S15 PolarHBondContact O-N 3.47Å; S11-S15 VanDerWaalsContact O-N 3.08Å; C12-S15 PolarHBondContact O-N 2.69Å; C12-S15 PolarHBondContact O-OG 2.84Å; S15-L17 VanDerWaalsContact C-N 3.33Å; S15-C19 PolarHBondContact O-N 2.85Å
16	E	52.4	Low	50.3	Low	129 Å²	129	101.5 Å²	101.5	60%	0.603	57%	0.568	S	S	*	*	H	α-helix	trans	-70.2	-28.1	173.1	-76.7	-179.6	165	0	0	112.6	C12 L14 N20	C12-E16 PolarHBondContact O-N 3.2Å; L14-E16 PolarHBondContact O-N 3Å; E16-N20 PolarHBondContact O-N 2.86Å; E16-N20 PolarHBondContact O-ND2 3.34Å
17	L	44.2	Very low	49.2	Very low	114 Å²	114	99.5 Å²	99.5	60%	0.597	58%	0.577	S	S	*	*	H	α-helix	trans	-77.3	-36.5	175.6	-76.3	166.1	0	0	0	112.3	K13 L14 S15 N20 L21	K13-L17 PolarHBondContact O-N 3.34Å; L14-L17 PolarHBondContact O-N 3.45Å; S15-L17 VanDerWaalsContact C-N 3.33Å; L17-N20 PolarHBondContact O-N 2.84Å; L17-L21 PolarHBondContact O-N 3.4Å
18	D	43.5	Very low	47.9	Very low	113 Å²	113	100.4 Å²	100.4	60%	0.604	59%	0.588	S	S	*	*	H	α-helix	trans	-70.9	-30.5	176.5	-84.1	-26.2	0	0	0	113.2	L14 S22	L14-D18 PolarHBondContact O-N 3.16Å; L14-D18 VanDerWaalsContact O-N 3.13Å; D18-S22 PolarHBondContact O-N 2.98Å; D18-S22 PolarHBondContact O-OG 3.45Å
19	C	41.5	Very low	46.4	Very low	83 Å²	83	102.7 Å²	102.7	56%	0.561	60%	0.602	S	S	*	*	H	α-helix	trans	-71.8	-27	171.8	-76.3	0	0	0	0	113.5	S15 S22 T23	S15-C19 PolarHBondContact O-N 2.85Å; C19-S22 WeakPolarHBondContact CA-OG 3.44Å; C19-S22 PolarHBondContact O-OG 3.45Å; C19-T23 PolarHBondContact O-OG1 2.84Å
20	N	43.5	Very low	45	Very low	103 Å²	103	103.9 Å²	103.9	55%	0.551	61%	0.612	S	S	*	*	H	α-helix	trans	-86.9	-21.7	177	-73.4	-41.6	0	0	0	113	E16 L17 T23	E16-N20 PolarHBondContact O-N 2.86Å; E16-N20 PolarHBondContact O-ND2 3.34Å; L17-N20 PolarHBondContact O-N 2.84Å; N20-T23 WeakPolarHBondContact CA-OG1 3.16Å; N20-T23 PolarHBondContact O-OG1 2.85Å
21	L	40.6	Very low	43.5	Very low	135 Å²	135	106.3 Å²	106.3	71%	0.707	63%	0.626	S	S	*	*	H	α-helix	trans	-84.6	-22.1	175.3	-149.6	69.6	0	0	0	112.9	L17	L17-L21 PolarHBondContact O-N 3.4Å
22	S	40.7	Very low	42.3	Very low	80 Å²	80	110 Å²	110	56%	0.559	63%	0.632	S	S	*	*	S	Bend	trans	-85.3	-8.6	175	46.2	0	0	0	0	114.1	D18 C19	D18-S22 PolarHBondContact O-N 2.98Å; D18-S22 PolarHBondContact O-OG 3.45Å; C19-S22 WeakPolarHBondContact CA-OG 3.44Å; C19-S22 PolarHBondContact O-OG 3.45Å
23	T	40.4	Very low	41.2	Very low	92 Å²	92	113.9 Å²	113.9	56%	0.564	65%	0.648	S	S	*	*	S	Bend	trans	-103.3	-3.6	178.3	42	0	0	0	0	114.5	C19 N20	C19-T23 PolarHBondContact O-OG1 2.84Å; N20-T23 WeakPolarHBondContact CA-OG1 3.16Å; N20-T23 PolarHBondContact O-OG1 2.85Å
24	L	36.2	Very low	39.4	Very low	150 Å²	150	114.2 Å²	114.2	79%	0.785	66%	0.656	S	S	*	*	S	Bend	trans	-99.3	3.4	179.5	-106.7	86.9	0	0	0	115.5
25	S	33.8	Very low	38.3	Very low	106 Å²	106	115.9 Å²	115.9	74%	0.741	67%	0.674	S	S	*	*	S	Bend	trans	-99.8	19.7	-174.9	52.3	0	0	0	0	115.2
26	S	32.8	Very low	37	Very low	99 Å²	99	117.2 Å²	117.2	69%	0.692	68%	0.683	S	S	*	*			trans	-142	69.1	-179.2	56	0	0	0	0	114.1
27	S	33.2	Very low	36	Very low	118 Å²	118	116 Å²	116	83%	0.825	69%	0.689	S	S	*	*			trans	-162.6	117.7	148.6	47.1	0	0	0	0	112.2
28	T	31	Very low	35.3	Very low	133 Å²	133	115.8 Å²	115.8	82%	0.816	70%	0.697	S	S	*	*			trans	-82.6	139.5	169.7	41	0	0	0	0	109.9
29	T	35.8	Very low	34.6	Very low	129 Å²	129	116 Å²	116	79%	0.791	71%	0.707	S	S	*	*			trans	-176.2	108.9	139.5	22.3	0	0	0	0	110.9
30	T	32.5	Very low	34.1	Very low	117 Å²	117	116.6 Å²	116.6	72%	0.718	71%	0.712	S	S	*	*			trans	18.1	123.5	136.2	58.1	0	0	0	0	118.2
31	D	33.9	Very low	33.3	Very low	120 Å²	120	120.7 Å²	120.7	64%	0.642	73%	0.726	S	S	*	*				171.9	137.5	85.5	-116.6	-3.6	0	0	0	112.3
32	K	34.3	Very low	33	Very low	157 Å²	157	121 Å²	121	68%	0.683	73%	0.727	S	S	*	*			trans	75.6	122.6	135.9	-81.4	175.5	-171.5	127.7	0	122.9
33	L	33.2	Very low	32.3	Very low	145 Å²	145	123.1 Å²	123.1	76%	0.759	73%	0.731	S	S	*	*			trans	82.3	139.8	137.5	-60.3	164.7	0	0	0	116.2
34	N	29.5	Very low	31.6	Very low	135 Å²	135	125.1 Å²	125.1	72%	0.722	74%	0.743	S	S	*	*			cis	-177	157.9	-18	-132.3	-5	0	0	0	104.2
35	S	32.4	Very low	31.2	Very low	110 Å²	110	125 Å²	125	77%	0.769	74%	0.743	S	S	*	*			trans	70	133.9	160.4	73.1	0	0	0	0	117
36	S	32.3	Very low	30.9	Very low	94 Å²	94	126.1 Å²	126.1	66%	0.657	74%	0.739	S	S	*	*			cis	-179.2	143.7	3	40.3	0	0	0	0	109
37	S	29.9	Very low	30.5	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	75%	0.754	S	S	*	*			trans	62.4	134.3	138.8	54.1	0	0	0	0	119.4
38	S	29.8	Very low	30.2	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	74%	0.742	S	S	*	*			cis	-175.3	159.9	17.3	-104.1	0	0	0	0	111.8
39	S	30.3	Very low	30.2	Very low	116 Å²	116	127.5 Å²	127.5	81%	0.811	74%	0.743	S	S	*	*			trans	95.7	123	155.5	77.1	0	0	0	0	118.1
40	S	29	Very low	29.7	Very low	96 Å²	96	128.9 Å²	128.9	67%	0.671	75%	0.746	S	S	*	*			cis	-176.1	128.7	-18.3	46.2	0	0	0	0	108.2
41	F	28.6	Very low	29.5	Very low	190 Å²	190	131 Å²	131	83%	0.833	75%	0.753	S	S	*	*			trans	53.6	129.2	133.3	-72.6	-92.7	0	0	0	119.5
42	L	33.2	Very low	29.3	Very low	140 Å²	140	131.2 Å²	131.2	73%	0.733	76%	0.763	S	S	*	*				-157.4	130	58.5	-79	167.1	0	0	0	113.9
43	I	26.6	Very low	28.9	Very low	126 Å²	126	130.7 Å²	130.7	65%	0.646	77%	0.766	S	S	*	*			trans	72	89.6	134.2	-53.7	168	0	0	0	116.6
44	T	25.1	Very low	28.6	Very low	134 Å²	134	130.8 Å²	130.8	82%	0.822	77%	0.768	S	S	*	*				42.5	93.4	74.9	10.5	0	0	0	0	116.5
45	D	28.1	Very low	28.5	Very low	146 Å²	146	133.5 Å²	133.5	78%	0.781	78%	0.776	S	S	*	*			trans	-151.2	120.4	142.6	-103.3	-23.8	0	0	0	111.1
46	I	26.7	Very low	28.4	Very low	130 Å²	130	135.9 Å²	135.9	67%	0.667	78%	0.778	S	S	*	*			trans	82.8	74.1	148.3	-49.5	166	0	0	0	116.6	A48	I46-A48 VanDerWaalsContact C-N 3.33Å; I46-A48 HydrophobicContact CG2-CB 3.48Å; I46-A48 VanDerWaalsContact CG2-CB 3.48Å; I46-A48 PolarHBondContact O-N 3.09Å
47	L	25	Very low	28.2	Very low	190 Å²	190	137.9 Å²	137.9	100%	0.995	79%	0.787	S	S	*	*				-60.5	97.6	125.3	-76.5	163.5	0	0	0	108.7
48	A	27.6	Very low	28.2	Very low	69 Å²	69	140.6 Å²	140.6	57%	0.57	79%	0.788	S	S	*	*			trans	-152.9	139.5	158.2	0	0	0	0	0	108.6	I46	I46-A48 VanDerWaalsContact C-N 3.33Å; I46-A48 HydrophobicContact CG2-CB 3.48Å; I46-A48 VanDerWaalsContact CG2-CB 3.48Å; I46-A48 PolarHBondContact O-N 3.09Å
49	S	29.5	Very low	28.2	Very low	120 Å²	120	142.3 Å²	142.3	84%	0.839	79%	0.787	S	S	*	*			trans	88.5	53.2	173.8	-47	0	0	0	0	116.9
50	N	26.7	Very low	28.4	Very low	159 Å²	159	142.9 Å²	142.9	85%	0.85	79%	0.786	S	S	*	*				-82.4	119.9	127.3	-95.2	-19.1	0	0	0	106.6
51	D	27.1	Very low	28.4	Very low	162 Å²	162	145.7 Å²	145.7	87%	0.866	79%	0.793	S	S	*	*			trans	-173.6	152.5	147.6	-92.2	-25.8	0	0	0	110.6
52	S	29.7	Very low	28.4	Very low	123 Å²	123	144.7 Å²	144.7	86%	0.86	79%	0.792	S	S	*	*			trans	98.3	61.4	175	-51.8	0	0	0	0	117.5
53	I	26.6	Very low	28.4	Very low	146 Å²	146	144 Å²	144	75%	0.749	79%	0.788	S	S	*	*			trans	-44.4	142.4	138.9	-71.9	168.8	0	0	0	112.6
54	N	26.2	Very low	28.7	Very low	148 Å²	148	143.1 Å²	143.1	79%	0.791	79%	0.791	S	S	*	*			trans	56.3	101.9	155.7	-62.8	-20	0	0	0	120.3
55	E	28.4	Very low	29.4	Very low	191 Å²	191	141.7 Å²	141.7	89%	0.893	79%	0.787	S	S	*	*			trans	-163.4	144.9	136.9	-129.4	170	176.8	0	0	112.6
56	I	30.2	Very low	29.9	Very low	160 Å²	160	138.8 Å²	138.8	82%	0.821	77%	0.774	S	S	*	*			trans	90.6	61.2	171.6	-41.3	169.5	0	0	0	115.9
57	V	27.8	Very low	30.5	Very low	137 Å²	137	138 Å²	138	83%	0.83	77%	0.771	S	S	*	*			trans	-93.1	110.1	138	169.2	0	0	0	0	106.7
58	H	29.4	Very low	31.3	Very low	160 Å²	160	136.1 Å²	136.1	74%	0.741	76%	0.755	S	S	*	*			trans	178.9	136.8	139.3	-123.4	-85.7	0	0	0	112.5
59	L	30.9	Very low	31.7	Very low	145 Å²	145	139 Å²	139	76%	0.759	76%	0.758	S	S	*	*			trans	117.8	111.6	153.3	-58.6	172	0	0	0	117.3
60	T	33.9	Very low	32.3	Very low	129 Å²	129	137.1 Å²	137.1	79%	0.791	74%	0.738	S	S	*	*			trans	85.5	91.6	162.5	69.2	0	0	0	0	116.2
61	N	28.5	Very low	33.2	Very low	154 Å²	154	132.2 Å²	132.2	82%	0.824	72%	0.716	S	S	*	*				49.3	122.9	73.5	-78.1	-0.5	0	0	0	110.7
62	E	30	Very low	34	Very low	170 Å²	170	128 Å²	128	79%	0.794	70%	0.696	S	S	*	*			cis	-161.1	125.8	40	-64	-178.7	156.2	0	0	111.7
63	N	32.1	Very low	34.4	Very low	125 Å²	125	127.7 Å²	127.7	67%	0.668	68%	0.681	S	S	*	*			trans	173.5	91.9	138.9	-98.2	-38.9	0	0	0	111	S65	N63-S65 PolarHBondContact O-N 2.65Å
64	P	34	Very low	35.4	Very low	108 Å²	108	127.3 Å²	127.3	70%	0.701	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	11.7	-164.1	31.9	-33.7	0	0	0	116.6
65	S	38.3	Very low	36.2	Very low	104 Å²	104	125.8 Å²	125.8	73%	0.727	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-36.2	-175.2	-165.5	0	0	0	0	114.1	N63	N63-S65 PolarHBondContact O-N 2.65Å
66	T	39.7	Very low	36.6	Very low	85 Å²	85	120.6 Å²	120.6	52%	0.521	64%	0.641	S	S	.	*	H	α-helix	trans	-83	-30.7	-179.1	35.5	0	0	0	0	113.7	K68 M69 I70	T66-K68 PolarHBondContact O-N 2.81Å; T66-M69 PolarHBondContact O-N 3.32Å; T66-I70 WeakPolarHBondContact O-CG1 3.47Å; T66-I70 PolarHBondContact O-N 3.44Å
67	D	38.4	Very low	36.9	Very low	113 Å²	113	118.9 Å²	118.9	60%	0.604	63%	0.629	S	S	*	*	H	α-helix	trans	-72.3	-27.5	-179.8	-83.2	-19.2	0	0	0	113.2	S71	D67-S71 WeakPolarHBondContact O-CB 3.5Å; D67-S71 PolarHBondContact O-N 3.47Å; D67-S71 PolarHBondContact O-OG 2.95Å
68	K	43.4	Very low	37.6	Very low	150 Å²	150	118.3 Å²	118.3	65%	0.652	62%	0.617	S	S	*	*	H	α-helix	trans	-70.6	-35.9	172	-73.7	-176.7	178.4	-179.8	0	111.9	T66 S71 V72	T66-K68 PolarHBondContact O-N 2.81Å; K68-S71 PolarHBondContact O-OG 2.83Å; K68-S71 VanDerWaalsContact O-OG 3.13Å; K68-V72 WeakPolarHBondContact O-CB 3.3Å; K68-V72 WeakPolarHBondContact O-CG2 3.28Å; K68-V72 PolarHBondContact O-N 2.85Å
69	M	34.9	Very low	37.9	Very low	130 Å²	130	116.2 Å²	116.2	64%	0.64	61%	0.608	S	S	*	*	H	α-helix	trans	-73.2	-40.4	177.7	-147.6	176.3	77.1	0	0	111.1	T66 Q73	T66-M69 PolarHBondContact O-N 3.32Å; M69-Q73 VanDerWaalsContact O-CB 3.23Å; M69-Q73 WeakPolarHBondContact O-CB 3.34Å; M69-Q73 PolarHBondContact O-N 2.79Å
70	I	42.6	Very low	38.1	Very low	80 Å²	80	114.4 Å²	114.4	41%	0.41	60%	0.599	S	S	.	*	H	α-helix	trans	-70.9	-34.2	175.6	-64.9	169.4	0	0	0	111.5	T66 K74	T66-I70 WeakPolarHBondContact O-CG1 3.47Å; T66-I70 PolarHBondContact O-N 3.44Å; I70-K74 HydrophobicContact CG2-CD 4.29Å; I70-K74 WeakPolarHBondContact O-CB 3.39Å; I70-K74 WeakPolarHBondContact O-CG 3.49Å; I70-K74 PolarHBondContact O-N 3.34Å
71	S	44.6	Very low	38.1	Very low	57 Å²	57	113.2 Å²	113.2	40%	0.399	59%	0.588	S	S	.	*	H	α-helix	trans	-70	-42	175.3	75.9	0	0	0	0	111.9	D67 K68 K74 Q75	D67-S71 WeakPolarHBondContact O-CB 3.5Å; D67-S71 PolarHBondContact O-N 3.47Å; D67-S71 PolarHBondContact O-OG 2.95Å; K68-S71 PolarHBondContact O-OG 2.83Å; K68-S71 VanDerWaalsContact O-OG 3.13Å; S71-K74 PolarHBondContact O-N 3.26Å; S71-Q75 WeakPolarHBondContact O-CB 3.49Å; S71-Q75 PolarHBondContact O-N 3.22Å
72	V	43.8	Very low	38.5	Very low	73 Å²	73	110.4 Å²	110.4	44%	0.442	57%	0.573	S	S	.	*	H	α-helix	trans	-66	-39.5	175	170.9	0	0	0	0	110.9	K68 Q75 N76	K68-V72 WeakPolarHBondContact O-CB 3.3Å; K68-V72 WeakPolarHBondContact O-CG2 3.28Å; K68-V72 PolarHBondContact O-N 2.85Å; V72-Q75 PolarHBondContact O-N 3.44Å; V72-N76 WeakPolarHBondContact O-CB 3.32Å; V72-N76 VanDerWaalsContact O-CG 3.29Å; V72-N76 PolarHBondContact O-N 3.3Å; V72-N76 PolarHBondContact O-ND2 2.72Å
73	Q	37.8	Very low	38.9	Very low	116 Å²	116	107 Å²	107	54%	0.542	56%	0.557	S	S	.	*	H	α-helix	trans	-70.6	-35.8	177.7	-155.6	162.2	0.8	0	0	112.1	M69 Q77	M69-Q73 VanDerWaalsContact O-CB 3.23Å; M69-Q73 WeakPolarHBondContact O-CB 3.34Å; M69-Q73 PolarHBondContact O-N 2.79Å; Q73-Q77 WeakPolarHBondContact O-CB 3.42Å; Q73-Q77 PolarHBondContact O-N 2.93Å
74	K	47.7	Very low	39.1	Very low	139 Å²	139	106.2 Å²	106.2	60%	0.604	55%	0.553	S	S	*	*	H	α-helix	trans	-69.5	-36.4	169.4	-80.2	179.5	177.6	175.6	0	112.8	I70 S71 Q77 Q78	I70-K74 HydrophobicContact CG2-CD 4.29Å; I70-K74 WeakPolarHBondContact O-CB 3.39Å; I70-K74 WeakPolarHBondContact O-CG 3.49Å; I70-K74 PolarHBondContact O-N 3.34Å; S71-K74 PolarHBondContact O-N 3.26Å; K74-Q77 PolarHBondContact O-N 3.2Å; K74-Q78 WeakPolarHBondContact O-CB 3.32Å; K74-Q78 WeakPolarHBondContact O-CG 3.04Å; K74-Q78 PolarHBondContact O-N 3.19Å
75	Q	44.3	Very low	39.3	Very low	116 Å²	116	107.1 Å²	107.1	54%	0.542	55%	0.546	S	S	.	.	H	α-helix	trans	-65.6	-43.8	174.3	-108.9	176.4	-25.1	0	0	111.4	S71 V72 Q77 Q78 Q79	S71-Q75 WeakPolarHBondContact O-CB 3.49Å; S71-Q75 PolarHBondContact O-N 3.22Å; V72-Q75 PolarHBondContact O-N 3.44Å; Q75-Q77 VanDerWaalsContact C-N 3.35Å; Q75-Q77 PolarHBondContact O-N 3.33Å; Q75-Q78 PolarHBondContact O-N 3.28Å; Q75-Q79 VanDerWaalsContact O-CB 3.31Å; Q75-Q79 WeakPolarHBondContact O-CB 3.22Å; Q75-Q79 WeakPolarHBondContact O-CG 3.4Å; Q75-Q79 PolarHBondContact O-N 2.87Å
76	N	35.8	Very low	39.3	Very low	82 Å²	82	108 Å²	108	44%	0.439	54%	0.536	S	S	.	.	H	α-helix	trans	-66.2	-36.2	176	-74.1	-18.7	0	0	0	112	V72 N80	V72-N76 WeakPolarHBondContact O-CB 3.32Å; V72-N76 VanDerWaalsContact O-CG 3.29Å; V72-N76 PolarHBondContact O-N 3.3Å; V72-N76 PolarHBondContact O-ND2 2.72Å; N76-N80 WeakPolarHBondContact O-CB 3.31Å; N76-N80 PolarHBondContact O-N 3.37Å; N76-N80 PolarHBondContact O-ND2 2.99Å
77	Q	37	Very low	39	Very low	123 Å²	123	112.5 Å²	112.5	58%	0.575	54%	0.544	S	S	*	.	H	α-helix	trans	-72.3	-39.8	176.3	-153.6	128	29.7	0	0	111.8	Q73 K74 Q75 N80 D81	Q73-Q77 WeakPolarHBondContact O-CB 3.42Å; Q73-Q77 PolarHBondContact O-N 2.93Å; K74-Q77 PolarHBondContact O-N 3.2Å; Q75-Q77 VanDerWaalsContact C-N 3.35Å; Q75-Q77 PolarHBondContact O-N 3.33Å; Q77-N80 PolarHBondContact O-N 3.36Å; Q77-D81 WeakPolarHBondContact O-CB 3.35Å; Q77-D81 VanDerWaalsContact O-CG 3.24Å; Q77-D81 PolarHBondContact O-N 3.48Å
78	Q	42.1	Very low	38.6	Very low	126 Å²	126	110.9 Å²	110.9	59%	0.589	53%	0.531	S	S	*	.	H	α-helix	trans	-68.6	-32.7	172.1	-79.4	177.8	-18.5	0	0	113	K74 Q75 N82	K74-Q78 WeakPolarHBondContact O-CB 3.32Å; K74-Q78 WeakPolarHBondContact O-CG 3.04Å; K74-Q78 PolarHBondContact O-N 3.19Å; Q75-Q78 PolarHBondContact O-N 3.28Å; Q78-N82 WeakPolarHBondContact O-CB 3.4Å; Q78-N82 PolarHBondContact O-N 3.24Å; Q78-N82 PolarHBondContact O-ND2 2.86Å
79	Q	36.8	Very low	38.2	Very low	116 Å²	116	106.9 Å²	106.9	54%	0.542	52%	0.515	S	S	.	.	H	α-helix	trans	-69.2	-42.6	173.1	-86	176.2	-32.5	0	0	111.4	Q75 N82 E83	Q75-Q79 VanDerWaalsContact O-CB 3.31Å; Q75-Q79 WeakPolarHBondContact O-CB 3.22Å; Q75-Q79 WeakPolarHBondContact O-CG 3.4Å; Q75-Q79 PolarHBondContact O-N 2.87Å; Q79-N82 PolarHBondContact O-N 3.08Å; Q79-E83 WeakPolarHBondContact O-CB 3.48Å; Q79-E83 WeakPolarHBondContact O-CG 3.25Å; Q79-E83 PolarHBondContact O-N 3.33Å
80	N	33.4	Very low	37.9	Very low	107 Å²	107	107 Å²	107	57%	0.572	51%	0.509	S	S	*	.	H	α-helix	trans	-65.7	-42.3	175	-75.9	-20	0	0	0	112.5	N76 Q77 N82 E83 D84	N76-N80 WeakPolarHBondContact O-CB 3.31Å; N76-N80 PolarHBondContact O-N 3.37Å; N76-N80 PolarHBondContact O-ND2 2.99Å; Q77-N80 PolarHBondContact O-N 3.36Å; N80-N82 VanDerWaalsContact C-N 3.31Å; N80-N82 PolarHBondContact O-N 2.67Å; N80-E83 PolarHBondContact O-N 2.81Å; N80-D84 PolarHBondContact O-N 3.39Å
81	D	34.2	Very low	37.5	Very low	103 Å²	103	107.9 Å²	107.9	55%	0.551	52%	0.515	S	S	*	.	H	α-helix	trans	-65.4	-35.2	175.4	-69.7	-20.2	0	0	0	111.6	Q77 F85	Q77-D81 WeakPolarHBondContact O-CB 3.35Å; Q77-D81 VanDerWaalsContact O-CG 3.24Å; Q77-D81 PolarHBondContact O-N 3.48Å; D81-F85 VanDerWaalsContact O-CB 3.25Å; D81-F85 WeakPolarHBondContact O-CB 3.19Å; D81-F85 PolarHBondContact O-N 3.37Å
82	N	37.6	Very low	37	Very low	95 Å²	95	107.6 Å²	107.6	51%	0.508	51%	0.507	S	S	.	.	H	α-helix	trans	-72.4	-36.7	174.4	-82.4	-27.2	0	0	0	112.7	Q78 Q79 N80 F85 K86	Q78-N82 WeakPolarHBondContact O-CB 3.4Å; Q78-N82 PolarHBondContact O-N 3.24Å; Q78-N82 PolarHBondContact O-ND2 2.86Å; Q79-N82 PolarHBondContact O-N 3.08Å; N80-N82 VanDerWaalsContact C-N 3.31Å; N80-N82 PolarHBondContact O-N 2.67Å; N82-F85 PolarHBondContact O-N 3.09Å; N82-K86 WeakPolarHBondContact O-CB 3.39Å; N82-K86 VanDerWaalsContact O-CG 3.24Å; N82-K86 WeakPolarHBondContact O-CG 3.39Å; N82-K86 PolarHBondContact O-N 3.5Å
83	E	37.5	Very low	36.5	Very low	98 Å²	98	108.4 Å²	108.4	46%	0.458	51%	0.508	S	S	.	.	H	α-helix	trans	-70	-41.6	175.9	-76.9	-62.6	131.2	0	0	111.2	Q79 N80 F85 K86 R87	Q79-E83 WeakPolarHBondContact O-CB 3.48Å; Q79-E83 WeakPolarHBondContact O-CG 3.25Å; Q79-E83 PolarHBondContact O-N 3.33Å; N80-E83 PolarHBondContact O-N 2.81Å; E83-F85 VanDerWaalsContact C-N 3.33Å; E83-F85 PolarHBondContact O-N 3.39Å; E83-K86 PolarHBondContact O-N 3.49Å; E83-K86 IonicContact OE1-NZ 2.91Å; E83-K86 PolarHBondContact OE1-NZ 2.94Å; E83-R87 VanDerWaalsContact O-CB 3.24Å; E83-R87 WeakPolarHBondContact O-CB 3.36Å; E83-R87 PolarHBondContact O-N 3.4Å
84	D	37.5	Very low	36.1	Very low	109 Å²	109	107 Å²	107	58%	0.583	50%	0.504	S	S	*	.	H	α-helix	trans	-63.7	-38.7	172	-80.6	-21.4	0	0	0	111.4	N80 F88	N80-D84 PolarHBondContact O-N 3.39Å; D84-F88 WeakPolarHBondContact O-CB 3.09Å; D84-F88 PolarHBondContact O-N 3.47Å
85	F	37.9	Very low	35.5	Very low	128 Å²	128	102.9 Å²	102.9	56%	0.561	49%	0.492	S	S	*	.	H	α-helix	trans	-66.8	-39.9	173.7	-173.2	-96.5	0	0	0	112.7	D81 N82 E83 Q89	D81-F85 VanDerWaalsContact O-CB 3.25Å; D81-F85 WeakPolarHBondContact O-CB 3.19Å; D81-F85 PolarHBondContact O-N 3.37Å; N82-F85 PolarHBondContact O-N 3.09Å; E83-F85 VanDerWaalsContact C-N 3.33Å; E83-F85 PolarHBondContact O-N 3.39Å; F85-Q89 HydrophobicContact CD1-CG 4.36Å; F85-Q89 HydrophobicContact CE1-CG 4.01Å; F85-Q89 HydrophobicContact CZ-CG 4.38Å; F85-Q89 WeakPolarHBondContact O-CB 3.31Å; F85-Q89 PolarHBondContact O-N 2.73Å
86	K	37.7	Very low	35	Very low	122 Å²	122	101.2 Å²	101.2	53%	0.53	49%	0.486	S	S	.	.	H	α-helix	trans	-67	-43.3	174.3	-79.5	177.8	-168.5	170.8	0	111.6	N82 E83 F88 Q89 Y90	N82-K86 WeakPolarHBondContact O-CB 3.39Å; N82-K86 VanDerWaalsContact O-CG 3.24Å; N82-K86 WeakPolarHBondContact O-CG 3.39Å; N82-K86 PolarHBondContact O-N 3.5Å; E83-K86 PolarHBondContact O-N 3.49Å; E83-K86 IonicContact OE1-NZ 2.91Å; E83-K86 PolarHBondContact OE1-NZ 2.94Å; K86-F88 VanDerWaalsContact C-N 3.32Å; K86-Q89 CarbonylContact O-C 3.42Å; K86-Q89 WeakPolarHBondContact O-CB 3.47Å; K86-Q89 PolarHBondContact O-N 3.3Å; K86-Y90 VanDerWaalsContact O-CB 3.27Å; K86-Y90 WeakPolarHBondContact O-CB 3.46Å; K86-Y90 PolarHBondContact O-N 3.27Å
87	R	34.2	Very low	35	Very low	180 Å²	180	103.7 Å²	103.7	68%	0.679	49%	0.492	S	S	*	.	H	α-helix	trans	-64.1	-41	178.2	-157.3	169.5	-168	-123	-0.3	110.6	E83 Y90 D91	E83-R87 VanDerWaalsContact O-CB 3.24Å; E83-R87 WeakPolarHBondContact O-CB 3.36Å; E83-R87 PolarHBondContact O-N 3.4Å; R87-Y90 PolarHBondContact O-N 3.08Å; R87-D91 PolarHBondContact O-N 3.24Å
88	F	30.5	Very low	34.8	Very low	78 Å²	78	101.8 Å²	101.8	34%	0.342	49%	0.49	S	S	.	.	H	α-helix	trans	-63.8	-43.5	171.7	-170.8	-89.2	0	0	0	112.8	D84 K86 K92 T131	D84-F88 WeakPolarHBondContact O-CB 3.09Å; D84-F88 PolarHBondContact O-N 3.47Å; K86-F88 VanDerWaalsContact C-N 3.32Å; F88-K92 VanDerWaalsContact O-CB 3.31Å; F88-K92 WeakPolarHBondContact O-CB 3.47Å; F88-K92 PolarHBondContact O-N 3.28Å; F88-T131 VanDerWaalsContact CE1-CB 3.43Å; F88-T131 HydrophobicContact CE1-CG2 3.84Å; F88-T131 HydrophobicContact CE2-CG2 3.7Å; F88-T131 HydrophobicContact CZ-CG2 3.06Å
89	Q	33.6	Very low	34.3	Very low	66 Å²	66	99.1 Å²	99.1	31%	0.308	48%	0.476	S	S	.	.	H	α-helix	trans	-64.2	-37.3	172.2	-90.8	-76.7	2.5	0	0	112.7	F85 K86 K92 N93	F85-Q89 HydrophobicContact CD1-CG 4.36Å; F85-Q89 HydrophobicContact CE1-CG 4.01Å; F85-Q89 HydrophobicContact CZ-CG 4.38Å; F85-Q89 WeakPolarHBondContact O-CB 3.31Å; F85-Q89 PolarHBondContact O-N 2.73Å; K86-Q89 CarbonylContact O-C 3.42Å; K86-Q89 WeakPolarHBondContact O-CB 3.47Å; K86-Q89 PolarHBondContact O-N 3.3Å; Q89-K92 PolarHBondContact O-N 3.31Å; Q89-N93 VanDerWaalsContact O-CB 3.31Å; Q89-N93 WeakPolarHBondContact O-CB 3Å; Q89-N93 PolarHBondContact O-N 3.49Å; Q89-N93 PolarHBondContact O-ND2 3.44Å
90	Y	30	Very low	34.2	Very low	132 Å²	132	96.5 Å²	96.5	52%	0.518	47%	0.468	S	S	.	.	H	α-helix	trans	-69.2	-44.8	179.9	-155.2	-96	0	0	0	110.9	K86 R87 K92 N93 I94	K86-Y90 VanDerWaalsContact O-CB 3.27Å; K86-Y90 WeakPolarHBondContact O-CB 3.46Å; K86-Y90 PolarHBondContact O-N 3.27Å; R87-Y90 PolarHBondContact O-N 3.08Å; Y90-K92 VanDerWaalsContact C-N 3.32Å; Y90-K92 PolarHBondContact O-N 3.13Å; Y90-N93 PolarHBondContact O-N 2.93Å; Y90-I94 HydrophobicContact CD1-CD1 3.52Å; Y90-I94 HydrophobicContact CD1-CG1 4.24Å; Y90-I94 HydrophobicContact CE1-CD1 3.58Å; Y90-I94 HydrophobicContact CE1-CG1 4.29Å; Y90-I94 WeakPolarHBondContact O-CG1 3.32Å; Y90-I94 PolarHBondContact O-N 3.23Å
91	D	32.6	Very low	34.3	Very low	99 Å²	99	95.6 Å²	95.6	53%	0.529	46%	0.463	S	S	.	.	H	α-helix	trans	-62.1	-40.1	173.1	-74.8	-20.3	0	0	0	111.4	R87 S95	R87-D91 PolarHBondContact O-N 3.24Å; D91-S95 WeakPolarHBondContact O-CB 3.07Å; D91-S95 PolarHBondContact O-N 3.06Å
92	K	35.4	Very low	34.3	Very low	52 Å²	52	97.8 Å²	97.8	23%	0.226	47%	0.465	C	S	.	.	H	α-helix	trans	-63.1	-43.4	173.4	-172.8	-178.4	178	-173.1	0	112.4	F88 Q89 Y90 S95 M96 S133	F88-K92 VanDerWaalsContact O-CB 3.31Å; F88-K92 WeakPolarHBondContact O-CB 3.47Å; F88-K92 PolarHBondContact O-N 3.28Å; Q89-K92 PolarHBondContact O-N 3.31Å; Y90-K92 VanDerWaalsContact C-N 3.32Å; Y90-K92 PolarHBondContact O-N 3.13Å; K92-S95 PolarHBondContact O-N 3.5Å; K92-M96 WeakPolarHBondContact O-CB 3.46Å; K92-M96 PolarHBondContact O-N 3.45Å; K92-S133 PolarHBondContact NZ-OG 3.08Å
93	N	32	Very low	34.2	Very low	89 Å²	89	98.9 Å²	98.9	48%	0.476	47%	0.467	S	S	.	.	H	α-helix	trans	-71.1	-35.6	179.8	-73.4	-32.1	0	0	0	112	Q89 Y90 K97	Q89-N93 VanDerWaalsContact O-CB 3.31Å; Q89-N93 WeakPolarHBondContact O-CB 3Å; Q89-N93 PolarHBondContact O-N 3.49Å; Q89-N93 PolarHBondContact O-ND2 3.44Å; Y90-N93 PolarHBondContact O-N 2.93Å; N93-K97 WeakPolarHBondContact O-CB 3.24Å; N93-K97 PolarHBondContact O-N 2.94Å
94	I	30.8	Very low	34.1	Very low	86 Å²	86	101 Å²	101	44%	0.441	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-48.2	170.6	-71.3	167.9	0	0	0	109.6	Y90 M96 K97 T98	Y90-I94 HydrophobicContact CD1-CD1 3.52Å; Y90-I94 HydrophobicContact CD1-CG1 4.24Å; Y90-I94 HydrophobicContact CE1-CD1 3.58Å; Y90-I94 HydrophobicContact CE1-CG1 4.29Å; Y90-I94 WeakPolarHBondContact O-CG1 3.32Å; Y90-I94 PolarHBondContact O-N 3.23Å; I94-M96 VanDerWaalsContact C-N 3.32Å; I94-M96 PolarHBondContact O-N 3.36Å; I94-K97 PolarHBondContact O-N 3.25Å; I94-T98 HydrophobicContact CG2-CG2 4.38Å; I94-T98 WeakPolarHBondContact O-CB 3.35Å; I94-T98 WeakPolarHBondContact O-CG2 3.23Å; I94-T98 PolarHBondContact O-N 3.22Å; I94-T98 PolarHBondContact O-OG1 3.11Å
95	S	34.9	Very low	34.1	Very low	53 Å²	53	102.1 Å²	102.1	37%	0.371	49%	0.487	S	S	.	.	H	α-helix	trans	-64.5	-34.7	-179.7	-166.1	0	0	0	0	112.8	D91 K92 T98 F99	D91-S95 WeakPolarHBondContact O-CB 3.07Å; D91-S95 PolarHBondContact O-N 3.06Å; K92-S95 PolarHBondContact O-N 3.5Å; S95-T98 WeakPolarHBondContact CA-OG1 3.48Å; S95-T98 PolarHBondContact O-OG1 3.24Å; S95-T98 VanDerWaalsContact O-OG1 3.08Å; S95-F99 VanDerWaalsContact O-CB 3.31Å; S95-F99 WeakPolarHBondContact O-CB 3.19Å; S95-F99 PolarHBondContact O-N 3.31Å
96	M	33.4	Very low	33.8	Very low	82 Å²	82	101.3 Å²	101.3	40%	0.404	49%	0.489	S	S	.	.	H	α-helix	trans	-77.2	-37.8	174.4	-83.3	-68.2	-67.3	0	0	113.1	K92 I94 F99 T100	K92-M96 WeakPolarHBondContact O-CB 3.46Å; K92-M96 PolarHBondContact O-N 3.45Å; I94-M96 VanDerWaalsContact C-N 3.32Å; I94-M96 PolarHBondContact O-N 3.36Å; M96-F99 CarbonylContact O-C 3.59Å; M96-F99 WeakPolarHBondContact O-CB 3.12Å; M96-F99 PolarHBondContact O-N 3.07Å; M96-T100 WeakPolarHBondContact O-CG2 3.48Å; M96-T100 PolarHBondContact O-N 3.26Å; M96-T100 PolarHBondContact O-OG1 3.42Å
97	K	35.5	Very low	33.5	Very low	133 Å²	133	102.3 Å²	102.3	58%	0.578	50%	0.5	S	S	*	.	H	α-helix	trans	-71.3	-38.9	178.8	-172.7	163.8	-176.5	178.3	0	112	N93 I94 F99 T100 D101	N93-K97 WeakPolarHBondContact O-CB 3.24Å; N93-K97 PolarHBondContact O-N 2.94Å; I94-K97 PolarHBondContact O-N 3.25Å; K97-F99 PolarHBondContact O-N 3.26Å; K97-T100 WeakPolarHBondContact CA-OG1 3.45Å; K97-T100 PolarHBondContact O-N 2.69Å; K97-T100 PolarHBondContact O-OG1 2.93Å; K97-T100 VanDerWaalsContact O-OG1 3.11Å; K97-D101 WeakPolarHBondContact CG-OD2 3.41Å; K97-D101 VanDerWaalsContact O-CB 3.27Å; K97-D101 WeakPolarHBondContact O-CB 3.04Å; K97-D101 PolarHBondContact O-N 3.35Å
98	T	32.8	Very low	33.4	Very low	84 Å²	84	100.3 Å²	100.3	52%	0.515	50%	0.503	S	S	.	.	H	α-helix	trans	-63.1	-31.2	167.9	49.7	0	0	0	0	112.6	I94 S95 Y102	I94-T98 HydrophobicContact CG2-CG2 4.38Å; I94-T98 WeakPolarHBondContact O-CB 3.35Å; I94-T98 WeakPolarHBondContact O-CG2 3.23Å; I94-T98 PolarHBondContact O-N 3.22Å; I94-T98 PolarHBondContact O-OG1 3.11Å; S95-T98 WeakPolarHBondContact CA-OG1 3.48Å; S95-T98 PolarHBondContact O-OG1 3.24Å; S95-T98 VanDerWaalsContact O-OG1 3.08Å; T98-Y102 WeakPolarHBondContact O-CB 3.49Å
99	F	32.4	Very low	33.5	Very low	69 Å²	69	103.2 Å²	103.2	30%	0.303	52%	0.522	S	S	.	.	H	α-helix	trans	-72	-41	173.3	-178.1	-97.9	0	0	0	112.6	S95 M96 K97 I121 L124	S95-F99 VanDerWaalsContact O-CB 3.31Å; S95-F99 WeakPolarHBondContact O-CB 3.19Å; S95-F99 PolarHBondContact O-N 3.31Å; M96-F99 CarbonylContact O-C 3.59Å; M96-F99 WeakPolarHBondContact O-CB 3.12Å; M96-F99 PolarHBondContact O-N 3.07Å; K97-F99 PolarHBondContact O-N 3.26Å; F99-I121 HydrophobicContact CE2-CG1 4.41Å; F99-I121 HydrophobicContact CZ-CG1 4.5Å; F99-L124 HydrophobicContact CD2-CD1 4.37Å
100	T	33.9	Very low	33.3	Very low	61 Å²	61	106 Å²	106	37%	0.374	54%	0.539	S	S	.	.	H	α-helix	trans	-75	-45.3	178.8	53.6	0	0	0	0	112.9	M96 K97 Y102 H103 D104	M96-T100 WeakPolarHBondContact O-CG2 3.48Å; M96-T100 PolarHBondContact O-N 3.26Å; M96-T100 PolarHBondContact O-OG1 3.42Å; K97-T100 WeakPolarHBondContact CA-OG1 3.45Å; K97-T100 PolarHBondContact O-N 2.69Å; K97-T100 PolarHBondContact O-OG1 2.93Å; K97-T100 VanDerWaalsContact O-OG1 3.11Å; T100-Y102 PolarHBondContact O-N 3.42Å; T100-H103 PolarHBondContact O-N 3.25Å; T100-H103 VanDerWaalsContact O-N 3.11Å; T100-D104 PolarHBondContact O-N 2.9Å
101	D	36.2	Very low	33.4	Very low	89 Å²	89	106.9 Å²	106.9	48%	0.476	55%	0.548	S	S	.	.	H	α-helix	trans	-67.4	-24.6	-175.3	-65.9	-7.5	0	0	0	112.1	K97	K97-D101 WeakPolarHBondContact CG-OD2 3.41Å; K97-D101 VanDerWaalsContact O-CB 3.27Å; K97-D101 WeakPolarHBondContact O-CB 3.04Å; K97-D101 PolarHBondContact O-N 3.35Å
102	Y	33.3	Very low	33.3	Very low	148 Å²	148	107 Å²	107	58%	0.58	55%	0.548	S	S	*	.	H	α-helix	trans	-83.4	-25.4	176.5	-144	-91.8	0	0	0	112.9	T98 T100	T98-Y102 WeakPolarHBondContact O-CB 3.49Å; T100-Y102 PolarHBondContact O-N 3.42Å
103	H	35.7	Very low	33.1	Very low	119 Å²	119	109 Å²	109	55%	0.551	56%	0.557	S	S	*	*	H	α-helix	trans	-84.8	-21.8	-176.8	-134.1	-57.3	0	0	0	113.3	T100	T100-H103 PolarHBondContact O-N 3.25Å; T100-H103 VanDerWaalsContact O-N 3.11Å
104	D	37	Very low	33.2	Very low	143 Å²	143	107 Å²	107	77%	0.765	55%	0.549	S	S	*	.	S	Bend	trans	-81.5	-14.8	177.6	-75.1	-19.7	0	0	0	113.6	T100	T100-D104 PolarHBondContact O-N 2.9Å
105	N	35.8	Very low	33.4	Very low	131 Å²	131	105.7 Å²	105.7	70%	0.701	54%	0.542	S	S	*	.	S	Bend	trans	-112.7	4.7	-166.6	-93.7	-32.3	0	0	0	117.5
106	N	31.7	Very low	33.4	Very low	111 Å²	111	106.3 Å²	106.3	59%	0.594	54%	0.541	S	S	*	.			trans	-152.2	86.8	176.1	-100.7	-49.3	0	0	0	114.4	N108	N106-N108 PolarHBondContact O-N 3.47Å
107	N	32.2	Very low	33.6	Very low	144 Å²	144	104.4 Å²	104.4	77%	0.77	53%	0.532	S	S	*	.			trans	-91.1	26.8	-175	-135.7	-8.3	0	0	0	114.5
108	N	32.4	Very low	33.7	Very low	137 Å²	137	99.7 Å²	99.7	73%	0.733	51%	0.514	S	S	*	.	S	Bend	trans	-148.8	71.4	-176.2	-82.4	-35.1	0	0	0	112.9	N106	N106-N108 PolarHBondContact O-N 3.47Å
109	N	31.3	Very low	34	Very low	139 Å²	139	98.1 Å²	98.1	74%	0.743	50%	0.501	S	S	*	.			trans	-172.1	71.9	157.1	-90.5	-32.3	0	0	0	111	H111	N109-H111 PolarHBondContact O-N 2.72Å
110	N	30.4	Very low	34.6	Very low	126 Å²	126	99.7 Å²	99.7	67%	0.674	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	23.1	-154.7	-71.6	-12.6	0	0	0	118.7
111	H	31.8	Very low	35.2	Very low	150 Å²	150	97.8 Å²	97.8	69%	0.694	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.9	-16.1	-179.6	-134.3	-47.1	0	0	0	116.8	N109	N109-H111 PolarHBondContact O-N 2.72Å
112	L	30.4	Very low	35.7	Very low	102 Å²	102	98 Å²	98	53%	0.534	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-33	180	-101.1	72.3	0	0	0	113.1	M371	L112-M371 HydrophobicContact CD2-CE 3.18Å; L112-M371 HydrophobicContact CD2-SD 3.83Å; L112-M371 HydrophobicContact CG-CE 4.23Å; L112-M371 HydrophobicContact CG-SD 4.48Å
113	H	32.4	Very low	36.4	Very low	93 Å²	93	96.1 Å²	96.1	43%	0.431	49%	0.488	S	S	.	.	H	α-helix	trans	-68.8	-38.2	-179.7	-96.5	29.5	0	0	0	112.7	N115 I116 D117	H113-N115 PolarHBondContact O-N 2.71Å; H113-I116 PolarHBondContact O-N 2.74Å; H113-D117 PolarHBondContact O-N 2.67Å
114	T	33.8	Very low	37	Very low	48 Å²	48	92.2 Å²	92.2	29%	0.294	47%	0.471	S	S	.	.	H	α-helix	trans	-54.2	-24.7	179.2	54.6	0	0	0	0	114.5	N118	T114-N118 WeakPolarHBondContact O-CB 3.12Å; T114-N118 PolarHBondContact O-N 3.01Å; T114-N118 PolarHBondContact O-ND2 3.3Å
115	N	35.1	Very low	37.3	Very low	57 Å²	57	85.8 Å²	85.8	31%	0.305	44%	0.436	S	S	.	.	H	α-helix	trans	-92.2	-21.5	-179.4	-81.9	-24.8	0	0	0	114.8	H113 N368	H113-N115 PolarHBondContact O-N 2.71Å; N115-N368 PolarHBondContact O-ND2 3.47Å
116	I	34.9	Very low	37.9	Very low	67 Å²	67	81.6 Å²	81.6	34%	0.344	41%	0.412	S	S	.	.	H	α-helix	trans	-80.4	-43.1	170.2	-68.7	165.9	0	0	0	108.3	H113 N118 I119 H120 N368	H113-I116 PolarHBondContact O-N 2.74Å; I116-N118 VanDerWaalsContact C-N 3.28Å; I116-N118 PolarHBondContact O-N 3.46Å; I116-I119 PolarHBondContact O-N 3.37Å; I116-H120 PolarHBondContact O-CD2 3.23Å; I116-H120 PolarHBondContact O-N 2.92Å; I116-N368 WeakPolarHBondContact CG1-OD1 3.46Å
117	D	37.2	Very low	38.6	Very low	41 Å²	41	80.2 Å²	80.2	22%	0.219	40%	0.402	C	S	.	.	H	α-helix	trans	-58.2	-41.1	175	-57.8	-28.8	0	0	0	110.6	H113 I119 H120 I121	H113-D117 PolarHBondContact O-N 2.67Å; D117-I119 PolarHBondContact O-N 2.89Å; D117-H120 PolarHBondContact O-N 3.36Å; D117-I121 HydrophobicContact CB-CD1 4.2Å; D117-I121 VanDerWaalsContact O-CB 3.22Å; D117-I121 WeakPolarHBondContact O-CB 3.34Å; D117-I121 VanDerWaalsContact O-CD1 3.32Å; D117-I121 WeakPolarHBondContact O-CD1 3.35Å; D117-I121 WeakPolarHBondContact O-CG1 3.38Å; D117-I121 PolarHBondContact O-N 3.1Å
118	N	36.9	Very low	39	Very low	35 Å²	35	74.4 Å²	74.4	19%	0.187	37%	0.372	C	S	.	.	H	α-helix	trans	-61.3	-38.2	178.3	-81.1	-30.3	0	0	0	114.1	T114 I116 I121 W122	T114-N118 WeakPolarHBondContact O-CB 3.12Å; T114-N118 PolarHBondContact O-N 3.01Å; T114-N118 PolarHBondContact O-ND2 3.3Å; I116-N118 VanDerWaalsContact C-N 3.28Å; I116-N118 PolarHBondContact O-N 3.46Å; N118-I121 PolarHBondContact O-N 3.5Å; N118-W122 WeakPolarHBondContact O-CB 3.27Å; N118-W122 PolarHBondContact O-N 2.89Å
119	I	39.7	Very low	39.5	Very low	50 Å²	50	71.7 Å²	71.7	26%	0.256	36%	0.357	S	S	.	.	H	α-helix	trans	-72.1	-42.3	178.6	-67	-176	0	0	0	110.4	I116 D117 I121 W122 Q123 L364 N368	I116-I119 PolarHBondContact O-N 3.37Å; D117-I119 PolarHBondContact O-N 2.89Å; I119-I121 VanDerWaalsContact C-N 3.33Å; I119-W122 PolarHBondContact O-N 3.06Å; I119-Q123 WeakPolarHBondContact O-CB 3.49Å; I119-Q123 PolarHBondContact O-N 3.49Å; I119-L364 HydrophobicContact CD1-CD2 4.03Å; I119-L364 HydrophobicContact CD1-CG 4.4Å; I119-L364 HydrophobicContact CG1-CD2 3.61Å; I119-L364 HydrophobicContact CG1-CG 4.44Å; I119-N368 HydrophobicContact CD1-CB 4.32Å; I119-N368 WeakPolarHBondContact CD1-ND2 3.2Å
120	H	44.8	Very low	40	Very low	102 Å²	102	65.9 Å²	65.9	47%	0.472	33%	0.326	S	S	.	.	H	α-helix	trans	-64.7	-37.8	173.7	-78.1	-72.3	0	0	0	111.7	I116 D117 Q123 L124	I116-H120 PolarHBondContact O-CD2 3.23Å; I116-H120 PolarHBondContact O-N 2.92Å; D117-H120 PolarHBondContact O-N 3.36Å; H120-Q123 PolarHBondContact O-N 2.82Å; H120-L124 WeakPolarHBondContact O-CB 3.36Å; H120-L124 WeakPolarHBondContact O-CD1 3.31Å; H120-L124 PolarHBondContact O-N 2.85Å
121	I	45.9	Very low	40.5	Very low	21 Å²	21	61.4 Å²	61.4	11%	0.108	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-43.2	172.5	-71.9	162	0	0	0	110.2	F99 D117 N118 I119 L124 L125 T147	F99-I121 HydrophobicContact CE2-CG1 4.41Å; F99-I121 HydrophobicContact CZ-CG1 4.5Å; D117-I121 HydrophobicContact CB-CD1 4.2Å; D117-I121 VanDerWaalsContact O-CB 3.22Å; D117-I121 WeakPolarHBondContact O-CB 3.34Å; D117-I121 VanDerWaalsContact O-CD1 3.32Å; D117-I121 WeakPolarHBondContact O-CD1 3.35Å; D117-I121 WeakPolarHBondContact O-CG1 3.38Å; D117-I121 PolarHBondContact O-N 3.1Å; N118-I121 PolarHBondContact O-N 3.5Å; I119-I121 VanDerWaalsContact C-N 3.33Å; I121-L124 PolarHBondContact O-N 2.73Å; I121-L125 HydrophobicContact CG2-CD1 3.82Å; I121-L125 HydrophobicContact CG2-CG 4.26Å; I121-L125 WeakPolarHBondContact O-CA 3.5Å; I121-L125 WeakPolarHBondContact O-CB 3.28Å; I121-L125 WeakPolarHBondContact O-CG 3.44Å; I121-L125 PolarHBondContact O-N 3.4Å; I121-T147 HydrophobicContact CG2-CG2 3.67Å
122	W	46.9	Very low	40.8	Very low	94 Å²	94	60.3 Å²	60.3	36%	0.356	30%	0.302	S	S	.	.	H	α-helix	trans	-68.7	-35.8	176.1	-83.6	108.8	0	0	0	112.8	N118 I119 L125 F126 T147 I149	N118-W122 WeakPolarHBondContact O-CB 3.27Å; N118-W122 PolarHBondContact O-N 2.89Å; I119-W122 PolarHBondContact O-N 3.06Å; W122-L125 HydrophobicContact CD2-CD1 4.35Å; W122-L125 HydrophobicContact CE3-CD1 4.15Å; W122-L125 HydrophobicContact CZ3-CD1 4.36Å; W122-F126 WeakPolarHBondContact O-CB 3.41Å; W122-F126 PolarHBondContact O-N 3.11Å; W122-T147 HydrophobicContact CZ2-CG2 4.21Å; W122-I149 HydrophobicContact CZ2-CD1 4.08Å
123	Q	48.7	Very low	41.2	Very low	109 Å²	109	56.8 Å²	56.8	51%	0.509	29%	0.287	S	S	.	.	H	α-helix	trans	-69.7	-41.9	174.5	-164.8	172.1	-11.1	0	0	111.1	I119 H120 F126 E127	I119-Q123 WeakPolarHBondContact O-CB 3.49Å; I119-Q123 PolarHBondContact O-N 3.49Å; H120-Q123 PolarHBondContact O-N 2.82Å; Q123-F126 PolarHBondContact O-N 2.83Å; Q123-E127 VanDerWaalsContact O-CB 3.22Å; Q123-E127 WeakPolarHBondContact O-CB 3.48Å; Q123-E127 WeakPolarHBondContact O-CG 2.95Å; Q123-E127 PolarHBondContact O-N 2.73Å
124	L	47.1	Very low	41.3	Very low	37 Å²	37	59.7 Å²	59.7	19%	0.194	30%	0.304	C	S	.	.	H	α-helix	trans	-66.2	-38.3	172.3	-90.9	151.1	0	0	0	112.1	F99 H120 I121 S128	F99-L124 HydrophobicContact CD2-CD1 4.37Å; H120-L124 WeakPolarHBondContact O-CB 3.36Å; H120-L124 WeakPolarHBondContact O-CD1 3.31Å; H120-L124 PolarHBondContact O-N 2.85Å; I121-L124 PolarHBondContact O-N 2.73Å; L124-S128 WeakPolarHBondContact O-CA 3.41Å; L124-S128 WeakPolarHBondContact O-CB 3.46Å; L124-S128 PolarHBondContact O-N 3.22Å; L124-S128 PolarHBondContact O-OG 2.93Å
125	L	44.4	Very low	41.7	Very low	8 Å²	8	59.6 Å²	59.6	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-45.1	174	-87.2	170.8	0	0	0	110.3	I121 W122 S128 L129 L143 T147	I121-L125 HydrophobicContact CG2-CD1 3.82Å; I121-L125 HydrophobicContact CG2-CG 4.26Å; I121-L125 WeakPolarHBondContact O-CA 3.5Å; I121-L125 WeakPolarHBondContact O-CB 3.28Å; I121-L125 WeakPolarHBondContact O-CG 3.44Å; I121-L125 PolarHBondContact O-N 3.4Å; W122-L125 HydrophobicContact CD2-CD1 4.35Å; W122-L125 HydrophobicContact CE3-CD1 4.15Å; W122-L125 HydrophobicContact CZ3-CD1 4.36Å; L125-S128 PolarHBondContact O-N 2.84Å; L125-L129 WeakPolarHBondContact O-CB 3.02Å; L125-L129 WeakPolarHBondContact O-CD1 3.37Å; L125-L129 WeakPolarHBondContact O-CG 3.2Å; L125-L129 PolarHBondContact O-N 3.23Å; L125-L143 HydrophobicContact CD2-CB 3.63Å; L125-L143 HydrophobicContact CD2-CD1 4.24Å; L125-L143 HydrophobicContact CD2-CD2 4.45Å; L125-L143 HydrophobicContact CD2-CG 4.34Å; L125-T147 HydrophobicContact CD1-CG2 4.11Å
126	F	48	Very low	41.9	Very low	43 Å²	43	60.7 Å²	60.7	19%	0.189	31%	0.308	C	S	.	.	H	α-helix	trans	-64.6	-50.5	176.9	-169.2	-107.8	0	0	0	110.6	W122 Q123 S128 L129 L130 Q262 W348	W122-F126 WeakPolarHBondContact O-CB 3.41Å; W122-F126 PolarHBondContact O-N 3.11Å; Q123-F126 PolarHBondContact O-N 2.83Å; F126-S128 VanDerWaalsContact C-N 3.35Å; F126-S128 PolarHBondContact O-N 3.46Å; F126-L129 PolarHBondContact O-N 3.42Å; F126-L130 HydrophobicContact CD1-CD1 3.32Å; F126-L130 HydrophobicContact CD2-CD1 4.24Å; F126-L130 HydrophobicContact CE1-CD1 3.26Å; F126-L130 HydrophobicContact CE2-CD1 4.18Å; F126-L130 HydrophobicContact CG-CD1 3.84Å; F126-L130 HydrophobicContact CZ-CD1 3.72Å; F126-L130 VanDerWaalsContact O-CB 3.28Å; F126-L130 WeakPolarHBondContact O-CB 3.34Å; F126-L130 WeakPolarHBondContact O-CD1 3.44Å; F126-L130 WeakPolarHBondContact O-CG 3.39Å; F126-L130 PolarHBondContact O-N 2.91Å; F126-Q262 HydrophobicContact CE1-CB 4.41Å; F126-W348 HydrophobicContact CD2-CZ2 4.25Å; F126-W348 HydrophobicContact CE2-CD2 4.1Å; F126-W348 AromaticContact CE2-CE2 3.74Å; F126-W348 HydrophobicContact CE2-CE3 4.46Å; F126-W348 HydrophobicContact CE2-CH2 4.2Å; F126-W348 AromaticContact CE2-CZ2 3.78Å; F126-W348 HydrophobicContact CE2-CZ2 3.78Å; F126-W348 HydrophobicContact CZ-CH2 4.43Å; F126-W348 HydrophobicContact CZ-CZ2 4.35Å
127	E	47.1	Very low	42.1	Very low	82 Å²	82	62.9 Å²	62.9	38%	0.383	32%	0.324	S	S	.	.	H	α-helix	trans	-56.6	-45	173.1	-74	-85.8	152	0	0	111.4	Q123 L130 T131	Q123-E127 VanDerWaalsContact O-CB 3.22Å; Q123-E127 WeakPolarHBondContact O-CB 3.48Å; Q123-E127 WeakPolarHBondContact O-CG 2.95Å; Q123-E127 PolarHBondContact O-N 2.73Å; E127-L130 CarbonylContact O-C 3.54Å; E127-L130 PolarHBondContact O-N 3.29Å; E127-L130 VanDerWaalsContact O-N 3.13Å; E127-T131 WeakPolarHBondContact O-CB 3.22Å; E127-T131 WeakPolarHBondContact O-CG2 3.48Å; E127-T131 PolarHBondContact O-N 3.33Å; E127-T131 PolarHBondContact O-OG1 3.27Å
128	S	40.8	Very low	42.4	Very low	21 Å²	21	67.5 Å²	67.5	15%	0.147	35%	0.345	C	S	.	.	H	α-helix	trans	-70.9	-35.6	-179.1	-62.6	0	0	0	0	113.1	L124 L125 F126 L130	L124-S128 WeakPolarHBondContact O-CA 3.41Å; L124-S128 WeakPolarHBondContact O-CB 3.46Å; L124-S128 PolarHBondContact O-N 3.22Å; L124-S128 PolarHBondContact O-OG 2.93Å; L125-S128 PolarHBondContact O-N 2.84Å; F126-S128 VanDerWaalsContact C-N 3.35Å; F126-S128 PolarHBondContact O-N 3.46Å; S128-L130 PolarHBondContact O-N 2.82Å
129	L	42.3	Very low	42.7	Very low	80 Å²	80	70.1 Å²	70.1	42%	0.419	36%	0.356	S	S	.	.	H	α-helix	trans	-64	-32	170	-82	162.3	0	0	0	111.5	L125 F126 L140	L125-L129 WeakPolarHBondContact O-CB 3.02Å; L125-L129 WeakPolarHBondContact O-CD1 3.37Å; L125-L129 WeakPolarHBondContact O-CG 3.2Å; L125-L129 PolarHBondContact O-N 3.23Å; F126-L129 PolarHBondContact O-N 3.42Å; L129-L140 HydrophobicContact CD2-CD1 3.72Å; L129-L140 HydrophobicContact CG-CD1 4.26Å
130	L	41	Very low	42.7	Very low	18 Å²	18	70.2 Å²	70.2	9%	0.094	36%	0.356	C	S	.	.	H	α-helix	trans	-86.8	-22.6	-176.6	-71	165.8	0	0	0	113.9	F126 E127 S128 H266	F126-L130 HydrophobicContact CD1-CD1 3.32Å; F126-L130 HydrophobicContact CD2-CD1 4.24Å; F126-L130 HydrophobicContact CE1-CD1 3.26Å; F126-L130 HydrophobicContact CE2-CD1 4.18Å; F126-L130 HydrophobicContact CG-CD1 3.84Å; F126-L130 HydrophobicContact CZ-CD1 3.72Å; F126-L130 VanDerWaalsContact O-CB 3.28Å; F126-L130 WeakPolarHBondContact O-CB 3.34Å; F126-L130 WeakPolarHBondContact O-CD1 3.44Å; F126-L130 WeakPolarHBondContact O-CG 3.39Å; F126-L130 PolarHBondContact O-N 2.91Å; E127-L130 CarbonylContact O-C 3.54Å; E127-L130 PolarHBondContact O-N 3.29Å; E127-L130 VanDerWaalsContact O-N 3.13Å; S128-L130 PolarHBondContact O-N 2.82Å; L130-H266 HydrophobicContact CD2-CB 3.87Å
131	T	41	Very low	42.5	Very low	31 Å²	31	69.9 Å²	69.9	19%	0.19	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	23.2	-161.9	59.6	0	0	0	0	116	F88 E127 S133	F88-T131 VanDerWaalsContact CE1-CB 3.43Å; F88-T131 HydrophobicContact CE1-CG2 3.84Å; F88-T131 HydrophobicContact CE2-CG2 3.7Å; F88-T131 HydrophobicContact CZ-CG2 3.06Å; E127-T131 WeakPolarHBondContact O-CB 3.22Å; E127-T131 WeakPolarHBondContact O-CG2 3.48Å; E127-T131 PolarHBondContact O-N 3.33Å; E127-T131 PolarHBondContact O-OG1 3.27Å; T131-S133 PolarHBondContact O-N 3.22Å; T131-S133 VanDerWaalsContact O-N 3.08Å
132	N	38.1	Very low	42.4	Very low	127 Å²	127	71.8 Å²	71.8	68%	0.679	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	14.8	162	-122.8	3.9	0	0	0	116.5	K341	N132-K341 PolarHBondContact OD1-NZ 3.21Å
133	S	38.4	Very low	42	Very low	29 Å²	29	70.1 Å²	70.1	20%	0.203	37%	0.368	C	S	.	.			trans	-90.8	135.8	173.3	61.1	0	0	0	0	111.7	K92 T131 L135	K92-S133 PolarHBondContact NZ-OG 3.08Å; T131-S133 PolarHBondContact O-N 3.22Å; T131-S133 VanDerWaalsContact O-N 3.08Å; S133-L135 PolarHBondContact O-N 3.2Å
134	L	36.2	Very low	41.5	Very low	153 Å²	153	67.6 Å²	67.6	80%	0.801	36%	0.358	S	S	*	.			trans	-44.3	68.2	177.8	-80.5	81.9	0	0	0	114.7	N136 Q139	L134-N136 PolarHBondContact O-N 2.91Å; L134-N136 PolarHBondContact O-OD1 3.47Å; L134-Q139 PolarHBondContact O-OE1 2.86Å
135	L	41.2	Very low	41.1	Very low	46 Å²	46	69.8 Å²	69.8	24%	0.241	38%	0.376	C	S	.	.			trans	-84	97.3	159.4	-85	127	0	0	0	107.5	S133 Q139 L140 L143	S133-L135 PolarHBondContact O-N 3.2Å; L135-Q139 HydrophobicContact CB-CB 4.49Å; L135-Q139 HydrophobicContact CD2-CB 3.71Å; L135-Q139 HydrophobicContact CG-CB 4.37Å; L135-L140 HydrophobicContact CB-CD1 4.41Å; L135-L143 HydrophobicContact CD2-CD1 3.22Å
136	N	39.2	Very low	40.7	Very low	81 Å²	81	76.8 Å²	76.8	43%	0.433	41%	0.407	S	S	.	.			trans	-53.8	153.5	169.1	-43.5	-0.2	0	0	0	108	L134 E138 Q139 L140	L134-N136 PolarHBondContact O-N 2.91Å; L134-N136 PolarHBondContact O-OD1 3.47Å; N136-E138 PolarHBondContact O-N 3.44Å; N136-E138 VanDerWaalsContact O-N 3.09Å; N136-Q139 HydrophobicContact CB-CG 4.27Å; N136-Q139 WeakPolarHBondContact O-CA 3.43Å; N136-Q139 PolarHBondContact O-N 3.05Å; N136-L140 PolarHBondContact O-N 2.73Å
137	T	38.4	Very low	40	Very low	112 Å²	112	74.9 Å²	74.9	69%	0.687	40%	0.399	S	S	*	.	H	α-helix	trans	-46.9	-40.9	174.2	27.8	0	0	0	0	112.4	Q139 L140 E141	T137-Q139 PolarHBondContact O-N 3.37Å; T137-L140 PolarHBondContact O-N 3.04Å; T137-E141 WeakPolarHBondContact O-CB 3.39Å; T137-E141 VanDerWaalsContact O-CG 3.28Å; T137-E141 WeakPolarHBondContact O-CG 3.27Å; T137-E141 PolarHBondContact O-N 2.93Å
138	E	45	Very low	39.4	Very low	139 Å²	139	81.6 Å²	81.6	65%	0.65	42%	0.421	S	S	*	.	H	α-helix	trans	-64.6	-34.2	175.8	-71.7	-179.7	159.9	0	0	114.4	N136 S142	N136-E138 PolarHBondContact O-N 3.44Å; N136-E138 VanDerWaalsContact O-N 3.09Å; E138-S142 WeakPolarHBondContact O-CB 3.38Å; E138-S142 PolarHBondContact O-N 2.92Å; E138-S142 PolarHBondContact O-OG 2.72Å
139	Q	41.8	Very low	39.1	Very low	89 Å²	89	84 Å²	84	42%	0.416	43%	0.431	S	S	.	.	H	α-helix	trans	-78.6	-35	179.2	-64	-178.4	-27.1	0	0	111	L134 L135 N136 T137 S142 L143	L134-Q139 PolarHBondContact O-OE1 2.86Å; L135-Q139 HydrophobicContact CB-CB 4.49Å; L135-Q139 HydrophobicContact CD2-CB 3.71Å; L135-Q139 HydrophobicContact CG-CB 4.37Å; N136-Q139 HydrophobicContact CB-CG 4.27Å; N136-Q139 WeakPolarHBondContact O-CA 3.43Å; N136-Q139 PolarHBondContact O-N 3.05Å; T137-Q139 PolarHBondContact O-N 3.37Å; Q139-S142 PolarHBondContact O-N 3.38Å; Q139-L143 PolarHBondContact O-N 3.19Å
140	L	40.4	Very low	38.7	Very low	52 Å²	52	82.7 Å²	82.7	27%	0.272	43%	0.429	S	S	.	.	H	α-helix	trans	-63.9	-45.2	169.6	-154.4	96	0	0	0	110.6	L129 L135 N136 T137 L143 L144	L129-L140 HydrophobicContact CD2-CD1 3.72Å; L129-L140 HydrophobicContact CG-CD1 4.26Å; L135-L140 HydrophobicContact CB-CD1 4.41Å; N136-L140 PolarHBondContact O-N 2.73Å; T137-L140 PolarHBondContact O-N 3.04Å; L140-L143 PolarHBondContact O-N 3.23Å; L140-L144 HydrophobicContact CD2-CD1 3.93Å; L140-L144 HydrophobicContact CG-CD1 4.15Å; L140-L144 VanDerWaalsContact O-CB 3.3Å; L140-L144 WeakPolarHBondContact O-CB 3.36Å; L140-L144 WeakPolarHBondContact O-CD1 3.47Å; L140-L144 WeakPolarHBondContact O-CG 3.38Å; L140-L144 PolarHBondContact O-N 3.49Å
141	E	40.1	Very low	38.3	Very low	96 Å²	96	88 Å²	88	45%	0.449	45%	0.453	S	S	.	.	H	α-helix	trans	-63	-39.4	174.9	-77.8	-178.3	163.8	0	0	112.1	T137 L144 S145 Q151	T137-E141 WeakPolarHBondContact O-CB 3.39Å; T137-E141 VanDerWaalsContact O-CG 3.28Å; T137-E141 WeakPolarHBondContact O-CG 3.27Å; T137-E141 PolarHBondContact O-N 2.93Å; E141-L144 PolarHBondContact O-N 3.39Å; E141-S145 WeakPolarHBondContact O-CB 3.21Å; E141-S145 PolarHBondContact O-N 3.46Å; E141-Q151 PolarHBondContact OE1-NE2 3.42Å
142	S	43.8	Very low	37.9	Very low	61 Å²	61	92.1 Å²	92.1	43%	0.427	47%	0.474	S	S	.	.	H	α-helix	trans	-64.1	-45.4	173.9	-67.8	0	0	0	0	111.7	E138 Q139 S145 F146	E138-S142 WeakPolarHBondContact O-CB 3.38Å; E138-S142 PolarHBondContact O-N 2.92Å; E138-S142 PolarHBondContact O-OG 2.72Å; Q139-S142 PolarHBondContact O-N 3.38Å; S142-S145 WeakPolarHBondContact O-CB 3.19Å; S142-S145 PolarHBondContact O-N 3.41Å; S142-S145 VanDerWaalsContact O-N 3.12Å; S142-S145 PolarHBondContact O-OG 3.15Å; S142-F146 VanDerWaalsContact O-CD2 3.24Å; S142-F146 WeakPolarHBondContact O-CD2 3.4Å; S142-F146 PolarHBondContact O-N 3.02Å
143	L	38.8	Very low	37.6	Very low	59 Å²	59	89.8 Å²	89.8	31%	0.309	46%	0.461	S	S	.	.	H	α-helix	trans	-67.8	-36.4	176.8	-84.3	152.1	0	0	0	112.9	L125 L135 Q139 L140 S145 F146	L125-L143 HydrophobicContact CD2-CB 3.63Å; L125-L143 HydrophobicContact CD2-CD1 4.24Å; L125-L143 HydrophobicContact CD2-CD2 4.45Å; L125-L143 HydrophobicContact CD2-CG 4.34Å; L135-L143 HydrophobicContact CD2-CD1 3.22Å; Q139-L143 PolarHBondContact O-N 3.19Å; L140-L143 PolarHBondContact O-N 3.23Å; L143-S145 VanDerWaalsContact C-N 3.27Å; L143-S145 PolarHBondContact O-N 3.35Å; L143-F146 PolarHBondContact O-N 2.96Å
144	L	37.4	Very low	37.1	Very low	55 Å²	55	91.3 Å²	91.3	29%	0.288	47%	0.471	S	S	.	.	H	α-helix	trans	-62.7	-34.4	169.9	-87	150.7	0	0	0	111.5	L140 E141 F146 T147	L140-L144 HydrophobicContact CD2-CD1 3.93Å; L140-L144 HydrophobicContact CG-CD1 4.15Å; L140-L144 VanDerWaalsContact O-CB 3.3Å; L140-L144 WeakPolarHBondContact O-CB 3.36Å; L140-L144 WeakPolarHBondContact O-CD1 3.47Å; L140-L144 WeakPolarHBondContact O-CG 3.38Å; L140-L144 PolarHBondContact O-N 3.49Å; E141-L144 PolarHBondContact O-N 3.39Å; L144-F146 VanDerWaalsContact C-N 3.33Å; L144-F146 PolarHBondContact O-N 2.99Å; L144-T147 PolarHBondContact O-N 3.15Å; L144-T147 PolarHBondContact O-OG1 2.88Å
145	S	40.2	Very low	36.9	Very low	84 Å²	84	87.3 Å²	87.3	59%	0.587	46%	0.456	S	S	*	.	H	α-helix	trans	-70	-24.9	177.4	81.7	0	0	0	0	114.1	E141 S142 L143	E141-S145 WeakPolarHBondContact O-CB 3.21Å; E141-S145 PolarHBondContact O-N 3.46Å; S142-S145 WeakPolarHBondContact O-CB 3.19Å; S142-S145 PolarHBondContact O-N 3.41Å; S142-S145 VanDerWaalsContact O-N 3.12Å; S142-S145 PolarHBondContact O-OG 3.15Å; L143-S145 VanDerWaalsContact C-N 3.27Å; L143-S145 PolarHBondContact O-N 3.35Å
146	F	35.6	Very low	36.5	Very low	154 Å²	154	89.2 Å²	89.2	68%	0.675	47%	0.466	S	S	*	.	H	α-helix	trans	-76.9	-31.6	176	-86.6	-76	0	0	0	112.9	S142 L143 L144 R148	S142-F146 VanDerWaalsContact O-CD2 3.24Å; S142-F146 WeakPolarHBondContact O-CD2 3.4Å; S142-F146 PolarHBondContact O-N 3.02Å; L143-F146 PolarHBondContact O-N 2.96Å; L144-F146 VanDerWaalsContact C-N 3.33Å; L144-F146 PolarHBondContact O-N 2.99Å; F146-R148 PolarHBondContact O-N 3.36Å
147	T	34	Very low	36.2	Very low	4 Å²	4	88 Å²	88	3%	0.025	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	117.4	165.5	67.2	0	0	0	0	106.5	I121 W122 L125 L144 I149	I121-T147 HydrophobicContact CG2-CG2 3.67Å; W122-T147 HydrophobicContact CZ2-CG2 4.21Å; L125-T147 HydrophobicContact CD1-CG2 4.11Å; L144-T147 PolarHBondContact O-N 3.15Å; L144-T147 PolarHBondContact O-OG1 2.88Å; T147-I149 PolarHBondContact O-N 2.91Å
148	R	33.6	Very low	35.8	Very low	223 Å²	223	88.9 Å²	88.9	84%	0.842	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	46	179.7	-73.6	179.5	173.5	161.2	-1.8	113.7	F146	F146-R148 PolarHBondContact O-N 3.36Å
149	I	34	Very low	35.2	Very low	70 Å²	70	88.2 Å²	88.2	36%	0.359	45%	0.451	S	S	.	.	S	Bend	trans	-110.5	106.9	167.2	-63.4	173.1	0	0	0	103.7	W122 T147 D153	W122-I149 HydrophobicContact CZ2-CD1 4.08Å; T147-I149 PolarHBondContact O-N 2.91Å; I149-D153 HydrophobicContact CG2-CB 4.06Å
150	S	34.7	Very low	34.7	Very low	54 Å²	54	89.5 Å²	89.5	38%	0.378	46%	0.457	S	S	.	.			trans	-61.5	146.5	-176	74.2	0	0	0	0	109.8	N152 D153 C154	S150-N152 PolarHBondContact O-N 2.9Å; S150-D153 WeakPolarHBondContact CB-OD2 3.06Å; S150-D153 PolarHBondContact N-OD2 2.87Å; S150-D153 WeakPolarHBondContact O-CB 3.35Å; S150-D153 PolarHBondContact O-N 2.96Å; S150-D153 PolarHBondContact OG-N 2.88Å; S150-D153 VanDerWaalsContact OG-N 3.16Å; S150-D153 PolarHBondContact OG-OD2 2.78Å; S150-C154 PolarHBondContact O-N 2.62Å
151	Q	31.4	Very low	34.3	Very low	129 Å²	129	92.9 Å²	92.9	60%	0.603	47%	0.469	S	S	*	.	H	α-helix	trans	-47.7	-29.8	169.4	-113.8	172.3	-16.1	0	0	111.8	E141 S155	E141-Q151 PolarHBondContact OE1-NE2 3.42Å; Q151-S155 WeakPolarHBondContact O-CB 3.37Å; Q151-S155 PolarHBondContact O-N 3.31Å; Q151-S155 VanDerWaalsContact O-N 3.16Å
152	N	33.3	Very low	33.8	Very low	117 Å²	117	95 Å²	95	63%	0.626	48%	0.483	S	S	*	.	H	α-helix	trans	-69.1	-36.5	174.1	-77.6	-12.1	0	0	0	113.4	S150 N156	S150-N152 PolarHBondContact O-N 2.9Å; N152-N156 WeakPolarHBondContact O-CB 3.33Å; N152-N156 PolarHBondContact O-N 3.44Å; N152-N156 PolarHBondContact O-ND2 3.4Å; N152-N156 VanDerWaalsContact O-ND2 3.14Å
153	D	32.9	Very low	33.1	Very low	78 Å²	78	98.2 Å²	98.2	42%	0.417	49%	0.491	S	S	.	.	H	α-helix	trans	-70.9	-36.3	178.7	-61.4	-48.7	0	0	0	111.6	I149 S150 I157	I149-D153 HydrophobicContact CG2-CB 4.06Å; S150-D153 WeakPolarHBondContact CB-OD2 3.06Å; S150-D153 PolarHBondContact N-OD2 2.87Å; S150-D153 WeakPolarHBondContact O-CB 3.35Å; S150-D153 PolarHBondContact O-N 2.96Å; S150-D153 PolarHBondContact OG-N 2.88Å; S150-D153 VanDerWaalsContact OG-N 3.16Å; S150-D153 PolarHBondContact OG-OD2 2.78Å; D153-I157 WeakPolarHBondContact O-CB 3.38Å; D153-I157 VanDerWaalsContact O-CD1 3.23Å; D153-I157 WeakPolarHBondContact O-CD1 3.22Å; D153-I157 WeakPolarHBondContact O-CG1 3.18Å; D153-I157 PolarHBondContact O-N 2.82Å
154	C	27.3	Very low	32.5	Very low	61 Å²	61	97.4 Å²	97.4	41%	0.412	49%	0.489	S	S	.	.	H	α-helix	trans	-69.8	-39.6	174.8	-104.2	0	0	0	0	112.6	S150 F158	S150-C154 PolarHBondContact O-N 2.62Å; C154-F158 PolarHBondContact O-N 2.97Å
155	S	31.4	Very low	32.1	Very low	69 Å²	69	97.3 Å²	97.3	48%	0.483	49%	0.493	S	S	.	.	H	α-helix	trans	-71.4	-37.5	176.9	-149.7	0	0	0	0	111.7	Q151 F158 Q159	Q151-S155 WeakPolarHBondContact O-CB 3.37Å; Q151-S155 PolarHBondContact O-N 3.31Å; Q151-S155 VanDerWaalsContact O-N 3.16Å; S155-F158 WeakPolarHBondContact O-CB 3.28Å; S155-F158 PolarHBondContact O-N 3.34Å; S155-Q159 WeakPolarHBondContact O-CG 3.18Å; S155-Q159 PolarHBondContact O-N 3.44Å
156	N	33.7	Very low	31.6	Very low	86 Å²	86	100.5 Å²	100.5	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-67.4	-40.3	173.6	-71.5	-19.2	0	0	0	111.5	N152 F158 Q159 E160	N152-N156 WeakPolarHBondContact O-CB 3.33Å; N152-N156 PolarHBondContact O-N 3.44Å; N152-N156 PolarHBondContact O-ND2 3.4Å; N152-N156 VanDerWaalsContact O-ND2 3.14Å; N156-F158 PolarHBondContact O-N 3.41Å; N156-Q159 PolarHBondContact O-N 2.62Å; N156-Q159 VanDerWaalsContact O-N 3.15Å; N156-E160 WeakPolarHBondContact O-CA 3.29Å; N156-E160 WeakPolarHBondContact O-CB 2.98Å; N156-E160 PolarHBondContact O-N 3.13Å
157	I	32.1	Very low	31.4	Very low	55 Å²	55	97.1 Å²	97.1	28%	0.282	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-28.3	174.8	-70.7	163.2	0	0	0	112.2	D153	D153-I157 WeakPolarHBondContact O-CB 3.38Å; D153-I157 VanDerWaalsContact O-CD1 3.23Å; D153-I157 WeakPolarHBondContact O-CD1 3.22Å; D153-I157 WeakPolarHBondContact O-CG1 3.18Å; D153-I157 PolarHBondContact O-N 2.82Å
158	F	29.7	Very low	31	Very low	132 Å²	132	107.3 Å²	107.3	58%	0.579	53%	0.531	S	S	*	.	H	α-helix	trans	-77.6	-31.4	175.3	-121.6	-89.8	0	0	0	113.2	C154 S155 N156 L347	C154-F158 PolarHBondContact O-N 2.97Å; S155-F158 WeakPolarHBondContact O-CB 3.28Å; S155-F158 PolarHBondContact O-N 3.34Å; N156-F158 PolarHBondContact O-N 3.41Å; F158-L347 HydrophobicContact CE1-CD2 4.26Å; F158-L347 HydrophobicContact CE2-CD2 4.24Å; F158-L347 HydrophobicContact CZ-CD1 4.02Å; F158-L347 HydrophobicContact CZ-CD2 3.47Å; F158-L347 VanDerWaalsContact CZ-CD2 3.47Å; F158-L347 HydrophobicContact CZ-CG 4.29Å
159	Q	32.5	Very low	30.6	Very low	125 Å²	125	105.5 Å²	105.5	58%	0.584	53%	0.532	S	S	*	.	H	α-helix	trans	-86.4	-36.8	177.4	-72.3	-78.7	-19.8	0	0	112.3	S155 N156 K161 L162	S155-Q159 WeakPolarHBondContact O-CG 3.18Å; S155-Q159 PolarHBondContact O-N 3.44Å; N156-Q159 PolarHBondContact O-N 2.62Å; N156-Q159 VanDerWaalsContact O-N 3.15Å; Q159-K161 VanDerWaalsContact C-N 3.3Å; Q159-K161 PolarHBondContact O-N 2.94Å; Q159-L162 PolarHBondContact O-N 3.47Å
160	E	32.1	Very low	30.1	Very low	115 Å²	115	111.2 Å²	111.2	54%	0.537	56%	0.557	S	S	.	*	H	α-helix	trans	-75.4	-16	-174	-165.3	175.3	-161.9	0	0	112.7	N156 L162	N156-E160 WeakPolarHBondContact O-CA 3.29Å; N156-E160 WeakPolarHBondContact O-CB 2.98Å; N156-E160 PolarHBondContact O-N 3.13Å; E160-L162 VanDerWaalsContact C-N 3.35Å
161	K	32.5	Very low	29.7	Very low	124 Å²	124	115 Å²	115	54%	0.539	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.1	-1.5	171.3	-86.4	-173.1	173.5	-169	0	114.6	Q159 N350	Q159-K161 VanDerWaalsContact C-N 3.3Å; Q159-K161 PolarHBondContact O-N 2.94Å; K161-N350 PolarHBondContact NZ-O 3Å
162	L	28.8	Very low	29.2	Very low	141 Å²	141	118.3 Å²	118.3	74%	0.738	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-5.4	174.5	-86.3	149.5	0	0	0	113.5	Q159 E160	Q159-L162 PolarHBondContact O-N 3.47Å; E160-L162 VanDerWaalsContact C-N 3.35Å
163	Q	27.9	Very low	28.8	Very low	128 Å²	128	121.6 Å²	121.6	60%	0.598	60%	0.603	S	S	*	*	S	Bend	trans	-138.7	120.9	-179.3	-78.5	159.6	-32.7	0	0	110.7	L177	Q163-L177 HydrophobicContact CB-CD2 3.54Å; Q163-L177 WeakPolarHBondContact O-CD2 3.35Å
164	T	28	Very low	28.3	Very low	42 Å²	42	128.6 Å²	128.6	26%	0.258	63%	0.625	S	S	.	*			trans	79.2	104.9	150.5	55.8	0	0	0	0	123.1	L177 L180	T164-L177 HydrophobicContact CG2-CB 4.3Å; T164-L177 WeakPolarHBondContact OG1-CA 3.11Å; T164-L177 WeakPolarHBondContact OG1-CB 3.22Å; T164-L177 WeakPolarHBondContact OG1-CD2 3.32Å; T164-L177 WeakPolarHBondContact OG1-CG 3.15Å; T164-L180 HydrophobicContact CG2-CB 3.63Å
165	S	29.3	Very low	28.3	Very low	52 Å²	52	133.6 Å²	133.6	36%	0.364	65%	0.647	S	S	.	*			trans	-43.4	-153.6	158.3	49.1	0	0	0	0	121.6	L180	S165-L180 VanDerWaalsContact C-CD2 3.4Å; S165-L180 WeakPolarHBondContact O-CD1 3.34Å; S165-L180 WeakPolarHBondContact OG-CA 3.24Å; S165-L180 WeakPolarHBondContact OG-CB 3.24Å; S165-L180 WeakPolarHBondContact OG-CD2 3.12Å; S165-L180 PolarHBondContact OG-O 2.87Å
166	H	27.9	Very low	28	Very low	152 Å²	152	135 Å²	135	70%	0.704	65%	0.654	S	S	*	*			trans	-100.8	-170.2	-161	-90.5	-52.3	0	0	0	118.2	L180	H166-L180 VanDerWaalsContact N-CD2 3.31Å; H166-L180 WeakPolarHBondContact O-CD1 3.23Å; H166-L180 WeakPolarHBondContact O-CD2 3.25Å
167	P	32.6	Very low	27.5	Very low	82 Å²	82	134.2 Å²	134.2	53%	0.532	65%	0.649	S	S	.	*			cis	-141.1	174.9	-17.1	28.1	-3.2	0	0	0	116.9
168	Y	25.1	Very low	27.5	Very low	218 Å²	218	140 Å²	140	86%	0.855	68%	0.675	S	S	*	*			trans	70.9	103.5	163.1	-60.3	-75.9	0	0	0	119.6
169	E	25.8	Very low	27.6	Very low	186 Å²	186	142.2 Å²	142.2	87%	0.869	69%	0.688	S	S	*	*				-178.9	139.7	112.4	-99.5	178.2	179.1	0	0	110.1	T171	E169-T171 PolarHBondContact O-N 3.08Å; E169-T171 VanDerWaalsContact O-N 3.11Å
170	E	23.7	Very low	27.4	Very low	190 Å²	190	137.9 Å²	137.9	89%	0.888	67%	0.668	S	S	*	*			trans	-61.3	106.5	168.6	-68.8	171.5	141.7	0	0	108.9
171	T	24.9	Very low	27.3	Very low	133 Å²	133	136.7 Å²	136.7	82%	0.816	67%	0.672	S	S	*	*			trans	171.2	148.6	140.3	30.4	0	0	0	0	109.3	E169	E169-T171 PolarHBondContact O-N 3.08Å; E169-T171 VanDerWaalsContact O-N 3.11Å
172	F	22.1	Very low	27.2	Very low	199 Å²	199	138.9 Å²	138.9	87%	0.873	68%	0.684	S	S	*	*			trans	-45.5	148.6	173	-79.1	-108.4	0	0	0	112.7
173	Q	23.7	Very low	27.2	Very low	186 Å²	186	137.5 Å²	137.5	87%	0.869	67%	0.674	S	S	*	*			trans	118.2	115.2	151.6	-146.9	154	4.8	0	0	116.3
174	Y	23.6	Very low	27.3	Very low	225 Å²	225	133.8 Å²	133.8	88%	0.882	66%	0.662	S	S	*	*			trans	-14.5	149.3	171	-70.1	-96.4	0	0	0	121.7
175	L	25.9	Very low	27.4	Very low	166 Å²	166	139 Å²	139	87%	0.869	68%	0.684	S	S	*	*			trans	130.6	148.3	146	-81	139.1	0	0	0	115.7
176	P	25.5	Very low	27.4	Very low	99 Å²	99	144.7 Å²	144.7	64%	0.643	71%	0.705	S	S	*	*				-119.3	167	-111.8	8.8	16.1	0	0	0	119	E178	P176-E178 PolarHBondContact O-N 2.81Å
177	L	24.5	Very low	27.5	Very low	68 Å²	68	142.7 Å²	142.7	36%	0.356	70%	0.703	S	S	.	*			trans	-9.6	93.8	154.9	-65.5	84	0	0	0	119.2	Q163 T164	Q163-L177 HydrophobicContact CB-CD2 3.54Å; Q163-L177 WeakPolarHBondContact O-CD2 3.35Å; T164-L177 HydrophobicContact CG2-CB 4.3Å; T164-L177 WeakPolarHBondContact OG1-CA 3.11Å; T164-L177 WeakPolarHBondContact OG1-CB 3.22Å; T164-L177 WeakPolarHBondContact OG1-CD2 3.32Å; T164-L177 WeakPolarHBondContact OG1-CG 3.15Å
178	E	31.8	Very low	27.4	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.822	71%	0.708	S	S	*	*			trans	-153.3	-21.7	155.8	-123.8	154.5	-169.3	0	0	116.2	P176 L180	P176-E178 PolarHBondContact O-N 2.81Å; E178-L180 VanDerWaalsContact C-N 3.35Å; E178-L180 PolarHBondContact O-N 3.23Å
179	E	30.9	Very low	27.6	Very low	180 Å²	180	142.7 Å²	142.7	84%	0.841	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	13.8	-172.6	-84.6	-175.3	147.5	0	0	116.6
180	L	28.3	Very low	27.9	Very low	33 Å²	33	138.5 Å²	138.5	17%	0.173	70%	0.695	C	S	.	*	T	Hydrogen-bonded Turn	trans	-134.7	19.4	-158.2	-78.3	159.3	0	0	0	114.3	T164 S165 H166 E178	T164-L180 HydrophobicContact CG2-CB 3.63Å; S165-L180 VanDerWaalsContact C-CD2 3.4Å; S165-L180 WeakPolarHBondContact O-CD1 3.34Å; S165-L180 WeakPolarHBondContact OG-CA 3.24Å; S165-L180 WeakPolarHBondContact OG-CB 3.24Å; S165-L180 WeakPolarHBondContact OG-CD2 3.12Å; S165-L180 PolarHBondContact OG-O 2.87Å; H166-L180 VanDerWaalsContact N-CD2 3.31Å; H166-L180 WeakPolarHBondContact O-CD1 3.23Å; H166-L180 WeakPolarHBondContact O-CD2 3.25Å; E178-L180 VanDerWaalsContact C-N 3.35Å; E178-L180 PolarHBondContact O-N 3.23Å
181	S	29.7	Very low	28.2	Very low	90 Å²	90	136 Å²	136	63%	0.629	69%	0.688	S	S	*	*	S	Bend	trans	-78.9	-2.1	157.1	-173.9	0	0	0	0	112.8
182	Q	30.4	Very low	28.3	Very low	170 Å²	170	133.3 Å²	133.3	79%	0.794	69%	0.687	S	S	*	*	S	Bend	trans	-107.5	-18.5	-177	-68.2	-175.7	15.4	0	0	115.2
183	Q	29.2	Very low	28.9	Very low	112 Å²	112	128.3 Å²	128.3	52%	0.523	67%	0.669	S	S	.	*	S	Bend	trans	-95	-11.8	178.4	-97.9	179.3	-1.8	0	0	114.9	Q185 Q186	Q183-Q185 PolarHBondContact O-N 3.01Å; Q183-Q186 PolarHBondContact O-N 3.28Å
184	S	30.4	Very low	29.2	Very low	50 Å²	50	127.8 Å²	127.8	35%	0.35	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.4	-15.6	175.3	64	0	0	0	0	113.4	Q186 H188	S184-Q186 PolarHBondContact O-N 2.81Å; S184-H188 PolarHBondContact O-CD2 3.45Å
185	Q	29.9	Very low	29.7	Very low	153 Å²	153	119.9 Å²	119.9	72%	0.715	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-7.7	176.9	-78.5	176	-2.1	0	0	114.7	Q183	Q183-Q185 PolarHBondContact O-N 3.01Å
186	Q	29.2	Very low	29.9	Very low	170 Å²	170	119 Å²	119	79%	0.794	64%	0.642	S	S	*	*	S	Bend	trans	-107.3	-7.4	-179.9	-78.8	-179.9	-4.4	0	0	115.3	Q183 S184	Q183-Q186 PolarHBondContact O-N 3.28Å; S184-Q186 PolarHBondContact O-N 2.81Å
187	T	29.4	Very low	30.4	Very low	110 Å²	110	117.5 Å²	117.5	68%	0.675	63%	0.628	S	S	*	*	S	Bend	trans	-108	6.3	174.3	55.3	0	0	0	0	113.9	E189	T187-E189 VanDerWaalsContact C-N 3.33Å
188	H	31.5	Very low	30.8	Very low	137 Å²	137	119.2 Å²	119.2	63%	0.634	64%	0.638	S	S	*	*	S	Bend	trans	-87.8	10.4	177.5	-90.7	-55.3	0	0	0	114.6	S184	S184-H188 PolarHBondContact O-CD2 3.45Å
189	E	29	Very low	31.4	Very low	164 Å²	164	114.3 Å²	114.3	77%	0.766	62%	0.623	S	S	*	*	S	Bend	trans	-125.5	4.5	-171.1	-64.6	-166.4	149.7	0	0	116.3	T187	T187-E189 VanDerWaalsContact C-N 3.33Å
190	S	31.3	Very low	32.1	Very low	97 Å²	97	111.6 Å²	111.6	68%	0.678	61%	0.614	S	S	*	*	S	Bend	trans	-115.5	-4.8	-177	58.1	0	0	0	0	117.3
191	N	31.5	Very low	33.5	Very low	138 Å²	138	113.4 Å²	113.4	74%	0.738	62%	0.624	S	S	*	*	S	Bend	trans	-123.9	113	171.3	-73	-27.1	0	0	0	109.4	L193	N191-L193 PolarHBondContact O-N 2.91Å
192	G	26.7	Very low	34.9	Very low	77 Å²	77	110.4 Å²	110.4	79%	0.794	60%	0.601	S	S	*	*			trans	-63.9	37.7	-170	0	0	0	0	0	118	K194	G192-K194 PolarHBondContact O-N 2.77Å
193	L	34.5	Very low	36.3	Very low	94 Å²	94	107.5 Å²	107.5	49%	0.492	59%	0.587	S	S	.	*			trans	-87.5	43.8	168.9	-73.3	160.7	0	0	0	111.1	N191 L208 K211 L215	N191-L193 PolarHBondContact O-N 2.91Å; L193-L208 HydrophobicContact CD2-CD1 4.17Å; L193-K211 HydrophobicContact CD2-CD 4.29Å; L193-L215 HydrophobicContact CD1-CD1 3.96Å
194	K	29.2	Very low	37.8	Very low	175 Å²	175	103.4 Å²	103.4	76%	0.761	57%	0.571	S	S	*	*			trans	-104.2	75.1	159.9	-100.9	178.8	179.3	169	0	107.8	G192	G192-K194 PolarHBondContact O-N 2.77Å
195	S	34.3	Very low	38.9	Very low	59 Å²	59	102 Å²	102	41%	0.413	56%	0.559	S	S	.	*			trans	-120.3	113.4	152.8	63.6	0	0	0	0	106.1	I197	S195-I197 PolarHBondContact O-N 2.62Å
196	T	29.9	Very low	40.4	Very low	146 Å²	146	96.3 Å²	96.3	90%	0.896	53%	0.532	S	S	*	.			trans	-43.1	97.4	166.1	43.6	0	0	0	0	109.3	D198	T196-D198 PolarHBondContact O-N 2.91Å; T196-D198 VanDerWaalsContact O-N 3.14Å
197	I	36	Very low	42.1	Very low	68 Å²	68	92.5 Å²	92.5	35%	0.349	51%	0.514	S	S	.	.			trans	-74	106.1	174.5	-65.2	152.6	0	0	0	105.4	S195 S199 L205 L208	S195-I197 PolarHBondContact O-N 2.62Å; I197-S199 PolarHBondContact O-N 2.75Å; I197-S199 VanDerWaalsContact O-N 3.14Å; I197-L205 HydrophobicContact CG2-CD2 4.47Å; I197-L208 HydrophobicContact CD1-CD1 4.12Å; I197-L208 HydrophobicContact CD1-CD2 3.63Å; I197-L208 HydrophobicContact CD1-CG 4.32Å
198	D	34.5	Very low	43.5	Very low	105 Å²	105	88.3 Å²	88.3	56%	0.561	49%	0.488	S	S	*	.			trans	-63.7	111.3	164.5	-154.1	-9	0	0	0	106.5	T196 N200 N201	T196-D198 PolarHBondContact O-N 2.91Å; T196-D198 VanDerWaalsContact O-N 3.14Å; D198-N200 PolarHBondContact O-N 2.97Å; D198-N201 PolarHBondContact O-N 3.39Å; D198-N201 VanDerWaalsContact O-N 3.08Å
199	S	43.2	Very low	44.7	Very low	73 Å²	73	82 Å²	82	51%	0.51	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-3.5	-169.3	59.6	0	0	0	0	114.3	I197	I197-S199 PolarHBondContact O-N 2.75Å; I197-S199 VanDerWaalsContact O-N 3.14Å
200	N	46.1	Very low	46.2	Very low	123 Å²	123	80.5 Å²	80.5	66%	0.658	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-0.6	-175.3	-59	-26	0	0	0	112.8	D198	D198-N200 PolarHBondContact O-N 2.97Å
201	N	57.7	Low	47.7	Very low	71 Å²	71	79.8 Å²	79.8	38%	0.38	43%	0.432	S	S	.	.			trans	-106.9	106.9	-175	-166.3	-15.7	0	0	0	112.3	D198 H203 S204 L205	D198-N201 PolarHBondContact O-N 3.39Å; D198-N201 VanDerWaalsContact O-N 3.08Å; N201-H203 PolarHBondContact O-N 3.11Å; N201-H203 VanDerWaalsContact O-N 3.15Å; N201-H203 VanDerWaalsContact OD1-CB 3.23Å; N201-H203 WeakPolarHBondContact OD1-CB 3.13Å; N201-H203 PolarHBondContact OD1-N 2.91Å; N201-S204 WeakPolarHBondContact O-CB 3.49Å; N201-S204 PolarHBondContact O-N 3.29Å; N201-L205 PolarHBondContact O-N 2.95Å
202	I	59.4	Low	48.8	Very low	27 Å²	27	74.2 Å²	74.2	14%	0.138	40%	0.402	C	S	.	.	H	α-helix	trans	-52.7	-35.2	174.7	-67.4	177.8	0	0	0	111.4	L205 K206 L271 E275 I278	I202-L205 PolarHBondContact O-N 3.21Å; I202-K206 HydrophobicContact CG2-CD 4.27Å; I202-K206 HydrophobicContact CG2-CG 4.41Å; I202-K206 WeakPolarHBondContact O-CG 3.42Å; I202-K206 PolarHBondContact O-N 3.48Å; I202-L271 HydrophobicContact CG2-CD2 4.1Å; I202-E275 HydrophobicContact CD1-CB 4.36Å; I202-E275 HydrophobicContact CG2-CB 4.44Å; I202-I278 HydrophobicContact CD1-CD1 3.48Å; I202-I278 VanDerWaalsContact CD1-CD1 3.48Å; I202-I278 HydrophobicContact CG1-CD1 4.5Å
203	H	59.1	Low	50.7	Low	109 Å²	109	73.1 Å²	73.1	51%	0.505	37%	0.374	S	S	.	.	H	α-helix	trans	-65.6	-43	179.6	-168.9	73.4	0	0	0	111.8	N201 L205 K206 Q207	N201-H203 PolarHBondContact O-N 3.11Å; N201-H203 VanDerWaalsContact O-N 3.15Å; N201-H203 VanDerWaalsContact OD1-CB 3.23Å; N201-H203 WeakPolarHBondContact OD1-CB 3.13Å; N201-H203 PolarHBondContact OD1-N 2.91Å; H203-L205 VanDerWaalsContact C-N 3.31Å; H203-L205 PolarHBondContact O-N 3.24Å; H203-K206 PolarHBondContact O-N 2.9Å; H203-Q207 PolarHBondContact CD2-NE2 3.13Å; H203-Q207 PolarHBondContact NE2-NE2 3.23Å; H203-Q207 WeakPolarHBondContact O-CG 3.31Å; H203-Q207 PolarHBondContact O-N 3.39Å
204	S	60.5	Low	51.9	Low	26 Å²	26	75 Å²	75	18%	0.182	38%	0.375	C	S	.	.	H	α-helix	trans	-63.2	-38.5	175.7	-57.8	0	0	0	0	111.8	N201 Q207 L208	N201-S204 WeakPolarHBondContact O-CB 3.49Å; N201-S204 PolarHBondContact O-N 3.29Å; S204-Q207 PolarHBondContact O-N 3.37Å; S204-L208 WeakPolarHBondContact O-CB 3.44Å; S204-L208 PolarHBondContact O-N 2.88Å
205	L	54.2	Low	53	Low	21 Å²	21	70.4 Å²	70.4	11%	0.11	36%	0.358	C	S	.	.	H	α-helix	trans	-68.6	-40.3	176.7	-70.4	167.4	0	0	0	112.6	I197 N201 I202 H203 L208 S209 L271 I342	I197-L205 HydrophobicContact CG2-CD2 4.47Å; N201-L205 PolarHBondContact O-N 2.95Å; I202-L205 PolarHBondContact O-N 3.21Å; H203-L205 VanDerWaalsContact C-N 3.31Å; H203-L205 PolarHBondContact O-N 3.24Å; L205-L208 PolarHBondContact O-N 3.47Å; L205-S209 PolarHBondContact O-N 3.41Å; L205-S209 PolarHBondContact O-OG 3.32Å; L205-L271 HydrophobicContact CB-CD1 4.38Å; L205-L271 HydrophobicContact CB-CD2 3.72Å; L205-L271 HydrophobicContact CD1-CD2 4.25Å; L205-I342 HydrophobicContact CD1-CD1 4.2Å; L205-I342 HydrophobicContact CD1-CG2 4.2Å; L205-I342 HydrophobicContact CD2-CG2 4.04Å
206	K	62.3	Low	54.2	Low	33 Å²	33	68.4 Å²	68.4	14%	0.143	34%	0.342	C	S	.	.	H	α-helix	trans	-60.8	-46.4	170.7	-74.9	177.9	176.6	-177.8	0	111.3	I202 H203 L208 S209 Y210 L271 E275	I202-K206 HydrophobicContact CG2-CD 4.27Å; I202-K206 HydrophobicContact CG2-CG 4.41Å; I202-K206 WeakPolarHBondContact O-CG 3.42Å; I202-K206 PolarHBondContact O-N 3.48Å; H203-K206 PolarHBondContact O-N 2.9Å; K206-L208 VanDerWaalsContact C-N 3.29Å; K206-L208 PolarHBondContact O-N 2.95Å; K206-S209 PolarHBondContact O-N 2.88Å; K206-S209 PolarHBondContact O-OG 3.25Å; K206-Y210 WeakPolarHBondContact O-CD2 2.9Å; K206-Y210 PolarHBondContact O-N 3.49Å; K206-L271 HydrophobicContact CG-CB 4.14Å; K206-L271 HydrophobicContact CG-CD1 3.83Å; K206-L271 HydrophobicContact CG-CG 4.43Å; K206-E275 IonicContact NZ-OE1 2.72Å; K206-E275 PolarHBondContact NZ-OE1 2.93Å; K206-E275 IonicContact NZ-OE2 3.27Å; K206-E275 PolarHBondContact NZ-OE2 3.31Å
207	Q	64.8	Low	55.2	Low	89 Å²	89	63.9 Å²	63.9	42%	0.416	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-40.4	177.4	-73.8	-169.6	3.3	0	0	111.8	H203 S204 K211	H203-Q207 PolarHBondContact CD2-NE2 3.13Å; H203-Q207 PolarHBondContact NE2-NE2 3.23Å; H203-Q207 WeakPolarHBondContact O-CG 3.31Å; H203-Q207 PolarHBondContact O-N 3.39Å; S204-Q207 PolarHBondContact O-N 3.37Å; Q207-K211 WeakPolarHBondContact O-CB 2.79Å; Q207-K211 VanDerWaalsContact O-CG 3.3Å; Q207-K211 WeakPolarHBondContact O-CG 2.9Å; Q207-K211 PolarHBondContact O-N 3.15Å
208	L	58.6	Low	56	Low	22 Å²	22	64.2 Å²	64.2	12%	0.115	31%	0.311	C	S	.	.	H	α-helix	trans	-64.8	-46.5	176.6	-176.1	68.1	0	0	0	111.9	L193 I197 S204 L205 K206 Y210 K211 I212	L193-L208 HydrophobicContact CD2-CD1 4.17Å; I197-L208 HydrophobicContact CD1-CD1 4.12Å; I197-L208 HydrophobicContact CD1-CD2 3.63Å; I197-L208 HydrophobicContact CD1-CG 4.32Å; S204-L208 WeakPolarHBondContact O-CB 3.44Å; S204-L208 PolarHBondContact O-N 2.88Å; L205-L208 PolarHBondContact O-N 3.47Å; K206-L208 VanDerWaalsContact C-N 3.29Å; K206-L208 PolarHBondContact O-N 2.95Å; L208-Y210 VanDerWaalsContact C-N 3.3Å; L208-Y210 PolarHBondContact O-N 3.4Å; L208-K211 PolarHBondContact O-N 2.93Å; L208-I212 HydrophobicContact CD1-CD1 4.27Å; L208-I212 HydrophobicContact CD1-CG1 4.44Å; L208-I212 HydrophobicContact CD2-CD1 4.38Å; L208-I212 HydrophobicContact CG-CD1 3.89Å; L208-I212 HydrophobicContact CG-CG1 4.43Å; L208-I212 WeakPolarHBondContact O-CB 3.16Å; L208-I212 WeakPolarHBondContact O-CG1 3.44Å; L208-I212 PolarHBondContact O-N 3.29Å
209	S	56.1	Low	56.7	Low	6 Å²	6	63 Å²	63	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-40.4	178.9	65.2	0	0	0	0	111.4	L205 K206 I212 W213 M268	L205-S209 PolarHBondContact O-N 3.41Å; L205-S209 PolarHBondContact O-OG 3.32Å; K206-S209 PolarHBondContact O-N 2.88Å; K206-S209 PolarHBondContact O-OG 3.25Å; S209-I212 PolarHBondContact O-N 2.8Å; S209-W213 WeakPolarHBondContact O-CB 3.31Å; S209-W213 PolarHBondContact O-N 3.22Å; S209-M268 PolarHBondContact OG-SD 2.8Å
210	Y	61.2	Low	56.8	Low	132 Å²	132	60.4 Å²	60.4	52%	0.518	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-45.9	172.3	-86.6	-69	0	0	0	112.5	K206 L208 I212 W213 R214 F264 M268	K206-Y210 WeakPolarHBondContact O-CD2 2.9Å; K206-Y210 PolarHBondContact O-N 3.49Å; L208-Y210 VanDerWaalsContact C-N 3.3Å; L208-Y210 PolarHBondContact O-N 3.4Å; Y210-I212 VanDerWaalsContact C-N 3.33Å; Y210-I212 PolarHBondContact O-N 3.49Å; Y210-W213 PolarHBondContact O-N 3.42Å; Y210-R214 WeakPolarHBondContact O-CB 3.15Å; Y210-R214 PolarHBondContact O-N 3.4Å; Y210-F264 HydrophobicContact CD1-CE2 4.19Å; Y210-F264 AromaticContact CD1-CZ 3.83Å; Y210-F264 HydrophobicContact CD1-CZ 3.83Å; Y210-F264 HydrophobicContact CE1-CE2 4.49Å; Y210-F264 AromaticContact CE1-CZ 3.71Å; Y210-F264 HydrophobicContact CE1-CZ 3.71Å; Y210-F264 HydrophobicContact CG-CE2 4.44Å; Y210-F264 HydrophobicContact CG-CZ 4.43Å; Y210-M268 HydrophobicContact CD2-CE 4.22Å; Y210-M268 HydrophobicContact CE2-CE 3.35Å; Y210-M268 HydrophobicContact CE2-SD 4.21Å
211	K	61.2	Low	56.4	Low	82 Å²	82	56.8 Å²	56.8	36%	0.357	27%	0.269	S	S	.	.	H	α-helix	trans	-59.9	-43.6	176.7	-78.4	177	-178.9	-178.7	0	111.5	L193 Q207 L208 R214 L215	L193-K211 HydrophobicContact CD2-CD 4.29Å; Q207-K211 WeakPolarHBondContact O-CB 2.79Å; Q207-K211 VanDerWaalsContact O-CG 3.3Å; Q207-K211 WeakPolarHBondContact O-CG 2.9Å; Q207-K211 PolarHBondContact O-N 3.15Å; L208-K211 PolarHBondContact O-N 2.93Å; K211-R214 PolarHBondContact O-N 3.36Å; K211-L215 WeakPolarHBondContact O-CB 3.47Å; K211-L215 VanDerWaalsContact O-CG 3.26Å; K211-L215 WeakPolarHBondContact O-CG 3.34Å; K211-L215 PolarHBondContact O-N 2.92Å
212	I	55	Low	55.4	Low	21 Å²	21	58.4 Å²	58.4	11%	0.108	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-47.2	177	-74	171.3	0	0	0	111	L208 S209 Y210 L215 F216 F349	L208-I212 HydrophobicContact CD1-CD1 4.27Å; L208-I212 HydrophobicContact CD1-CG1 4.44Å; L208-I212 HydrophobicContact CD2-CD1 4.38Å; L208-I212 HydrophobicContact CG-CD1 3.89Å; L208-I212 HydrophobicContact CG-CG1 4.43Å; L208-I212 WeakPolarHBondContact O-CB 3.16Å; L208-I212 WeakPolarHBondContact O-CG1 3.44Å; L208-I212 PolarHBondContact O-N 3.29Å; S209-I212 PolarHBondContact O-N 2.8Å; Y210-I212 VanDerWaalsContact C-N 3.33Å; Y210-I212 PolarHBondContact O-N 3.49Å; I212-L215 PolarHBondContact O-N 3.37Å; I212-F216 WeakPolarHBondContact O-CB 3.47Å; I212-F216 PolarHBondContact O-N 3.46Å; I212-F349 HydrophobicContact CB-CZ 4.45Å; I212-F349 HydrophobicContact CD1-CE1 4.27Å; I212-F349 HydrophobicContact CD1-CZ 4.43Å; I212-F349 HydrophobicContact CG1-CZ 4.44Å; I212-F349 HydrophobicContact CG2-CD2 4.27Å; I212-F349 HydrophobicContact CG2-CE1 4.12Å; I212-F349 HydrophobicContact CG2-CE2 3.31Å; I212-F349 HydrophobicContact CG2-CZ 3.25Å
213	W	67.3	Low	54.4	Low	54 Å²	54	63.6 Å²	63.6	21%	0.205	31%	0.306	C	S	.	.	H	α-helix	trans	-61	-45	177.3	179.7	-108.7	0	0	0	111.6	S209 Y210 F216 Q217 E261 F264	S209-W213 WeakPolarHBondContact O-CB 3.31Å; S209-W213 PolarHBondContact O-N 3.22Å; Y210-W213 PolarHBondContact O-N 3.42Å; W213-F216 HydrophobicContact CE3-CD1 4.39Å; W213-F216 HydrophobicContact CZ3-CD1 4.19Å; W213-F216 PolarHBondContact O-N 2.95Å; W213-Q217 HydrophobicContact CD2-CG 4.43Å; W213-Q217 VanDerWaalsContact CH2-NE2 3.33Å; W213-Q217 HydrophobicContact CZ2-CG 4.45Å; W213-Q217 VanDerWaalsContact O-CG 3.29Å; W213-Q217 WeakPolarHBondContact O-CG 3.17Å; W213-Q217 PolarHBondContact O-N 2.99Å; W213-E261 HydrophobicContact CH2-CB 3.75Å; W213-E261 HydrophobicContact CH2-CG 3.95Å; W213-E261 VanDerWaalsContact CZ3-CA 3.45Å; W213-E261 HydrophobicContact CZ3-CB 4.07Å; W213-F264 HydrophobicContact CB-CD2 3.55Å; W213-F264 HydrophobicContact CB-CE2 3.7Å; W213-F264 HydrophobicContact CB-CG 4.16Å; W213-F264 HydrophobicContact CB-CZ 4.43Å; W213-F264 HydrophobicContact CD2-CB 4.24Å; W213-F264 HydrophobicContact CD2-CD1 4.29Å; W213-F264 HydrophobicContact CD2-CD2 4.32Å; W213-F264 HydrophobicContact CD2-CG 4.01Å; W213-F264 HydrophobicContact CE3-CB 3.8Å; W213-F264 HydrophobicContact CE3-CG 4.1Å; W213-F264 HydrophobicContact CG-CD1 4.39Å; W213-F264 AromaticContact CG-CD2 3.92Å; W213-F264 HydrophobicContact CG-CD2 3.92Å; W213-F264 HydrophobicContact CG-CE2 4.08Å; W213-F264 HydrophobicContact CG-CG 4.08Å; W213-F264 HydrophobicContact CG-CZ 4.39Å; W213-F264 HydrophobicContact CZ3-CB 4.3Å
214	R	60.1	Low	53.3	Low	133 Å²	133	59.5 Å²	59.5	50%	0.502	29%	0.288	S	S	.	.	H	α-helix	trans	-60.6	-47.2	176.3	-159	-159.6	-145	-142.1	12.5	111.3	Y210 K211 F216 Q217 E218 D640	Y210-R214 WeakPolarHBondContact O-CB 3.15Å; Y210-R214 PolarHBondContact O-N 3.4Å; K211-R214 PolarHBondContact O-N 3.36Å; R214-F216 VanDerWaalsContact C-N 3.31Å; R214-F216 PolarHBondContact O-N 3.25Å; R214-Q217 PolarHBondContact O-N 3.49Å; R214-E218 WeakPolarHBondContact CD-OE1 3.39Å; R214-E218 WeakPolarHBondContact CG-OE1 3.49Å; R214-E218 IonicContact CZ-OE1 3.59Å; R214-E218 IonicContact NE-OE1 3.02Å; R214-E218 IonicContact NH1-OE1 2.71Å; R214-E218 PolarHBondContact NH1-OE1 3.23Å; R214-E218 WeakPolarHBondContact O-CB 3.5Å; R214-E218 VanDerWaalsContact O-CG 3.29Å; R214-E218 WeakPolarHBondContact O-CG 3.28Å; R214-E218 PolarHBondContact O-N 3.06Å; R214-D640 IonicContact CZ-OD2 2.8Å; R214-D640 IonicContact NH2-OD2 3.41Å; R214-D640 PolarHBondContact NH2-OD2 3.41Å
215	L	52.7	Low	52.2	Low	78 Å²	78	63.3 Å²	63.3	41%	0.408	31%	0.306	S	S	.	.	H	α-helix	trans	-59.8	-41.6	176.9	-75.8	171.4	0	0	0	111.6	L193 K211 I212 E218 T219	L193-L215 HydrophobicContact CD1-CD1 3.96Å; K211-L215 WeakPolarHBondContact O-CB 3.47Å; K211-L215 VanDerWaalsContact O-CG 3.26Å; K211-L215 WeakPolarHBondContact O-CG 3.34Å; K211-L215 PolarHBondContact O-N 2.92Å; I212-L215 PolarHBondContact O-N 3.37Å; L215-E218 PolarHBondContact O-N 3.3Å; L215-T219 PolarHBondContact O-N 3.23Å; L215-T219 PolarHBondContact O-OG1 2.65Å
216	F	57.8	Low	51.4	Low	18 Å²	18	69.7 Å²	69.7	8%	0.079	34%	0.34	C	S	.	.	H	α-helix	trans	-63.5	-44.2	176	172.9	-99.3	0	0	0	112.2	I212 W213 R214 T219 S220 T257 Y260	I212-F216 WeakPolarHBondContact O-CB 3.47Å; I212-F216 PolarHBondContact O-N 3.46Å; W213-F216 HydrophobicContact CE3-CD1 4.39Å; W213-F216 HydrophobicContact CZ3-CD1 4.19Å; W213-F216 PolarHBondContact O-N 2.95Å; R214-F216 VanDerWaalsContact C-N 3.31Å; R214-F216 PolarHBondContact O-N 3.25Å; F216-T219 PolarHBondContact O-N 2.98Å; F216-T219 PolarHBondContact O-OG1 2.64Å; F216-S220 VanDerWaalsContact CZ-OG 3.3Å; F216-S220 WeakPolarHBondContact CZ-OG 3.47Å; F216-S220 VanDerWaalsContact O-CB 3.3Å; F216-S220 WeakPolarHBondContact O-CB 3.48Å; F216-S220 PolarHBondContact O-N 3.03Å; F216-S220 PolarHBondContact O-OG 3.03Å; F216-T257 HydrophobicContact CE1-CG2 4.32Å; F216-Y260 HydrophobicContact CB-CD1 4.07Å; F216-Y260 HydrophobicContact CB-CE1 4.32Å; F216-Y260 HydrophobicContact CD1-CD1 4.39Å; F216-Y260 HydrophobicContact CD1-CG 4.05Å; F216-Y260 AromaticContact CD2-CD1 3.6Å; F216-Y260 HydrophobicContact CD2-CD1 3.6Å; F216-Y260 AromaticContact CD2-CD2 3.41Å; F216-Y260 HydrophobicContact CD2-CD2 3.41Å; F216-Y260 VanDerWaalsContact CD2-CD2 3.41Å; F216-Y260 AromaticContact CD2-CE1 3.69Å; F216-Y260 HydrophobicContact CD2-CE1 3.69Å; F216-Y260 AromaticContact CD2-CE2 3.56Å; F216-Y260 HydrophobicContact CD2-CE2 3.56Å; F216-Y260 AromaticContact CD2-CG 3.46Å; F216-Y260 HydrophobicContact CD2-CG 3.46Å; F216-Y260 VanDerWaalsContact CD2-CG 3.46Å; F216-Y260 AromaticContact CD2-CZ 3.7Å; F216-Y260 HydrophobicContact CE1-CD2 4.33Å; F216-Y260 HydrophobicContact CE1-CG 4.15Å; F216-Y260 HydrophobicContact CE2-CD1 4.2Å; F216-Y260 AromaticContact CE2-CD2 3.12Å; F216-Y260 HydrophobicContact CE2-CD2 3.12Å; F216-Y260 HydrophobicContact CE2-CE1 4.39Å; F216-Y260 AromaticContact CE2-CE2 3.43Å; F216-Y260 HydrophobicContact CE2-CE2 3.43Å; F216-Y260 VanDerWaalsContact CE2-CE2 3.43Å; F216-Y260 AromaticContact CE2-CG 3.58Å; F216-Y260 HydrophobicContact CE2-CG 3.58Å; F216-Y260 AromaticContact CG-CD1 3.72Å; F216-Y260 HydrophobicContact CG-CD1 3.72Å; F216-Y260 HydrophobicContact CG-CD2 4.14Å; F216-Y260 HydrophobicContact CG-CE1 4.14Å; F216-Y260 AromaticContact CG-CG 3.72Å; F216-Y260 HydrophobicContact CG-CG 3.72Å; F216-Y260 AromaticContact CZ-CD2 3.65Å; F216-Y260 HydrophobicContact CZ-CD2 3.65Å; F216-Y260 HydrophobicContact CZ-CE2 4.37Å; F216-Y260 AromaticContact CZ-CG 3.94Å; F216-Y260 HydrophobicContact CZ-CG 3.94Å
217	Q	52.7	Low	50.1	Low	51 Å²	51	71.8 Å²	71.8	24%	0.238	35%	0.353	C	S	.	.	H	α-helix	trans	-60.5	-49.1	174.3	-68.3	-64.4	-18.8	0	0	110.1	W213 R214 T219 S220 I221	W213-Q217 HydrophobicContact CD2-CG 4.43Å; W213-Q217 VanDerWaalsContact CH2-NE2 3.33Å; W213-Q217 HydrophobicContact CZ2-CG 4.45Å; W213-Q217 VanDerWaalsContact O-CG 3.29Å; W213-Q217 WeakPolarHBondContact O-CG 3.17Å; W213-Q217 PolarHBondContact O-N 2.99Å; R214-Q217 PolarHBondContact O-N 3.49Å; Q217-T219 VanDerWaalsContact C-N 3.35Å; Q217-T219 PolarHBondContact O-N 2.89Å; Q217-S220 PolarHBondContact O-N 3.18Å; Q217-I221 WeakPolarHBondContact O-CB 3.35Å; Q217-I221 WeakPolarHBondContact O-CD1 3.39Å; Q217-I221 WeakPolarHBondContact O-CG1 3.5Å; Q217-I221 PolarHBondContact O-N 3.42Å
218	E	52.3	Low	48.9	Very low	75 Å²	75	74.1 Å²	74.1	35%	0.35	36%	0.364	S	S	.	.	H	α-helix	trans	-60.1	-38.7	177.2	-71.4	170.3	-173.5	0	0	112.8	R214 L215 N222	R214-E218 WeakPolarHBondContact CD-OE1 3.39Å; R214-E218 WeakPolarHBondContact CG-OE1 3.49Å; R214-E218 IonicContact CZ-OE1 3.59Å; R214-E218 IonicContact NE-OE1 3.02Å; R214-E218 IonicContact NH1-OE1 2.71Å; R214-E218 PolarHBondContact NH1-OE1 3.23Å; R214-E218 WeakPolarHBondContact O-CB 3.5Å; R214-E218 VanDerWaalsContact O-CG 3.29Å; R214-E218 WeakPolarHBondContact O-CG 3.28Å; R214-E218 PolarHBondContact O-N 3.06Å; L215-E218 PolarHBondContact O-N 3.3Å; E218-N222 VanDerWaalsContact O-CB 3.27Å; E218-N222 WeakPolarHBondContact O-CB 3.34Å; E218-N222 VanDerWaalsContact O-CG 3.29Å; E218-N222 PolarHBondContact O-N 3.02Å; E218-N222 PolarHBondContact O-ND2 3.44Å
219	T	49.3	Very low	47.8	Very low	79 Å²	79	79.3 Å²	79.3	49%	0.485	39%	0.392	S	S	.	.	H	α-helix	trans	-72.7	-35.5	175.9	11.5	0	0	0	0	112.7	L215 F216 Q217 I221 N223	L215-T219 PolarHBondContact O-N 3.23Å; L215-T219 PolarHBondContact O-OG1 2.65Å; F216-T219 PolarHBondContact O-N 2.98Å; F216-T219 PolarHBondContact O-OG1 2.64Å; Q217-T219 VanDerWaalsContact C-N 3.35Å; Q217-T219 PolarHBondContact O-N 2.89Å; T219-I221 VanDerWaalsContact C-N 3.31Å; T219-N223 PolarHBondContact O-N 3.47Å
220	S	44.6	Very low	46.9	Very low	19 Å²	19	80.3 Å²	80.3	13%	0.133	40%	0.396	C	S	.	.	H	α-helix	trans	-67.6	-34.3	175	-63.7	0	0	0	0	111.6	F216 Q217 N224 Q253	F216-S220 VanDerWaalsContact CZ-OG 3.3Å; F216-S220 WeakPolarHBondContact CZ-OG 3.47Å; F216-S220 VanDerWaalsContact O-CB 3.3Å; F216-S220 WeakPolarHBondContact O-CB 3.48Å; F216-S220 PolarHBondContact O-N 3.03Å; F216-S220 PolarHBondContact O-OG 3.03Å; Q217-S220 PolarHBondContact O-N 3.18Å; S220-N224 PolarHBondContact O-ND2 3.35Å; S220-Q253 PolarHBondContact O-NE2 2.77Å
221	I	36.8	Very low	45.8	Very low	47 Å²	47	80.7 Å²	80.7	24%	0.241	40%	0.401	C	S	.	.	H	α-helix	trans	-75.2	-41.8	176.4	-65.7	163.5	0	0	0	110.8	Q217 T219 N224 E234	Q217-I221 WeakPolarHBondContact O-CB 3.35Å; Q217-I221 WeakPolarHBondContact O-CD1 3.39Å; Q217-I221 WeakPolarHBondContact O-CG1 3.5Å; Q217-I221 PolarHBondContact O-N 3.42Å; T219-I221 VanDerWaalsContact C-N 3.31Å; I221-N224 PolarHBondContact O-N 3.47Å; I221-E234 WeakPolarHBondContact CD1-OE1 3.48Å; I221-E234 VanDerWaalsContact CG1-OE1 3.28Å; I221-E234 WeakPolarHBondContact CG1-OE1 3.39Å
222	N	37.3	Very low	44.8	Very low	105 Å²	105	83.5 Å²	83.5	56%	0.561	42%	0.415	S	S	*	.	H	α-helix	trans	-74.6	-28.8	-175.3	-78.9	-27.5	0	0	0	114.9	E218 N224	E218-N222 VanDerWaalsContact O-CB 3.27Å; E218-N222 WeakPolarHBondContact O-CB 3.34Å; E218-N222 VanDerWaalsContact O-CG 3.29Å; E218-N222 PolarHBondContact O-N 3.02Å; E218-N222 PolarHBondContact O-ND2 3.44Å; N222-N224 PolarHBondContact O-N 3.02Å
223	N	38.2	Very low	43.8	Very low	135 Å²	135	86 Å²	86	72%	0.722	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-9.5	173.3	-80.1	-18.9	0	0	0	113.4	T219	T219-N223 PolarHBondContact O-N 3.47Å
224	N	36.6	Very low	42.3	Very low	23 Å²	23	86.5 Å²	86.5	12%	0.123	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	10.6	-173.7	-77.6	-1	0	0	0	114.5	S220 I221 N222 N226 N227 I230 Q253	S220-N224 PolarHBondContact O-ND2 3.35Å; I221-N224 PolarHBondContact O-N 3.47Å; N222-N224 PolarHBondContact O-N 3.02Å; N224-N226 PolarHBondContact O-N 3.33Å; N224-N227 PolarHBondContact O-N 3.46Å; N224-N227 VanDerWaalsContact O-N 3.12Å; N224-I230 VanDerWaalsContact ND2-CD1 3.31Å; N224-I230 WeakPolarHBondContact ND2-CD1 3.25Å; N224-I230 WeakPolarHBondContact ND2-CG2 3.48Å; N224-Q253 PolarHBondContact ND2-NE2 3.37Å; N224-Q253 PolarHBondContact ND2-OE1 3.36Å; N224-Q253 PolarHBondContact OD1-OE1 3.43Å
225	N	36.3	Very low	41.2	Very low	106 Å²	106	81.2 Å²	81.2	57%	0.567	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	1.9	178	-78.5	-38.7	0	0	0	115.1
226	N	37.4	Very low	40.1	Very low	156 Å²	156	80.8 Å²	80.8	83%	0.834	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	-0.7	174.5	-70.6	-19.7	0	0	0	114.8	N224	N224-N226 PolarHBondContact O-N 3.33Å
227	N	35	Very low	39	Very low	76 Å²	76	82.9 Å²	82.9	41%	0.406	43%	0.427	S	S	.	.			trans	-125.8	105.2	176.4	-77.8	-12.2	0	0	0	109.9	N224 D229	N224-N227 PolarHBondContact O-N 3.46Å; N224-N227 VanDerWaalsContact O-N 3.12Å; N227-D229 PolarHBondContact O-N 2.96Å; N227-D229 VanDerWaalsContact O-N 3.16Å
228	E	40.2	Very low	38.2	Very low	139 Å²	139	82.2 Å²	82.2	65%	0.65	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-63	-14.7	177.1	-77.2	-177.9	141.1	0	0	113.4	I230	E228-I230 VanDerWaalsContact C-N 3.32Å; E228-I230 PolarHBondContact O-N 3.19Å
229	D	36.7	Very low	37.2	Very low	130 Å²	130	83.8 Å²	83.8	70%	0.695	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-77.7	-8.1	-175.2	-60.3	-29.5	0	0	0	114.6	N227	N227-D229 PolarHBondContact O-N 2.96Å; N227-D229 VanDerWaalsContact O-N 3.16Å
230	I	36	Very low	36.4	Very low	28 Å²	28	85.5 Å²	85.5	14%	0.144	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-100	-8.5	-175.4	-64.9	174.5	0	0	0	113.2	N224 E228 E232 I233	N224-I230 VanDerWaalsContact ND2-CD1 3.31Å; N224-I230 WeakPolarHBondContact ND2-CD1 3.25Å; N224-I230 WeakPolarHBondContact ND2-CG2 3.48Å; E228-I230 VanDerWaalsContact C-N 3.32Å; E228-I230 PolarHBondContact O-N 3.19Å; I230-E232 PolarHBondContact O-N 3.09Å; I230-E232 VanDerWaalsContact O-N 3.14Å; I230-I233 HydrophobicContact CB-CD1 4.2Å; I230-I233 HydrophobicContact CG1-CD1 3.99Å; I230-I233 HydrophobicContact CG2-CB 4.19Å; I230-I233 HydrophobicContact CG2-CD1 3.84Å; I230-I233 HydrophobicContact CG2-CG1 4.16Å; I230-I233 WeakPolarHBondContact O-CB 3.18Å; I230-I233 PolarHBondContact O-N 3.29Å
231	K	39.1	Very low	35.8	Very low	140 Å²	140	90.7 Å²	90.7	61%	0.609	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-9	177	-70.9	-180	-179.4	172.4	0	114
232	E	39.3	Very low	35.9	Very low	141 Å²	141	93.9 Å²	93.9	66%	0.659	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-11	169.3	-71.7	-175.4	167.9	0	0	113.4	I230	I230-E232 PolarHBondContact O-N 3.09Å; I230-E232 VanDerWaalsContact O-N 3.14Å
233	I	33.2	Very low	36.2	Very low	73 Å²	73	93.3 Å²	93.3	37%	0.374	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-79.7	-20.8	-177	-57.8	-170.6	0	0	0	112.4	I230 N235	I230-I233 HydrophobicContact CB-CD1 4.2Å; I230-I233 HydrophobicContact CG1-CD1 3.99Å; I230-I233 HydrophobicContact CG2-CB 4.19Å; I230-I233 HydrophobicContact CG2-CD1 3.84Å; I230-I233 HydrophobicContact CG2-CG1 4.16Å; I230-I233 WeakPolarHBondContact O-CB 3.18Å; I230-I233 PolarHBondContact O-N 3.29Å; I233-N235 PolarHBondContact O-N 3.07Å
234	E	36.3	Very low	36.5	Very low	64 Å²	64	94.3 Å²	94.3	30%	0.299	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-72.8	-4.5	179.5	-73.6	176.4	156.7	0	0	114	I221 H643 T645	I221-E234 WeakPolarHBondContact CD1-OE1 3.48Å; I221-E234 VanDerWaalsContact CG1-OE1 3.28Å; I221-E234 WeakPolarHBondContact CG1-OE1 3.39Å; E234-H643 IonicContact OE1-CE1 3.94Å; E234-H643 IonicContact OE1-ND1 2.95Å; E234-H643 IonicContact OE2-CE1 3.39Å; E234-H643 PolarHBondContact OE2-CE1 3.35Å; E234-H643 IonicContact OE2-CG 3.81Å; E234-H643 IonicContact OE2-ND1 3.92Å; E234-H643 PolarHBondContact OE2-ND1 3.35Å; E234-T645 HydrophobicContact CB-CG2 3.69Å; E234-T645 PolarHBondContact O-OG1 3.14Å
235	N	37	Very low	36.8	Very low	23 Å²	23	101 Å²	101	12%	0.123	52%	0.515	C	S	.	.	G	3₁₀ helix	trans	-102.1	-17	-172.2	-91.9	-36.9	0	0	0	118.7	I233 T645 L646	I233-N235 PolarHBondContact O-N 3.07Å; N235-T645 VanDerWaalsContact ND2-C 3.29Å; N235-T645 VanDerWaalsContact ND2-CA 3.29Å; N235-T645 WeakPolarHBondContact ND2-CA 3.38Å; N235-T645 WeakPolarHBondContact ND2-CB 3.47Å; N235-T645 WeakPolarHBondContact OD1-CA 3.38Å; N235-T645 WeakPolarHBondContact OD1-CB 3.38Å; N235-T645 PolarHBondContact OD1-O 2.8Å; N235-T645 PolarHBondContact OD1-OG1 3.04Å; N235-L646 VanDerWaalsContact CB-O 3.29Å; N235-L646 WeakPolarHBondContact CB-O 3.5Å; N235-L646 PolarHBondContact ND2-N 2.86Å; N235-L646 PolarHBondContact ND2-O 3.16Å; N235-L646 PolarHBondContact OD1-N 2.94Å; N235-L646 PolarHBondContact OD1-O 3.42Å
236	H	30.7	Very low	37.2	Very low	68 Å²	68	97.2 Å²	97.2	32%	0.315	49%	0.494	S	S	.	.	S	Bend	trans	-107.7	122.8	177.4	-72.3	-72.9	0	0	0	106.4	I238 M648	H236-I238 PolarHBondContact O-N 3.41Å; H236-M648 WeakPolarHBondContact CE1-CB 3.42Å
237	S	33.9	Very low	37.7	Very low	62 Å²	62	94.5 Å²	94.5	43%	0.434	48%	0.48	S	S	.	.			trans	-34	117.5	142.1	32	0	0	0	0	107.6	T239	S237-T239 PolarHBondContact O-N 2.92Å; S237-T239 PolarHBondContact O-OG1 2.82Å
238	I	35.2	Very low	38.1	Very low	38 Å²	38	93.9 Å²	93.9	20%	0.195	48%	0.476	C	S	.	.	S	Bend	trans	-63.8	25.7	-162.9	-69.9	149.2	0	0	0	113.4	H236 T257 K258 E261	H236-I238 PolarHBondContact O-N 3.41Å; I238-T257 HydrophobicContact CD1-CG2 3.69Å; I238-T257 HydrophobicContact CG1-CG2 4.39Å; I238-K258 HydrophobicContact CG2-CG 3.87Å; I238-E261 VanDerWaalsContact CB-OE2 3.22Å; I238-E261 WeakPolarHBondContact CB-OE2 3.35Å; I238-E261 WeakPolarHBondContact CD1-OE2 3.4Å; I238-E261 WeakPolarHBondContact CG2-OE2 3.41Å
239	T	32	Very low	38.6	Very low	108 Å²	108	93.2 Å²	93.2	66%	0.663	47%	0.473	S	S	*	.	S	Bend	trans	-105.6	3.4	-164.9	49.3	0	0	0	0	114.6	S237	S237-T239 PolarHBondContact O-N 2.92Å; S237-T239 PolarHBondContact O-OG1 2.82Å
240	S	33.1	Very low	39.1	Very low	114 Å²	114	88.7 Å²	88.7	80%	0.797	45%	0.449	S	S	*	.			trans	-153.6	28.2	-176.9	-163.9	0	0	0	0	117.3
241	Y	32.5	Very low	39.6	Very low	129 Å²	129	87.7 Å²	87.7	51%	0.506	44%	0.444	S	S	.	.			trans	-91.6	128.6	176.8	-144.3	-92.1	0	0	0	111.9	E243 L246	Y241-E243 PolarHBondContact O-N 3.32Å; Y241-L246 HydrophobicContact CD1-CD1 4.18Å
242	N	38.8	Very low	40	Very low	114 Å²	114	82.1 Å²	82.1	61%	0.61	42%	0.422	S	S	*	.			trans	-53.6	103.9	179.7	-94.5	-32.5	0	0	0	111.5	Q244	N242-Q244 PolarHBondContact O-N 3.21Å
243	E	42.1	Very low	40.7	Very low	92 Å²	92	77.1 Å²	77.1	43%	0.43	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.6	179.9	-69.8	-173.8	157.4	0	0	113.7	Y241 Q245 K251 L254 K258	Y241-E243 PolarHBondContact O-N 3.32Å; E243-Q245 PolarHBondContact O-N 2.72Å; E243-K251 WeakPolarHBondContact O-CE 3.47Å; E243-L254 HydrophobicContact CG-CD2 4.36Å; E243-K258 IonicContact OE1-NZ 2.88Å; E243-K258 PolarHBondContact OE1-NZ 3.37Å
244	Q	44.6	Very low	41.7	Very low	156 Å²	156	74.8 Å²	74.8	73%	0.729	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-18.7	-171.8	-67.6	-180	-9.1	0	0	114.6	N242	N242-Q244 PolarHBondContact O-N 3.21Å
245	Q	42.8	Very low	42.4	Very low	165 Å²	165	74.1 Å²	74.1	77%	0.771	38%	0.383	S	S	*	.	S	Bend	trans	-107.2	-7.4	-172	-64.3	-169.7	13.7	0	0	116.1	E243	E243-Q245 PolarHBondContact O-N 2.72Å
246	L	45.2	Very low	43.4	Very low	25 Å²	25	74.4 Å²	74.4	13%	0.131	38%	0.383	C	S	.	.			trans	-73.4	148.6	-175	-84.2	87.4	0	0	0	113.4	Y241 D250 K251 L254	Y241-L246 HydrophobicContact CD1-CD1 4.18Å; L246-D250 HydrophobicContact CB-CB 4.05Å; L246-D250 HydrophobicContact CD2-CB 3.64Å; L246-D250 WeakPolarHBondContact CD2-O 3.31Å; L246-D250 HydrophobicContact CG-CB 4.06Å; L246-K251 HydrophobicContact CB-CD 4.46Å; L246-K251 HydrophobicContact CB-CG 3.5Å; L246-K251 VanDerWaalsContact CB-CG 3.5Å; L246-K251 WeakPolarHBondContact O-CE 3.41Å; L246-K251 PolarHBondContact O-NZ 3.46Å; L246-L254 HydrophobicContact CD2-CB 4.08Å; L246-L254 HydrophobicContact CD2-CD2 4.02Å
247	N	47.2	Very low	44.6	Very low	100 Å²	100	72.1 Å²	72.1	54%	0.535	37%	0.373	S	S	.	.			trans	-70.2	159.5	168.6	-168.3	3.8	0	0	0	110.7	Q249 D250 K251	N247-Q249 PolarHBondContact O-N 3.01Å; N247-Q249 VanDerWaalsContact O-N 3.09Å; N247-D250 WeakPolarHBondContact CB-OD2 3.45Å; N247-D250 PolarHBondContact N-OD2 3.46Å; N247-D250 PolarHBondContact O-N 2.99Å; N247-K251 WeakPolarHBondContact O-CB 3.35Å; N247-K251 WeakPolarHBondContact O-CG 3.44Å; N247-K251 PolarHBondContact O-N 3.31Å
248	N	43.8	Very low	45.6	Very low	62 Å²	62	72.6 Å²	72.6	33%	0.332	37%	0.368	S	S	.	.	H	α-helix	trans	-57.2	-27.5	-179.1	-78.5	-20.8	0	0	0	113.8	S252 Y362	N248-S252 PolarHBondContact O-N 3.21Å; N248-Y362 PolarHBondContact O-OH 2.84Å
249	Q	50.9	Low	46.4	Very low	126 Å²	126	71.9 Å²	71.9	59%	0.589	37%	0.366	S	S	*	.	H	α-helix	trans	-75.4	-46.4	174.6	-171.2	166.3	-20.6	0	0	111.1	N247 K251 S252 Q253	N247-Q249 PolarHBondContact O-N 3.01Å; N247-Q249 VanDerWaalsContact O-N 3.09Å; Q249-K251 VanDerWaalsContact C-N 3.26Å; Q249-K251 PolarHBondContact O-N 3.29Å; Q249-S252 WeakPolarHBondContact O-CB 3.47Å; Q249-S252 PolarHBondContact O-N 3.29Å; Q249-S252 VanDerWaalsContact O-N 3.14Å; Q249-S252 PolarHBondContact O-OG 3.23Å; Q249-Q253 PolarHBondContact O-N 2.89Å; Q249-Q253 VanDerWaalsContact O-N 3.07Å
250	D	47.6	Very low	47.6	Very low	35 Å²	35	67.9 Å²	67.9	19%	0.187	34%	0.339	C	S	.	.	H	α-helix	trans	-65.6	-32.8	178.2	-46.1	-34.7	0	0	0	111.4	L246 N247 Q253 L254	L246-D250 HydrophobicContact CB-CB 4.05Å; L246-D250 HydrophobicContact CD2-CB 3.64Å; L246-D250 WeakPolarHBondContact CD2-O 3.31Å; L246-D250 HydrophobicContact CG-CB 4.06Å; N247-D250 WeakPolarHBondContact CB-OD2 3.45Å; N247-D250 PolarHBondContact N-OD2 3.46Å; N247-D250 PolarHBondContact O-N 2.99Å; D250-Q253 PolarHBondContact O-N 3.31Å; D250-L254 WeakPolarHBondContact O-CB 3.18Å; D250-L254 PolarHBondContact O-N 3.28Å
251	K	46.6	Very low	48.9	Very low	7 Å²	7	63.3 Å²	63.3	3%	0.03	31%	0.305	C	S	.	.	H	α-helix	trans	-66.3	-39.1	173.3	-75	-164.2	-170.8	112.1	0	113.7	E243 L246 N247 Q249 Q253 L254 F255 Y365 Y369	E243-K251 WeakPolarHBondContact O-CE 3.47Å; L246-K251 HydrophobicContact CB-CD 4.46Å; L246-K251 HydrophobicContact CB-CG 3.5Å; L246-K251 VanDerWaalsContact CB-CG 3.5Å; L246-K251 WeakPolarHBondContact O-CE 3.41Å; L246-K251 PolarHBondContact O-NZ 3.46Å; N247-K251 WeakPolarHBondContact O-CB 3.35Å; N247-K251 WeakPolarHBondContact O-CG 3.44Å; N247-K251 PolarHBondContact O-N 3.31Å; Q249-K251 VanDerWaalsContact C-N 3.26Å; Q249-K251 PolarHBondContact O-N 3.29Å; K251-Q253 VanDerWaalsContact C-N 3.27Å; K251-L254 PolarHBondContact O-N 2.86Å; K251-F255 PolarHBondContact O-N 3.36Å; K251-Y365 HydrophobicContact CB-CE1 3.6Å; K251-Y365 WeakPolarHBondContact CB-OH 3.4Å; K251-Y365 HydrophobicContact CD-CE1 4.41Å; K251-Y369 HydrophobicContact CD-CD1 4.17Å; K251-Y369 HydrophobicContact CD-CD2 3.44Å; K251-Y369 VanDerWaalsContact CD-CD2 3.44Å; K251-Y369 HydrophobicContact CD-CE1 4.1Å; K251-Y369 HydrophobicContact CD-CE2 3.34Å; K251-Y369 HydrophobicContact CD-CG 3.89Å; K251-Y369 VanDerWaalsContact CE-OH 3.25Å; K251-Y369 WeakPolarHBondContact CE-OH 3.37Å; K251-Y369 VanDerWaalsContact NZ-CE2 3.33Å; K251-Y369 PolarHBondContact NZ-OH 2.76Å
252	S	47.7	Very low	50	Low	23 Å²	23	61.3 Å²	61.3	16%	0.161	30%	0.3	C	S	.	.	H	α-helix	trans	-60.9	-43.3	172.4	85	0	0	0	0	110.7	N248 Q249 F255 W256	N248-S252 PolarHBondContact O-N 3.21Å; Q249-S252 WeakPolarHBondContact O-CB 3.47Å; Q249-S252 PolarHBondContact O-N 3.29Å; Q249-S252 VanDerWaalsContact O-N 3.14Å; Q249-S252 PolarHBondContact O-OG 3.23Å; S252-F255 WeakPolarHBondContact O-CB 3.39Å; S252-F255 PolarHBondContact O-N 2.92Å; S252-W256 PolarHBondContact O-N 2.92Å
253	Q	53.2	Low	50.9	Low	35 Å²	35	56.6 Å²	56.6	16%	0.164	27%	0.274	C	S	.	.	H	α-helix	trans	-67.2	-43.5	179.5	-170.9	171.6	11.1	0	0	110.5	S220 N224 Q249 D250 K251 F255 W256 T257	S220-Q253 PolarHBondContact O-NE2 2.77Å; N224-Q253 PolarHBondContact ND2-NE2 3.37Å; N224-Q253 PolarHBondContact ND2-OE1 3.36Å; N224-Q253 PolarHBondContact OD1-OE1 3.43Å; Q249-Q253 PolarHBondContact O-N 2.89Å; Q249-Q253 VanDerWaalsContact O-N 3.07Å; D250-Q253 PolarHBondContact O-N 3.31Å; K251-Q253 VanDerWaalsContact C-N 3.27Å; Q253-F255 VanDerWaalsContact C-N 3.34Å; Q253-F255 PolarHBondContact O-N 3.42Å; Q253-W256 PolarHBondContact O-N 2.86Å; Q253-T257 WeakPolarHBondContact O-CB 3.43Å; Q253-T257 PolarHBondContact O-N 3.1Å; Q253-T257 PolarHBondContact O-OG1 3.27Å
254	L	54.7	Low	51.8	Low	25 Å²	25	53.7 Å²	53.7	13%	0.131	26%	0.26	C	S	.	.	H	α-helix	trans	-58.7	-43.5	174.5	-175.9	64.7	0	0	0	112	E243 L246 D250 K251 T257 K258	E243-L254 HydrophobicContact CG-CD2 4.36Å; L246-L254 HydrophobicContact CD2-CB 4.08Å; L246-L254 HydrophobicContact CD2-CD2 4.02Å; D250-L254 WeakPolarHBondContact O-CB 3.18Å; D250-L254 PolarHBondContact O-N 3.28Å; K251-L254 PolarHBondContact O-N 2.86Å; L254-T257 PolarHBondContact O-N 3.14Å; L254-K258 HydrophobicContact CD1-CG 4.37Å; L254-K258 HydrophobicContact CG-CD 4.38Å; L254-K258 WeakPolarHBondContact O-CB 3.45Å; L254-K258 WeakPolarHBondContact O-CG 3.27Å; L254-K258 PolarHBondContact O-N 3.33Å
255	F	50.8	Low	52.5	Low	50 Å²	50	52.1 Å²	52.1	22%	0.219	25%	0.247	C	C	.	.	H	α-helix	trans	-58.7	-47.5	174.8	171.3	-96.8	0	0	0	111.5	K251 S252 Q253 S259 L361 Y365	K251-F255 PolarHBondContact O-N 3.36Å; S252-F255 WeakPolarHBondContact O-CB 3.39Å; S252-F255 PolarHBondContact O-N 2.92Å; Q253-F255 VanDerWaalsContact C-N 3.34Å; Q253-F255 PolarHBondContact O-N 3.42Å; F255-S259 WeakPolarHBondContact O-CB 3.45Å; F255-S259 PolarHBondContact O-N 2.82Å; F255-S259 PolarHBondContact O-OG 3.48Å; F255-L361 HydrophobicContact CE1-CB 4.22Å; F255-Y365 HydrophobicContact CB-CD2 4.12Å; F255-Y365 HydrophobicContact CB-CE2 4.16Å; F255-Y365 AromaticContact CD2-CD2 3.91Å; F255-Y365 HydrophobicContact CD2-CD2 3.91Å; F255-Y365 HydrophobicContact CD2-CE2 4.41Å; F255-Y365 HydrophobicContact CG-CD2 4.14Å
256	W	58.3	Low	53.1	Low	28 Å²	28	46.2 Å²	46.2	11%	0.106	22%	0.22	C	C	.	.	H	α-helix	trans	-62	-51.1	176.2	-71.8	117.6	0	0	0	110.9	S252 Q253 K258 S259 Y260 M352 R358 L361	S252-W256 PolarHBondContact O-N 2.92Å; Q253-W256 PolarHBondContact O-N 2.86Å; W256-K258 PolarHBondContact O-N 2.72Å; W256-S259 WeakPolarHBondContact O-CA 3.23Å; W256-S259 WeakPolarHBondContact O-CB 3.3Å; W256-S259 PolarHBondContact O-N 2.98Å; W256-Y260 HydrophobicContact CB-CD2 4.43Å; W256-Y260 HydrophobicContact CE3-CE2 4.05Å; W256-Y260 VanDerWaalsContact O-CD2 3.24Å; W256-Y260 WeakPolarHBondContact O-CD2 3.47Å; W256-Y260 PolarHBondContact O-N 2.94Å; W256-M352 HydrophobicContact CH2-SD 3.9Å; W256-M352 HydrophobicContact CZ3-CB 4.48Å; W256-M352 HydrophobicContact CZ3-CE 4.33Å; W256-M352 HydrophobicContact CZ3-SD 3.57Å; W256-M352 VanDerWaalsContact CZ3-SD 3.57Å; W256-R358 HydrophobicContact CH2-CB 4.19Å; W256-R358 HydrophobicContact CH2-CG 3.84Å; W256-R358 HydrophobicContact CZ2-CB 3.97Å; W256-R358 HydrophobicContact CZ2-CG 3.28Å; W256-L361 HydrophobicContact CH2-CB 4.17Å; W256-L361 HydrophobicContact CH2-CD1 3.7Å; W256-L361 HydrophobicContact CZ2-CB 4.18Å; W256-L361 HydrophobicContact CZ3-CD1 4.41Å
257	T	56.7	Low	53.8	Low	20 Å²	20	45.3 Å²	45.3	12%	0.123	22%	0.215	C	C	.	.	H	α-helix	trans	-54.4	-48.7	179	-58.9	0	0	0	0	112.4	F216 I238 Q253 L254 S259 Y260 E261	F216-T257 HydrophobicContact CE1-CG2 4.32Å; I238-T257 HydrophobicContact CD1-CG2 3.69Å; I238-T257 HydrophobicContact CG1-CG2 4.39Å; Q253-T257 WeakPolarHBondContact O-CB 3.43Å; Q253-T257 PolarHBondContact O-N 3.1Å; Q253-T257 PolarHBondContact O-OG1 3.27Å; L254-T257 PolarHBondContact O-N 3.14Å; T257-S259 VanDerWaalsContact C-N 3.32Å; T257-S259 PolarHBondContact O-N 3.23Å; T257-Y260 PolarHBondContact O-N 3.47Å; T257-E261 WeakPolarHBondContact O-CB 3.5Å; T257-E261 PolarHBondContact O-N 3.47Å
258	K	53.9	Low	54.7	Low	72 Å²	72	41.3 Å²	41.3	31%	0.313	19%	0.193	S	C	.	.	H	α-helix	trans	-60.6	-41.4	175.7	-74.5	-175.7	177.2	-172.2	0	111.8	I238 E243 L254 W256 E261 Q262	I238-K258 HydrophobicContact CG2-CG 3.87Å; E243-K258 IonicContact OE1-NZ 2.88Å; E243-K258 PolarHBondContact OE1-NZ 3.37Å; L254-K258 HydrophobicContact CD1-CG 4.37Å; L254-K258 HydrophobicContact CG-CD 4.38Å; L254-K258 WeakPolarHBondContact O-CB 3.45Å; L254-K258 WeakPolarHBondContact O-CG 3.27Å; L254-K258 PolarHBondContact O-N 3.33Å; W256-K258 PolarHBondContact O-N 2.72Å; K258-E261 PolarHBondContact O-N 3.48Å; K258-Q262 WeakPolarHBondContact O-CG 3.4Å; K258-Q262 PolarHBondContact O-N 2.92Å
259	S	51.9	Low	55.6	Low	23 Å²	23	42.1 Å²	42.1	16%	0.161	20%	0.198	C	C	.	.	H	α-helix	trans	-65.1	-45	178.9	-58.2	0	0	0	0	112.3	F255 W256 T257 Q262 Y263	F255-S259 WeakPolarHBondContact O-CB 3.45Å; F255-S259 PolarHBondContact O-N 2.82Å; F255-S259 PolarHBondContact O-OG 3.48Å; W256-S259 WeakPolarHBondContact O-CA 3.23Å; W256-S259 WeakPolarHBondContact O-CB 3.3Å; W256-S259 PolarHBondContact O-N 2.98Å; T257-S259 VanDerWaalsContact C-N 3.32Å; T257-S259 PolarHBondContact O-N 3.23Å; S259-Q262 PolarHBondContact O-N 3.25Å; S259-Y263 PolarHBondContact O-N 3Å; S259-Y263 VanDerWaalsContact O-N 3.1Å
260	Y	57.3	Low	56	Low	25 Å²	25	37.8 Å²	37.8	10%	0.098	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-37.8	176.6	-84.2	-89.4	0	0	0	111.8	F216 W256 T257 Y263 F264 F349 N353	F216-Y260 HydrophobicContact CB-CD1 4.07Å; F216-Y260 HydrophobicContact CB-CE1 4.32Å; F216-Y260 HydrophobicContact CD1-CD1 4.39Å; F216-Y260 HydrophobicContact CD1-CG 4.05Å; F216-Y260 AromaticContact CD2-CD1 3.6Å; F216-Y260 HydrophobicContact CD2-CD1 3.6Å; F216-Y260 AromaticContact CD2-CD2 3.41Å; F216-Y260 HydrophobicContact CD2-CD2 3.41Å; F216-Y260 VanDerWaalsContact CD2-CD2 3.41Å; F216-Y260 AromaticContact CD2-CE1 3.69Å; F216-Y260 HydrophobicContact CD2-CE1 3.69Å; F216-Y260 AromaticContact CD2-CE2 3.56Å; F216-Y260 HydrophobicContact CD2-CE2 3.56Å; F216-Y260 AromaticContact CD2-CG 3.46Å; F216-Y260 HydrophobicContact CD2-CG 3.46Å; F216-Y260 VanDerWaalsContact CD2-CG 3.46Å; F216-Y260 AromaticContact CD2-CZ 3.7Å; F216-Y260 HydrophobicContact CE1-CD2 4.33Å; F216-Y260 HydrophobicContact CE1-CG 4.15Å; F216-Y260 HydrophobicContact CE2-CD1 4.2Å; F216-Y260 AromaticContact CE2-CD2 3.12Å; F216-Y260 HydrophobicContact CE2-CD2 3.12Å; F216-Y260 HydrophobicContact CE2-CE1 4.39Å; F216-Y260 AromaticContact CE2-CE2 3.43Å; F216-Y260 HydrophobicContact CE2-CE2 3.43Å; F216-Y260 VanDerWaalsContact CE2-CE2 3.43Å; F216-Y260 AromaticContact CE2-CG 3.58Å; F216-Y260 HydrophobicContact CE2-CG 3.58Å; F216-Y260 AromaticContact CG-CD1 3.72Å; F216-Y260 HydrophobicContact CG-CD1 3.72Å; F216-Y260 HydrophobicContact CG-CD2 4.14Å; F216-Y260 HydrophobicContact CG-CE1 4.14Å; F216-Y260 AromaticContact CG-CG 3.72Å; F216-Y260 HydrophobicContact CG-CG 3.72Å; F216-Y260 AromaticContact CZ-CD2 3.65Å; F216-Y260 HydrophobicContact CZ-CD2 3.65Å; F216-Y260 HydrophobicContact CZ-CE2 4.37Å; F216-Y260 AromaticContact CZ-CG 3.94Å; F216-Y260 HydrophobicContact CZ-CG 3.94Å; W256-Y260 HydrophobicContact CB-CD2 4.43Å; W256-Y260 HydrophobicContact CE3-CE2 4.05Å; W256-Y260 VanDerWaalsContact O-CD2 3.24Å; W256-Y260 WeakPolarHBondContact O-CD2 3.47Å; W256-Y260 PolarHBondContact O-N 2.94Å; T257-Y260 PolarHBondContact O-N 3.47Å; Y260-Y263 PolarHBondContact O-N 3.15Å; Y260-F264 WeakPolarHBondContact O-CB 3.24Å; Y260-F264 PolarHBondContact O-N 3.38Å; Y260-F349 AromaticContact CD1-CE2 3.87Å; Y260-F349 HydrophobicContact CD1-CE2 3.87Å; Y260-F349 HydrophobicContact CE1-CD2 4.27Å; Y260-F349 AromaticContact CE1-CE2 3.35Å; Y260-F349 HydrophobicContact CE1-CE2 3.35Å; Y260-F349 AromaticContact CE1-CZ 3.89Å; Y260-F349 HydrophobicContact CE1-CZ 3.89Å; Y260-N353 PolarHBondContact OH-OD1 2.76Å
261	E	59.3	Low	56.6	Low	18 Å²	18	36.1 Å²	36.1	8%	0.084	17%	0.169	C	C	.	.	H	α-helix	trans	-64.6	-45.6	177.6	-170.2	-170.6	171.7	0	0	111.1	W213 I238 T257 K258 Y263 F264 R265	W213-E261 HydrophobicContact CH2-CB 3.75Å; W213-E261 HydrophobicContact CH2-CG 3.95Å; W213-E261 VanDerWaalsContact CZ3-CA 3.45Å; W213-E261 HydrophobicContact CZ3-CB 4.07Å; I238-E261 VanDerWaalsContact CB-OE2 3.22Å; I238-E261 WeakPolarHBondContact CB-OE2 3.35Å; I238-E261 WeakPolarHBondContact CD1-OE2 3.4Å; I238-E261 WeakPolarHBondContact CG2-OE2 3.41Å; T257-E261 WeakPolarHBondContact O-CB 3.5Å; T257-E261 PolarHBondContact O-N 3.47Å; K258-E261 PolarHBondContact O-N 3.48Å; E261-Y263 PolarHBondContact O-N 2.78Å; E261-F264 PolarHBondContact O-N 2.86Å; E261-R265 HydrophobicContact CG-CG 4.45Å; E261-R265 WeakPolarHBondContact O-CB 3.4Å; E261-R265 WeakPolarHBondContact O-CG 3.3Å; E261-R265 PolarHBondContact O-N 3.1Å; E261-R265 IonicContact OE1-CZ 3.64Å; E261-R265 VanDerWaalsContact OE1-CZ 3.27Å; E261-R265 IonicContact OE1-NE 3.51Å; E261-R265 PolarHBondContact OE1-NE 3.41Å; E261-R265 IonicContact OE1-NH2 3.58Å; E261-R265 PolarHBondContact OE1-NH2 3.39Å
262	Q	57	Low	57.6	Low	87 Å²	87	40.6 Å²	40.6	41%	0.407	19%	0.188	S	C	.	.	H	α-helix	trans	-61.5	-44.2	177.9	-75	-66.4	-3	0	0	111.9	F126 K258 S259 F264 R265 H266	F126-Q262 HydrophobicContact CE1-CB 4.41Å; K258-Q262 WeakPolarHBondContact O-CG 3.4Å; K258-Q262 PolarHBondContact O-N 2.92Å; S259-Q262 PolarHBondContact O-N 3.25Å; Q262-F264 PolarHBondContact O-N 3.35Å; Q262-R265 PolarHBondContact O-N 3.47Å; Q262-H266 WeakPolarHBondContact O-CB 3.43Å; Q262-H266 PolarHBondContact O-N 2.91Å; Q262-H266 PolarHBondContact O-ND1 3.02Å; Q262-H266 PolarHBondContact OE1-CE1 3.47Å
263	Y	57.8	Low	58.2	Low	14 Å²	14	45.1 Å²	45.1	6%	0.055	21%	0.207	C	C	.	.	H	α-helix	trans	-56.4	-48.5	173	169.7	-97.4	0	0	0	112.1	S259 Y260 E261 T267 C345 W348 F349	S259-Y263 PolarHBondContact O-N 3Å; S259-Y263 VanDerWaalsContact O-N 3.1Å; Y260-Y263 PolarHBondContact O-N 3.15Å; E261-Y263 PolarHBondContact O-N 2.78Å; Y263-T267 VanDerWaalsContact O-CB 3.28Å; Y263-T267 WeakPolarHBondContact O-CB 3.4Å; Y263-T267 PolarHBondContact O-N 3.39Å; Y263-T267 PolarHBondContact O-OG1 2.87Å; Y263-C345 HydrophobicContact CD2-CB 4.46Å; Y263-C345 HydrophobicContact CE2-CB 3.77Å; Y263-C345 VanDerWaalsContact CE2-O 3.3Å; Y263-C345 WeakPolarHBondContact CE2-O 3.32Å; Y263-W348 AromaticContact CD2-CE3 3.78Å; Y263-W348 HydrophobicContact CD2-CE3 3.78Å; Y263-W348 AromaticContact CD2-CZ3 3.82Å; Y263-W348 HydrophobicContact CD2-CZ3 3.82Å; Y263-W348 HydrophobicContact CE2-CE3 4.41Å; Y263-W348 HydrophobicContact CG-CE3 4.46Å; Y263-W348 HydrophobicContact CG-CZ3 4.04Å; Y263-F349 HydrophobicContact CD1-CD2 4.06Å; Y263-F349 AromaticContact CE1-CD2 3.72Å; Y263-F349 HydrophobicContact CE1-CD2 3.72Å; Y263-F349 HydrophobicContact CE1-CE2 4.26Å; Y263-F349 HydrophobicContact CE1-CG 4.42Å; Y263-F349 HydrophobicContact CE2-CB 3.99Å; Y263-F349 HydrophobicContact CE2-CD2 4.35Å; Y263-F349 AromaticContact CZ-CD2 3.89Å
264	F	60.7	Low	58.4	Low	31 Å²	31	44.1 Å²	44.1	14%	0.136	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-47.5	-178.8	-179	-100.1	0	0	0	111.7	Y210 W213 Y260 E261 Q262 H266 T267 M268	Y210-F264 HydrophobicContact CD1-CE2 4.19Å; Y210-F264 AromaticContact CD1-CZ 3.83Å; Y210-F264 HydrophobicContact CD1-CZ 3.83Å; Y210-F264 HydrophobicContact CE1-CE2 4.49Å; Y210-F264 AromaticContact CE1-CZ 3.71Å; Y210-F264 HydrophobicContact CE1-CZ 3.71Å; Y210-F264 HydrophobicContact CG-CE2 4.44Å; Y210-F264 HydrophobicContact CG-CZ 4.43Å; W213-F264 HydrophobicContact CB-CD2 3.55Å; W213-F264 HydrophobicContact CB-CE2 3.7Å; W213-F264 HydrophobicContact CB-CG 4.16Å; W213-F264 HydrophobicContact CB-CZ 4.43Å; W213-F264 HydrophobicContact CD2-CB 4.24Å; W213-F264 HydrophobicContact CD2-CD1 4.29Å; W213-F264 HydrophobicContact CD2-CD2 4.32Å; W213-F264 HydrophobicContact CD2-CG 4.01Å; W213-F264 HydrophobicContact CE3-CB 3.8Å; W213-F264 HydrophobicContact CE3-CG 4.1Å; W213-F264 HydrophobicContact CG-CD1 4.39Å; W213-F264 AromaticContact CG-CD2 3.92Å; W213-F264 HydrophobicContact CG-CD2 3.92Å; W213-F264 HydrophobicContact CG-CE2 4.08Å; W213-F264 HydrophobicContact CG-CG 4.08Å; W213-F264 HydrophobicContact CG-CZ 4.39Å; W213-F264 HydrophobicContact CZ3-CB 4.3Å; Y260-F264 WeakPolarHBondContact O-CB 3.24Å; Y260-F264 PolarHBondContact O-N 3.38Å; E261-F264 PolarHBondContact O-N 2.86Å; Q262-F264 PolarHBondContact O-N 3.35Å; F264-H266 PolarHBondContact O-N 3.5Å; F264-T267 PolarHBondContact O-N 2.94Å; F264-M268 HydrophobicContact CD1-CG 4.27Å; F264-M268 HydrophobicContact CD2-CG 4.22Å; F264-M268 HydrophobicContact CE1-CG 3.89Å; F264-M268 HydrophobicContact CE2-CG 3.84Å; F264-M268 HydrophobicContact CE2-SD 4.26Å; F264-M268 HydrophobicContact CG-CG 4.42Å; F264-M268 HydrophobicContact CZ-CG 3.67Å; F264-M268 HydrophobicContact CZ-SD 4.25Å; F264-M268 WeakPolarHBondContact O-CB 3.34Å; F264-M268 VanDerWaalsContact O-CG 3.25Å; F264-M268 WeakPolarHBondContact O-CG 3.38Å; F264-M268 PolarHBondContact O-N 3.41Å
265	R	59.6	Low	58.8	Low	123 Å²	123	47 Å²	47	46%	0.464	22%	0.215	S	C	.	.	H	α-helix	trans	-57.4	-49.5	177.7	-75.9	179.4	179.2	-95.8	1.7	111.7	E261 Q262 M268 N269	E261-R265 HydrophobicContact CG-CG 4.45Å; E261-R265 WeakPolarHBondContact O-CB 3.4Å; E261-R265 WeakPolarHBondContact O-CG 3.3Å; E261-R265 PolarHBondContact O-N 3.1Å; E261-R265 IonicContact OE1-CZ 3.64Å; E261-R265 VanDerWaalsContact OE1-CZ 3.27Å; E261-R265 IonicContact OE1-NE 3.51Å; E261-R265 PolarHBondContact OE1-NE 3.41Å; E261-R265 IonicContact OE1-NH2 3.58Å; E261-R265 PolarHBondContact OE1-NH2 3.39Å; Q262-R265 PolarHBondContact O-N 3.47Å; R265-M268 PolarHBondContact O-N 3.46Å; R265-N269 WeakPolarHBondContact O-CB 3.48Å; R265-N269 PolarHBondContact O-N 2.88Å
266	H	55.6	Low	59.3	Low	42 Å²	42	51.7 Å²	51.7	19%	0.194	23%	0.233	C	C	.	.	H	α-helix	trans	-65.6	-44.9	-179.6	-81.3	83.8	0	0	0	112.3	L130 Q262 F264 M268 N269 H270	L130-H266 HydrophobicContact CD2-CB 3.87Å; Q262-H266 WeakPolarHBondContact O-CB 3.43Å; Q262-H266 PolarHBondContact O-N 2.91Å; Q262-H266 PolarHBondContact O-ND1 3.02Å; Q262-H266 PolarHBondContact OE1-CE1 3.47Å; F264-H266 PolarHBondContact O-N 3.5Å; H266-M268 VanDerWaalsContact C-N 3.31Å; H266-M268 PolarHBondContact O-N 3.03Å; H266-N269 PolarHBondContact O-N 2.89Å; H266-H270 PolarHBondContact O-CD2 2.86Å; H266-H270 PolarHBondContact O-N 3.42Å
267	T	59.8	Low	59.1	Low	5 Å²	5	52.7 Å²	52.7	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-43.3	177.7	-55.6	0	0	0	0	110.9	Y263 F264 H270 L271	Y263-T267 VanDerWaalsContact O-CB 3.28Å; Y263-T267 WeakPolarHBondContact O-CB 3.4Å; Y263-T267 PolarHBondContact O-N 3.39Å; Y263-T267 PolarHBondContact O-OG1 2.87Å; F264-T267 PolarHBondContact O-N 2.94Å; T267-H270 PolarHBondContact O-N 3.45Å; T267-L271 HydrophobicContact CG2-CD1 3.98Å; T267-L271 WeakPolarHBondContact O-CB 3.32Å; T267-L271 VanDerWaalsContact O-CG 3.25Å; T267-L271 WeakPolarHBondContact O-CG 3.47Å; T267-L271 PolarHBondContact O-N 2.79Å
268	M	66.2	Low	59.1	Low	16 Å²	16	55.1 Å²	55.1	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-68.1	-37.6	177.9	-71.4	-60.2	-72.9	0	0	113	S209 Y210 F264 R265 H266 L271 K272	S209-M268 PolarHBondContact OG-SD 2.8Å; Y210-M268 HydrophobicContact CD2-CE 4.22Å; Y210-M268 HydrophobicContact CE2-CE 3.35Å; Y210-M268 HydrophobicContact CE2-SD 4.21Å; F264-M268 HydrophobicContact CD1-CG 4.27Å; F264-M268 HydrophobicContact CD2-CG 4.22Å; F264-M268 HydrophobicContact CE1-CG 3.89Å; F264-M268 HydrophobicContact CE2-CG 3.84Å; F264-M268 HydrophobicContact CE2-SD 4.26Å; F264-M268 HydrophobicContact CG-CG 4.42Å; F264-M268 HydrophobicContact CZ-CG 3.67Å; F264-M268 HydrophobicContact CZ-SD 4.25Å; F264-M268 WeakPolarHBondContact O-CB 3.34Å; F264-M268 VanDerWaalsContact O-CG 3.25Å; F264-M268 WeakPolarHBondContact O-CG 3.38Å; F264-M268 PolarHBondContact O-N 3.41Å; R265-M268 PolarHBondContact O-N 3.46Å; H266-M268 VanDerWaalsContact C-N 3.31Å; H266-M268 PolarHBondContact O-N 3.03Å; M268-L271 PolarHBondContact O-N 2.91Å; M268-L271 HydrophobicContact SD-CD1 4.22Å; M268-K272 WeakPolarHBondContact O-CB 3.45Å; M268-K272 VanDerWaalsContact O-CG 3.32Å; M268-K272 WeakPolarHBondContact O-CG 3.38Å; M268-K272 PolarHBondContact O-N 3.5Å
269	N	62.2	Low	59	Low	80 Å²	80	54 Å²	54	43%	0.428	26%	0.257	S	S	.	.	H	α-helix	trans	-64.7	-44.8	174.2	-76.7	-13.1	0	0	0	111.4	R265 H266 L271 K272 H273	R265-N269 WeakPolarHBondContact O-CB 3.48Å; R265-N269 PolarHBondContact O-N 2.88Å; H266-N269 PolarHBondContact O-N 2.89Å; N269-L271 PolarHBondContact O-N 3.46Å; N269-K272 PolarHBondContact O-N 2.84Å; N269-H273 PolarHBondContact O-CD2 3.22Å; N269-H273 PolarHBondContact O-N 2.79Å
270	H	58.7	Low	58.8	Low	35 Å²	35	57.5 Å²	57.5	16%	0.162	27%	0.274	C	S	.	.	H	α-helix	trans	-61.2	-43.2	174.2	-85.6	-68.7	0	0	0	112.2	H266 T267 K272 H273 T274	H266-H270 PolarHBondContact O-CD2 2.86Å; H266-H270 PolarHBondContact O-N 3.42Å; T267-H270 PolarHBondContact O-N 3.45Å; H270-K272 VanDerWaalsContact C-N 3.33Å; H270-K272 PolarHBondContact O-N 3.3Å; H270-H273 PolarHBondContact O-N 3.32Å; H270-T274 WeakPolarHBondContact O-CG2 3.3Å; H270-T274 PolarHBondContact O-N 3.3Å; H270-T274 PolarHBondContact O-OG1 3.47Å; H270-T274 VanDerWaalsContact O-OG1 3.12Å
271	L	61.6	Low	58.2	Low	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-37.4	176.6	-74.3	167.2	0	0	0	112.5	I202 L205 K206 T267 M268 N269 T274 E275 I342	I202-L271 HydrophobicContact CG2-CD2 4.1Å; L205-L271 HydrophobicContact CB-CD1 4.38Å; L205-L271 HydrophobicContact CB-CD2 3.72Å; L205-L271 HydrophobicContact CD1-CD2 4.25Å; K206-L271 HydrophobicContact CG-CB 4.14Å; K206-L271 HydrophobicContact CG-CD1 3.83Å; K206-L271 HydrophobicContact CG-CG 4.43Å; T267-L271 HydrophobicContact CG2-CD1 3.98Å; T267-L271 WeakPolarHBondContact O-CB 3.32Å; T267-L271 VanDerWaalsContact O-CG 3.25Å; T267-L271 WeakPolarHBondContact O-CG 3.47Å; T267-L271 PolarHBondContact O-N 2.79Å; M268-L271 PolarHBondContact O-N 2.91Å; M268-L271 HydrophobicContact SD-CD1 4.22Å; N269-L271 PolarHBondContact O-N 3.46Å; L271-T274 VanDerWaalsContact C-OG1 3.24Å; L271-T274 WeakPolarHBondContact CA-OG1 3.18Å; L271-T274 PolarHBondContact O-OG1 2.62Å; L271-E275 WeakPolarHBondContact O-CB 3.22Å; L271-E275 PolarHBondContact O-N 2.96Å; L271-I342 HydrophobicContact CD2-CD1 3.67Å; L271-I342 HydrophobicContact CG-CD1 4.36Å
272	K	65.8	Low	57.3	Low	100 Å²	100	62 Å²	62	44%	0.435	30%	0.302	S	S	.	.	H	α-helix	trans	-64.8	-49.1	172.3	-76	174.4	-178.3	178.2	0	111.1	M268 N269 H270 T274 E275 Y276	M268-K272 WeakPolarHBondContact O-CB 3.45Å; M268-K272 VanDerWaalsContact O-CG 3.32Å; M268-K272 WeakPolarHBondContact O-CG 3.38Å; M268-K272 PolarHBondContact O-N 3.5Å; N269-K272 PolarHBondContact O-N 2.84Å; H270-K272 VanDerWaalsContact C-N 3.33Å; H270-K272 PolarHBondContact O-N 3.3Å; K272-T274 VanDerWaalsContact C-N 3.3Å; K272-T274 PolarHBondContact O-N 3.05Å; K272-E275 WeakPolarHBondContact O-CB 3.44Å; K272-E275 PolarHBondContact O-N 2.68Å; K272-E275 VanDerWaalsContact O-N 3.11Å; K272-Y276 WeakPolarHBondContact O-CD2 3.21Å; K272-Y276 PolarHBondContact O-N 3.39Å
273	H	61.2	Low	56.5	Low	119 Å²	119	62.7 Å²	62.7	55%	0.551	31%	0.308	S	S	*	.	H	α-helix	trans	-63.1	-35.1	178.7	-75.4	-61.5	0	0	0	112.9	N269 H270 S277	N269-H273 PolarHBondContact O-CD2 3.22Å; N269-H273 PolarHBondContact O-N 2.79Å; H270-H273 PolarHBondContact O-N 3.32Å; H273-S277 WeakPolarHBondContact O-CB 3.36Å; H273-S277 PolarHBondContact O-N 3.01Å; H273-S277 VanDerWaalsContact O-N 3.09Å; H273-S277 PolarHBondContact O-OG 3.46Å
274	T	57.8	Low	55.7	Low	13 Å²	13	67.5 Å²	67.5	8%	0.08	34%	0.335	C	S	.	.	H	α-helix	trans	-64	-43	171.5	46.9	0	0	0	0	111.7	H270 L271 K272 S277 I278 K338	H270-T274 WeakPolarHBondContact O-CG2 3.3Å; H270-T274 PolarHBondContact O-N 3.3Å; H270-T274 PolarHBondContact O-OG1 3.47Å; H270-T274 VanDerWaalsContact O-OG1 3.12Å; L271-T274 VanDerWaalsContact C-OG1 3.24Å; L271-T274 WeakPolarHBondContact CA-OG1 3.18Å; L271-T274 PolarHBondContact O-OG1 2.62Å; K272-T274 VanDerWaalsContact C-N 3.3Å; K272-T274 PolarHBondContact O-N 3.05Å; T274-S277 PolarHBondContact O-N 3.13Å; T274-I278 WeakPolarHBondContact O-CG1 3.46Å; T274-I278 PolarHBondContact O-N 3.38Å; T274-I278 VanDerWaalsContact O-N 3.1Å; T274-K338 HydrophobicContact CG2-CB 3.5Å; T274-K338 VanDerWaalsContact CG2-CB 3.5Å; T274-K338 HydrophobicContact CG2-CD 3.51Å; T274-K338 HydrophobicContact CG2-CG 4Å
275	E	62.9	Low	54.7	Low	85 Å²	85	70.8 Å²	70.8	40%	0.397	35%	0.354	S	S	.	.	H	α-helix	trans	-65.5	-45.3	179.9	-174.5	177.8	-123.9	0	0	111.9	I202 K206 L271 K272 S277 I278 S279	I202-E275 HydrophobicContact CD1-CB 4.36Å; I202-E275 HydrophobicContact CG2-CB 4.44Å; K206-E275 IonicContact NZ-OE1 2.72Å; K206-E275 PolarHBondContact NZ-OE1 2.93Å; K206-E275 IonicContact NZ-OE2 3.27Å; K206-E275 PolarHBondContact NZ-OE2 3.31Å; L271-E275 WeakPolarHBondContact O-CB 3.22Å; L271-E275 PolarHBondContact O-N 2.96Å; K272-E275 WeakPolarHBondContact O-CB 3.44Å; K272-E275 PolarHBondContact O-N 2.68Å; K272-E275 VanDerWaalsContact O-N 3.11Å; E275-S277 VanDerWaalsContact C-N 3.26Å; E275-S277 PolarHBondContact O-N 3.26Å; E275-I278 PolarHBondContact O-N 3.07Å; E275-S279 PolarHBondContact O-N 3.48Å; E275-S279 PolarHBondContact O-OG 2.91Å
276	Y	61.4	Low	53.8	Low	149 Å²	149	70 Å²	70	58%	0.584	36%	0.359	S	S	*	.	H	α-helix	trans	-61.2	-33.7	173.7	-81.1	-69.5	0	0	0	112.9	K272 S279 N280	K272-Y276 WeakPolarHBondContact O-CD2 3.21Å; K272-Y276 PolarHBondContact O-N 3.39Å; Y276-S279 WeakPolarHBondContact CA-OG 3.43Å; Y276-S279 PolarHBondContact O-OG 3.31Å; Y276-N280 WeakPolarHBondContact O-CB 3.23Å; Y276-N280 PolarHBondContact O-N 3Å
277	S	54.8	Low	53	Low	50 Å²	50	74.3 Å²	74.3	35%	0.35	38%	0.384	S	S	.	.	H	α-helix	trans	-70.5	-35.5	177.5	-57	0	0	0	0	111.9	H273 T274 E275 T281 K338	H273-S277 WeakPolarHBondContact O-CB 3.36Å; H273-S277 PolarHBondContact O-N 3.01Å; H273-S277 VanDerWaalsContact O-N 3.09Å; H273-S277 PolarHBondContact O-OG 3.46Å; T274-S277 PolarHBondContact O-N 3.13Å; E275-S277 VanDerWaalsContact C-N 3.26Å; E275-S277 PolarHBondContact O-N 3.26Å; S277-T281 PolarHBondContact O-OG1 2.86Å; S277-K338 PolarHBondContact OG-NZ 2.95Å
278	I	56.2	Low	52	Low	70 Å²	70	79.3 Å²	79.3	36%	0.359	41%	0.414	S	S	.	.	H	α-helix	trans	-75.2	-43.4	178.6	-66.1	175.9	0	0	0	110.9	I202 T274 E275 N280 T281 D282	I202-I278 HydrophobicContact CD1-CD1 3.48Å; I202-I278 VanDerWaalsContact CD1-CD1 3.48Å; I202-I278 HydrophobicContact CG1-CD1 4.5Å; T274-I278 WeakPolarHBondContact O-CG1 3.46Å; T274-I278 PolarHBondContact O-N 3.38Å; T274-I278 VanDerWaalsContact O-N 3.1Å; E275-I278 PolarHBondContact O-N 3.07Å; I278-N280 VanDerWaalsContact C-N 3.32Å; I278-N280 PolarHBondContact O-N 3.29Å; I278-T281 WeakPolarHBondContact CA-OG1 3.34Å; I278-T281 PolarHBondContact O-N 2.81Å; I278-T281 VanDerWaalsContact O-N 3.13Å; I278-T281 PolarHBondContact O-OG1 2.93Å; I278-D282 PolarHBondContact O-N 3.42Å
279	S	50.9	Low	50.8	Low	48 Å²	48	85 Å²	85	34%	0.336	44%	0.443	S	S	.	.	H	α-helix	trans	-65.9	-32.6	179.9	60.2	0	0	0	0	113.2	E275 Y276 T281 D282 N283	E275-S279 PolarHBondContact O-N 3.48Å; E275-S279 PolarHBondContact O-OG 2.91Å; Y276-S279 WeakPolarHBondContact CA-OG 3.43Å; Y276-S279 PolarHBondContact O-OG 3.31Å; S279-T281 VanDerWaalsContact C-N 3.35Å; S279-D282 PolarHBondContact O-N 2.72Å; S279-N283 PolarHBondContact O-N 3.45Å
280	N	47.5	Very low	49.6	Very low	98 Å²	98	88.3 Å²	88.3	52%	0.524	46%	0.461	S	S	.	.	H	α-helix	trans	-72.8	-24.1	174.2	-80.1	-12.6	0	0	0	113.5	Y276 I278 N284	Y276-N280 WeakPolarHBondContact O-CB 3.23Å; Y276-N280 PolarHBondContact O-N 3Å; I278-N280 VanDerWaalsContact C-N 3.32Å; I278-N280 PolarHBondContact O-N 3.29Å; N280-N284 PolarHBondContact O-ND2 3.29Å
281	T	45.5	Very low	48.6	Very low	50 Å²	50	91 Å²	91	31%	0.307	48%	0.484	S	S	.	.	H	α-helix	trans	-76.8	-31.1	173.5	41.2	0	0	0	0	113.2	S277 I278 S279 N285	S277-T281 PolarHBondContact O-OG1 2.86Å; I278-T281 WeakPolarHBondContact CA-OG1 3.34Å; I278-T281 PolarHBondContact O-N 2.81Å; I278-T281 VanDerWaalsContact O-N 3.13Å; I278-T281 PolarHBondContact O-OG1 2.93Å; S279-T281 VanDerWaalsContact C-N 3.35Å; T281-N285 PolarHBondContact O-N 3.43Å; T281-N285 PolarHBondContact O-ND2 2.92Å
282	D	39.5	Very low	47.3	Very low	87 Å²	87	99.3 Å²	99.3	47%	0.465	53%	0.529	S	S	.	.	H	α-helix	trans	-77.2	-35.1	179.3	-68.2	-25.4	0	0	0	112.4	I278 S279 N285 N286	I278-D282 PolarHBondContact O-N 3.42Å; S279-D282 PolarHBondContact O-N 2.72Å; D282-N285 PolarHBondContact O-N 3.26Å; D282-N286 PolarHBondContact O-N 3.06Å; D282-N286 PolarHBondContact O-ND2 3.12Å
283	N	40.1	Very low	45.6	Very low	101 Å²	101	97.6 Å²	97.6	54%	0.54	54%	0.539	S	S	.	.	H	α-helix	trans	-71.9	-27.9	176.4	-78.8	-20.3	0	0	0	113.5	S279	S279-N283 PolarHBondContact O-N 3.45Å
284	N	40.9	Very low	44.2	Very low	115 Å²	115	99 Å²	99	62%	0.615	55%	0.551	S	S	*	*	H	α-helix	trans	-80.4	-25.5	176.3	-80.9	-24	0	0	0	113.2	N280 T288	N280-N284 PolarHBondContact O-ND2 3.29Å; N284-T288 PolarHBondContact O-OG1 3.47Å
285	N	41.6	Very low	43.2	Very low	101 Å²	101	105.4 Å²	105.4	54%	0.54	58%	0.584	S	S	.	*	H	α-helix	trans	-83.3	-27.4	177.4	-76	-27	0	0	0	113.5	T281 D282	T281-N285 PolarHBondContact O-N 3.43Å; T281-N285 PolarHBondContact O-ND2 2.92Å; D282-N285 PolarHBondContact O-N 3.26Å
286	N	39.6	Very low	41.9	Very low	107 Å²	107	108.1 Å²	108.1	57%	0.572	60%	0.601	S	S	*	*	H	α-helix	trans	-79.3	-23	178.2	-72.9	-24.7	0	0	0	113.6	D282	D282-N286 PolarHBondContact O-N 3.06Å; D282-N286 PolarHBondContact O-ND2 3.12Å
287	N	38.8	Very low	40.6	Very low	131 Å²	131	108.7 Å²	108.7	70%	0.701	61%	0.609	S	S	*	*	S	Bend	trans	-84.8	-7.9	177.1	-76.3	-16.8	0	0	0	114.1
288	T	38.5	Very low	39.5	Very low	110 Å²	110	113 Å²	113	68%	0.675	63%	0.629	S	S	*	*	S	Bend	trans	-100.8	-3.8	179.3	-19.5	0	0	0	0	114.2	N284	N284-T288 PolarHBondContact O-OG1 3.47Å
289	I	41.1	Very low	38.4	Very low	135 Å²	135	114.8 Å²	114.8	69%	0.692	65%	0.647	S	S	*	*	S	Bend	trans	-106.3	-10	-173	-64.7	176.1	0	0	0	113.1
290	N	38	Very low	37.5	Very low	150 Å²	150	117.5 Å²	117.5	80%	0.802	66%	0.662	S	S	*	*	S	Bend	trans	-107.9	27.5	-173.6	-86.9	-9.1	0	0	0	115.6
291	S	36.7	Very low	36.9	Very low	91 Å²	91	119.1 Å²	119.1	64%	0.636	67%	0.671	S	S	*	*	S	Bend	trans	-130.5	51.9	-177	-43.6	0	0	0	0	112.6
292	N	35.5	Very low	36.3	Very low	176 Å²	176	123 Å²	123	94%	0.941	69%	0.689	S	S	*	*			trans	-163.3	86.9	163.2	-92.1	-27.4	0	0	0	110
293	G	29.1	Very low	36.1	Very low	63 Å²	63	126.3 Å²	126.3	65%	0.649	71%	0.706	S	S	*	*			trans	-126.2	138.7	168.6	0	0	0	0	0	109.8
294	N	31.8	Very low	35.6	Very low	150 Å²	150	129.9 Å²	129.9	80%	0.802	72%	0.719	S	S	*	*			trans	92.4	104.8	170.4	-54.2	-18.3	0	0	0	116.7
295	N	37.2	Very low	35.4	Very low	147 Å²	147	128.6 Å²	128.6	79%	0.786	72%	0.717	S	S	*	*				-178.4	121.1	104.7	-81.3	-25.9	0	0	0	112.9
296	N	35.2	Very low	34.8	Very low	141 Å²	141	132.1 Å²	132.1	75%	0.754	73%	0.727	S	S	*	*			trans	64.4	101.6	141.5	-62.8	-5.5	0	0	0	122.9
297	E	33.9	Very low	34.5	Very low	161 Å²	161	133.3 Å²	133.3	75%	0.752	73%	0.733	S	S	*	*				57.4	116.1	114.8	-70.9	-169.6	-176.9	0	0	122.9
298	N	31.8	Very low	34.2	Very low	141 Å²	141	135.5 Å²	135.5	75%	0.754	74%	0.737	S	S	*	*				96.6	117.4	124.5	-72.2	-24	0	0	0	121.4
299	S	33.2	Very low	33.8	Very low	107 Å²	107	135.8 Å²	135.8	75%	0.748	73%	0.733	S	S	*	*			trans	89.6	133.7	138.7	-149.4	0	0	0	0	117.7
300	T	32.7	Very low	33.3	Very low	105 Å²	105	136.4 Å²	136.4	64%	0.644	73%	0.733	S	S	*	*			cis	-171.4	148.5	-15.4	21.8	0	0	0	0	105.2
301	N	34.3	Very low	33	Very low	133 Å²	133	138 Å²	138	71%	0.711	73%	0.733	S	S	*	*			trans	65	140.2	146.7	-55.6	-4.6	0	0	0	118.3
302	D	32.4	Very low	32.5	Very low	130 Å²	130	141.9 Å²	141.9	70%	0.695	74%	0.738	S	S	*	*			cis	-176.4	155.6	7.7	-119.2	-31.9	0	0	0	109.7
303	I	35.1	Very low	32.2	Very low	158 Å²	158	140.9 Å²	140.9	81%	0.81	73%	0.728	S	S	*	*			trans	86.6	117.5	148.6	-58.1	155.2	0	0	0	121.7
304	H	29.5	Very low	32.2	Very low	176 Å²	176	144.9 Å²	144.9	82%	0.815	73%	0.73	S	S	*	*			trans	-83.2	-165.5	172.5	-122.9	-38.8	0	0	0	111.8
305	P	36.6	Very low	32.2	Very low	88 Å²	88	145.2 Å²	145.2	57%	0.571	72%	0.724	S	S	*	*			cis	-143.6	-173.6	-34.3	41.6	-23.6	0	0	0	115.8
306	K	29.8	Very low	31.7	Very low	175 Å²	175	146.6 Å²	146.6	76%	0.761	73%	0.726	S	S	*	*			trans	80	115.5	145.7	-76.9	170.1	-167.9	178.5	0	122.1
307	N	33	Very low	31.3	Very low	131 Å²	131	147.8 Å²	147.8	70%	0.701	73%	0.727	S	S	*	*				153	130.6	102.1	-91.5	-31.8	0	0	0	114.9
308	K	32.3	Very low	30.9	Very low	177 Å²	177	146.6 Å²	146.6	77%	0.77	73%	0.726	S	S	*	*			trans	51.7	142.3	132.9	-67.8	-179.4	167.9	-179.8	0	119.6
309	I	29.6	Very low	30.7	Very low	117 Å²	117	148.3 Å²	148.3	60%	0.6	73%	0.729	S	S	*	*			cis	177.2	147.6	10.5	-109	169.9	0	0	0	107.3
310	Q	31.1	Very low	30.2	Very low	148 Å²	148	148.7 Å²	148.7	69%	0.692	73%	0.73	S	S	*	*			trans	71.8	122.2	149.9	-78.2	159.9	25.2	0	0	124.9
311	K	31.1	Very low	29.9	Very low	183 Å²	183	147.9 Å²	147.9	80%	0.796	73%	0.729	S	S	*	*				66.3	138.6	128.4	-73	176.7	178.9	178.8	0	117.7
312	K	27.8	Very low	29.5	Very low	172 Å²	172	150.8 Å²	150.8	75%	0.748	74%	0.738	S	S	*	*			cis	-176.8	158.1	-1.2	-154.3	-174.2	177.5	-158.9	0	104.5
313	E	28.4	Very low	29.1	Very low	156 Å²	156	147.6 Å²	147.6	73%	0.729	74%	0.736	S	S	*	*			trans	102.3	121.7	156	-68.2	167.6	-166.1	0	0	120.6
314	E	29.1	Very low	28.8	Very low	146 Å²	146	149.7 Å²	149.7	68%	0.682	74%	0.739	S	S	*	*			trans	86.6	105.7	147.4	-68.6	-166.3	133.6	0	0	122.9
315	K	31.5	Very low	28.9	Very low	157 Å²	157	147.1 Å²	147.1	68%	0.683	73%	0.732	S	S	*	*				64.8	114	123.5	-68.9	171.7	-177.9	153.3	0	120
316	Q	26.9	Very low	28.4	Very low	177 Å²	177	151.6 Å²	151.6	83%	0.827	74%	0.743	S	S	*	*			trans	83.8	132.5	134.3	-74.5	177.3	-10.1	0	0	119.3
317	E	26.6	Very low	28.4	Very low	166 Å²	166	153 Å²	153	78%	0.776	75%	0.749	S	S	*	*			trans	90.8	95.4	160.1	-66.8	-179.4	174.9	0	0	119.8
318	N	26.8	Very low	28.4	Very low	136 Å²	136	154.1 Å²	154.1	73%	0.727	75%	0.747	S	S	*	*				83.1	129.5	121.8	-67.5	-22.9	0	0	0	121.3
319	H	27	Very low	28.2	Very low	176 Å²	176	150.4 Å²	150.4	82%	0.815	74%	0.735	S	S	*	*			trans	89	108.7	156.1	-72.5	-65.5	0	0	0	120.4
320	C	21.6	Very low	28.1	Very low	116 Å²	116	151.5 Å²	151.5	78%	0.784	74%	0.741	S	S	*	*				91	118.8	129.7	-155.6	0	0	0	0	118.1
321	S	26.3	Very low	28.1	Very low	88 Å²	88	149 Å²	149	62%	0.615	73%	0.733	S	S	*	*			trans	119.5	117.9	144.5	-55.1	0	0	0	0	115.6
322	Q	26.9	Very low	27.9	Very low	193 Å²	193	146.9 Å²	146.9	90%	0.902	72%	0.723	S	S	*	*			trans	73.3	124.4	148.3	-59.3	167.2	-11.6	0	0	115.6
323	G	24.9	Very low	28.1	Very low	64 Å²	64	143 Å²	143	66%	0.66	71%	0.711	S	S	*	*			cis	120.1	124	29.8	0	0	0	0	0	107.2
324	K	28.7	Very low	28.7	Very low	201 Å²	201	139.6 Å²	139.6	87%	0.874	70%	0.698	S	S	*	*			trans	81.8	105.2	-179.5	-47.4	161	-173.6	178.8	0	112.7
325	D	31.3	Very low	29.2	Very low	122 Å²	122	135.7 Å²	135.7	65%	0.652	68%	0.684	S	S	*	*	S	Bend	trans	168.9	-10.2	140.2	-82.5	-18.8	0	0	0	115.4
326	F	26.3	Very low	29.8	Very low	183 Å²	183	131.7 Å²	131.7	80%	0.803	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-11.6	179.8	-83.5	-85.2	0	0	0	116
327	K	29.9	Very low	31	Very low	204 Å²	204	126.3 Å²	126.3	89%	0.887	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-7.9	179.8	-112.4	179.3	-179	179	0	115.3
328	K	32	Very low	32.2	Very low	154 Å²	154	120.4 Å²	120.4	67%	0.67	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-22.9	175.1	-86.4	179.7	177.2	176.2	0	113.7
329	I	27.7	Very low	33.3	Very low	100 Å²	100	115.4 Å²	115.4	51%	0.513	59%	0.594	S	S	.	*	H	α-helix	trans	-80.5	-27.3	-169.9	-63.1	170.8	0	0	0	112.2	N333	I329-N333 PolarHBondContact O-ND2 2.87Å
330	L	27.9	Very low	34.5	Very low	140 Å²	140	110.5 Å²	110.5	73%	0.733	57%	0.574	S	S	*	*	H	α-helix	trans	-85.8	-21.9	-179	-85.7	150	0	0	0	115
331	N	31.9	Very low	36	Very low	96 Å²	96	107.5 Å²	107.5	51%	0.513	55%	0.547	S	S	.	.	H	α-helix	trans	-87.4	-30.7	178	-114.1	3.4	0	0	0	113.2	N334 V335	N331-N334 PolarHBondContact O-N 3.25Å; N331-V335 PolarHBondContact O-N 3.37Å
332	F	27	Very low	37.3	Very low	137 Å²	137	103.9 Å²	103.9	60%	0.601	52%	0.521	S	S	*	.	H	α-helix	trans	-66.6	-37	175.4	-100	-85.2	0	0	0	112.5	N334 V335 N336	F332-N334 VanDerWaalsContact C-N 3.29Å; F332-N334 PolarHBondContact O-N 3.43Å; F332-V335 PolarHBondContact O-N 2.71Å; F332-N336 WeakPolarHBondContact O-CB 3.46Å; F332-N336 PolarHBondContact O-N 3.11Å; F332-N336 PolarHBondContact O-ND2 3.39Å
333	N	32.2	Very low	38.4	Very low	90 Å²	90	99.7 Å²	99.7	48%	0.481	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-35.8	178.1	-72.4	-13.5	0	0	0	112.2	I329 T337	I329-N333 PolarHBondContact O-ND2 2.87Å; N333-T337 WeakPolarHBondContact O-CG2 3.45Å; N333-T337 PolarHBondContact O-N 3.27Å; N333-T337 PolarHBondContact O-OG1 3.26Å
334	N	39.8	Very low	39.6	Very low	86 Å²	86	99.9 Å²	99.9	46%	0.46	49%	0.488	S	S	.	.	H	α-helix	trans	-79.3	-24.2	-178.9	-148.9	-1.6	0	0	0	113.2	N331 F332 T337 K338	N331-N334 PolarHBondContact O-N 3.25Å; F332-N334 VanDerWaalsContact C-N 3.29Å; F332-N334 PolarHBondContact O-N 3.43Å; N334-T337 WeakPolarHBondContact CA-OG1 3.25Å; N334-T337 PolarHBondContact O-OG1 2.92Å; N334-T337 VanDerWaalsContact O-OG1 3.06Å; N334-K338 VanDerWaalsContact O-CG 3.27Å; N334-K338 WeakPolarHBondContact O-CG 3.41Å; N334-K338 PolarHBondContact O-N 3.31Å
335	V	39.9	Very low	40.5	Very low	63 Å²	63	91.2 Å²	91.2	38%	0.382	45%	0.453	S	S	.	.	H	α-helix	trans	-77.1	-43.4	170.5	176.1	0	0	0	0	110.1	N331 F332 K338 I339	N331-V335 PolarHBondContact O-N 3.37Å; F332-V335 PolarHBondContact O-N 2.71Å; V335-K338 PolarHBondContact O-N 3.09Å; V335-I339 HydrophobicContact CG1-CD1 3.83Å; V335-I339 HydrophobicContact CG1-CG1 4.41Å; V335-I339 WeakPolarHBondContact O-CG1 3.33Å; V335-I339 PolarHBondContact O-N 2.91Å
336	N	43.5	Very low	41.6	Very low	74 Å²	74	88.3 Å²	88.3	40%	0.396	44%	0.435	S	S	.	.	H	α-helix	trans	-60.8	-45.6	175.7	-75	-19.6	0	0	0	111.6	F332 K338 I339 D340	F332-N336 WeakPolarHBondContact O-CB 3.46Å; F332-N336 PolarHBondContact O-N 3.11Å; F332-N336 PolarHBondContact O-ND2 3.39Å; N336-K338 VanDerWaalsContact C-N 3.28Å; N336-K338 PolarHBondContact O-N 3.35Å; N336-I339 PolarHBondContact O-N 2.6Å; N336-D340 VanDerWaalsContact O-CB 3.31Å; N336-D340 WeakPolarHBondContact O-CB 3.28Å; N336-D340 PolarHBondContact O-N 3.47Å; N336-D340 VanDerWaalsContact O-OD2 3.13Å
337	T	53.7	Low	42.8	Very low	64 Å²	64	83.4 Å²	83.4	39%	0.393	42%	0.417	S	S	.	.	H	α-helix	trans	-61.1	-35.4	176.6	55.7	0	0	0	0	112.7	N333 N334 K341	N333-T337 WeakPolarHBondContact O-CG2 3.45Å; N333-T337 PolarHBondContact O-N 3.27Å; N333-T337 PolarHBondContact O-OG1 3.26Å; N334-T337 WeakPolarHBondContact CA-OG1 3.25Å; N334-T337 PolarHBondContact O-OG1 2.92Å; N334-T337 VanDerWaalsContact O-OG1 3.06Å; T337-K341 VanDerWaalsContact O-CG 3.28Å; T337-K341 WeakPolarHBondContact O-CG 3.39Å; T337-K341 PolarHBondContact O-N 2.94Å
338	K	50.9	Low	43.9	Very low	41 Å²	41	76.4 Å²	76.4	18%	0.178	39%	0.385	C	S	.	.	H	α-helix	trans	-74.5	-38.4	176.4	-69.9	176.5	-171.1	178.2	0	112.4	T274 S277 N334 V335 N336 D340 K341 I342	T274-K338 HydrophobicContact CG2-CB 3.5Å; T274-K338 VanDerWaalsContact CG2-CB 3.5Å; T274-K338 HydrophobicContact CG2-CD 3.51Å; T274-K338 HydrophobicContact CG2-CG 4Å; S277-K338 PolarHBondContact OG-NZ 2.95Å; N334-K338 VanDerWaalsContact O-CG 3.27Å; N334-K338 WeakPolarHBondContact O-CG 3.41Å; N334-K338 PolarHBondContact O-N 3.31Å; V335-K338 PolarHBondContact O-N 3.09Å; N336-K338 VanDerWaalsContact C-N 3.28Å; N336-K338 PolarHBondContact O-N 3.35Å; K338-D340 VanDerWaalsContact C-N 3.32Å; K338-K341 WeakPolarHBondContact O-CB 3.21Å; K338-K341 PolarHBondContact O-N 2.92Å; K338-I342 WeakPolarHBondContact O-CG1 3.18Å; K338-I342 PolarHBondContact O-N 3.28Å; K338-I342 VanDerWaalsContact O-N 3.14Å
339	I	50.6	Low	44.7	Very low	32 Å²	32	70 Å²	70	16%	0.164	36%	0.357	C	S	.	.	H	α-helix	trans	-63.3	-41.6	171.5	-71.5	171.4	0	0	0	110.2	V335 N336 K341 I342 K343	V335-I339 HydrophobicContact CG1-CD1 3.83Å; V335-I339 HydrophobicContact CG1-CG1 4.41Å; V335-I339 WeakPolarHBondContact O-CG1 3.33Å; V335-I339 PolarHBondContact O-N 2.91Å; N336-I339 PolarHBondContact O-N 2.6Å; I339-K341 VanDerWaalsContact C-N 3.34Å; I339-K341 PolarHBondContact O-N 3.42Å; I339-I342 WeakPolarHBondContact O-CB 3.43Å; I339-I342 PolarHBondContact O-N 3.36Å; I339-I342 VanDerWaalsContact O-N 3.1Å; I339-K343 HydrophobicContact CG2-CD 4.43Å; I339-K343 HydrophobicContact CG2-CG 4.49Å; I339-K343 WeakPolarHBondContact O-CG 3.35Å; I339-K343 PolarHBondContact O-N 3.17Å
340	D	52.5	Low	45.7	Very low	73 Å²	73	69.1 Å²	69.1	39%	0.39	35%	0.354	S	S	.	.	H	α-helix	trans	-66.6	-36.8	178.7	-67.2	-24.9	0	0	0	111.1	N336 K338 I342 K343 T344	N336-D340 VanDerWaalsContact O-CB 3.31Å; N336-D340 WeakPolarHBondContact O-CB 3.28Å; N336-D340 PolarHBondContact O-N 3.47Å; N336-D340 VanDerWaalsContact O-OD2 3.13Å; K338-D340 VanDerWaalsContact C-N 3.32Å; D340-I342 VanDerWaalsContact C-N 3.32Å; D340-I342 PolarHBondContact O-N 3.35Å; D340-K343 CarbonylContact O-C 3.21Å; D340-K343 WeakPolarHBondContact O-CB 3.48Å; D340-K343 PolarHBondContact O-N 3.42Å; D340-K343 IonicContact OD1-NZ 2.72Å; D340-K343 PolarHBondContact OD1-NZ 2.93Å; D340-T344 WeakPolarHBondContact O-CB 3.45Å; D340-T344 PolarHBondContact O-N 2.88Å; D340-T344 PolarHBondContact O-OG1 3.02Å
341	K	51.6	Low	46.6	Very low	52 Å²	52	64.4 Å²	64.4	23%	0.226	33%	0.332	C	S	.	.	H	α-helix	trans	-58.8	-41.9	168.5	-74.9	173.6	-176.8	-169.3	0	112.6	N132 T337 K338 I339 T344 C345	N132-K341 PolarHBondContact OD1-NZ 3.21Å; T337-K341 VanDerWaalsContact O-CG 3.28Å; T337-K341 WeakPolarHBondContact O-CG 3.39Å; T337-K341 PolarHBondContact O-N 2.94Å; K338-K341 WeakPolarHBondContact O-CB 3.21Å; K338-K341 PolarHBondContact O-N 2.92Å; I339-K341 VanDerWaalsContact C-N 3.34Å; I339-K341 PolarHBondContact O-N 3.42Å; K341-T344 PolarHBondContact O-N 3.41Å; K341-C345 PolarHBondContact O-N 2.83Å; K341-C345 PolarHBondContact O-SG 3.27Å; K341-C345 VanDerWaalsContact O-SG 3.37Å
342	I	53.3	Low	47.4	Very low	12 Å²	12	60.7 Å²	60.7	6%	0.062	31%	0.312	C	S	.	.	H	α-helix	trans	-66.4	-41.2	176.7	-65	162.3	0	0	0	110.6	L205 L271 K338 I339 D340 T344 C345 Q346	L205-I342 HydrophobicContact CD1-CD1 4.2Å; L205-I342 HydrophobicContact CD1-CG2 4.2Å; L205-I342 HydrophobicContact CD2-CG2 4.04Å; L271-I342 HydrophobicContact CD2-CD1 3.67Å; L271-I342 HydrophobicContact CG-CD1 4.36Å; K338-I342 WeakPolarHBondContact O-CG1 3.18Å; K338-I342 PolarHBondContact O-N 3.28Å; K338-I342 VanDerWaalsContact O-N 3.14Å; I339-I342 WeakPolarHBondContact O-CB 3.43Å; I339-I342 PolarHBondContact O-N 3.36Å; I339-I342 VanDerWaalsContact O-N 3.1Å; D340-I342 VanDerWaalsContact C-N 3.32Å; D340-I342 PolarHBondContact O-N 3.35Å; I342-T344 VanDerWaalsContact C-N 3.34Å; I342-T344 PolarHBondContact O-N 2.92Å; I342-C345 WeakPolarHBondContact O-CB 3.47Å; I342-C345 PolarHBondContact O-N 3.2Å; I342-Q346 WeakPolarHBondContact O-CB 3.3Å; I342-Q346 PolarHBondContact O-N 3.13Å
343	K	50.8	Low	48.2	Very low	105 Å²	105	57.4 Å²	57.4	46%	0.457	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-41.9	172.6	-68.2	175.7	-168.7	152	0	111.4	I339 D340 Q346 L347	I339-K343 HydrophobicContact CG2-CD 4.43Å; I339-K343 HydrophobicContact CG2-CG 4.49Å; I339-K343 WeakPolarHBondContact O-CG 3.35Å; I339-K343 PolarHBondContact O-N 3.17Å; D340-K343 CarbonylContact O-C 3.21Å; D340-K343 WeakPolarHBondContact O-CB 3.48Å; D340-K343 PolarHBondContact O-N 3.42Å; D340-K343 IonicContact OD1-NZ 2.72Å; D340-K343 PolarHBondContact OD1-NZ 2.93Å; K343-Q346 CarbonylContact O-C 3.59Å; K343-Q346 WeakPolarHBondContact O-CB 3.25Å; K343-Q346 PolarHBondContact O-N 2.89Å; K343-Q346 VanDerWaalsContact O-N 3.15Å; K343-L347 WeakPolarHBondContact O-CG 3.4Å; K343-L347 PolarHBondContact O-N 3.12Å
344	T	49.5	Very low	49.1	Very low	69 Å²	69	53.9 Å²	53.9	42%	0.423	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-44.8	176.9	-57.9	0	0	0	0	111.4	D340 K341 I342 Q346 L347 W348	D340-T344 WeakPolarHBondContact O-CB 3.45Å; D340-T344 PolarHBondContact O-N 2.88Å; D340-T344 PolarHBondContact O-OG1 3.02Å; K341-T344 PolarHBondContact O-N 3.41Å; I342-T344 VanDerWaalsContact C-N 3.34Å; I342-T344 PolarHBondContact O-N 2.92Å; T344-Q346 VanDerWaalsContact C-N 3.29Å; T344-Q346 PolarHBondContact O-N 3.01Å; T344-L347 PolarHBondContact O-N 2.85Å; T344-W348 WeakPolarHBondContact O-CB 3.49Å; T344-W348 PolarHBondContact O-N 3.46Å
345	C	48.2	Very low	49.3	Very low	19 Å²	19	55.5 Å²	55.5	13%	0.128	29%	0.291	C	S	.	.	H	α-helix	trans	-57.2	-44.1	171.5	-72.7	0	0	0	0	111.1	Y263 K341 I342 L347 W348 F349	Y263-C345 HydrophobicContact CD2-CB 4.46Å; Y263-C345 HydrophobicContact CE2-CB 3.77Å; Y263-C345 VanDerWaalsContact CE2-O 3.3Å; Y263-C345 WeakPolarHBondContact CE2-O 3.32Å; K341-C345 PolarHBondContact O-N 2.83Å; K341-C345 PolarHBondContact O-SG 3.27Å; K341-C345 VanDerWaalsContact O-SG 3.37Å; I342-C345 WeakPolarHBondContact O-CB 3.47Å; I342-C345 PolarHBondContact O-N 3.2Å; C345-L347 PolarHBondContact O-N 2.8Å; C345-W348 WeakPolarHBondContact O-CB 3.32Å; C345-W348 PolarHBondContact O-N 2.94Å; C345-F349 WeakPolarHBondContact O-CB 3.15Å; C345-F349 PolarHBondContact O-N 3.16Å
346	Q	53.6	Low	49.6	Very low	60 Å²	60	58.1 Å²	58.1	28%	0.28	30%	0.303	S	S	.	.	H	α-helix	trans	-67.5	-35.2	179	-167.3	156.5	-1.4	0	0	113.1	I342 K343 T344 F349 N350	I342-Q346 WeakPolarHBondContact O-CB 3.3Å; I342-Q346 PolarHBondContact O-N 3.13Å; K343-Q346 CarbonylContact O-C 3.59Å; K343-Q346 WeakPolarHBondContact O-CB 3.25Å; K343-Q346 PolarHBondContact O-N 2.89Å; K343-Q346 VanDerWaalsContact O-N 3.15Å; T344-Q346 VanDerWaalsContact C-N 3.29Å; T344-Q346 PolarHBondContact O-N 3.01Å; Q346-F349 WeakPolarHBondContact O-CB 3.32Å; Q346-F349 PolarHBondContact O-N 2.91Å; Q346-N350 WeakPolarHBondContact O-CB 3.48Å; Q346-N350 PolarHBondContact O-N 3.14Å; Q346-N350 PolarHBondContact O-ND2 3.18Å
347	L	52.7	Low	49.7	Very low	80 Å²	80	56.4 Å²	56.4	42%	0.419	29%	0.293	S	S	.	.	H	α-helix	trans	-66.4	-44.7	172.2	-74.1	175.9	0	0	0	111.6	F158 K343 T344 C345 F349 N350 S351	F158-L347 HydrophobicContact CE1-CD2 4.26Å; F158-L347 HydrophobicContact CE2-CD2 4.24Å; F158-L347 HydrophobicContact CZ-CD1 4.02Å; F158-L347 HydrophobicContact CZ-CD2 3.47Å; F158-L347 VanDerWaalsContact CZ-CD2 3.47Å; F158-L347 HydrophobicContact CZ-CG 4.29Å; K343-L347 WeakPolarHBondContact O-CG 3.4Å; K343-L347 PolarHBondContact O-N 3.12Å; T344-L347 PolarHBondContact O-N 2.85Å; C345-L347 PolarHBondContact O-N 2.8Å; L347-F349 VanDerWaalsContact C-N 3.29Å; L347-F349 PolarHBondContact O-N 2.85Å; L347-N350 PolarHBondContact O-N 2.97Å; L347-S351 PolarHBondContact O-N 3.34Å
348	W	52.3	Low	49.4	Very low	57 Å²	57	57.6 Å²	57.6	22%	0.216	29%	0.291	C	S	.	.	H	α-helix	trans	-57.8	-44.2	173.5	-179.2	90	0	0	0	111	F126 Y263 T344 C345 N350 S351 M352	F126-W348 HydrophobicContact CD2-CZ2 4.25Å; F126-W348 HydrophobicContact CE2-CD2 4.1Å; F126-W348 AromaticContact CE2-CE2 3.74Å; F126-W348 HydrophobicContact CE2-CE3 4.46Å; F126-W348 HydrophobicContact CE2-CH2 4.2Å; F126-W348 AromaticContact CE2-CZ2 3.78Å; F126-W348 HydrophobicContact CE2-CZ2 3.78Å; F126-W348 HydrophobicContact CZ-CH2 4.43Å; F126-W348 HydrophobicContact CZ-CZ2 4.35Å; Y263-W348 AromaticContact CD2-CE3 3.78Å; Y263-W348 HydrophobicContact CD2-CE3 3.78Å; Y263-W348 AromaticContact CD2-CZ3 3.82Å; Y263-W348 HydrophobicContact CD2-CZ3 3.82Å; Y263-W348 HydrophobicContact CE2-CE3 4.41Å; Y263-W348 HydrophobicContact CG-CE3 4.46Å; Y263-W348 HydrophobicContact CG-CZ3 4.04Å; T344-W348 WeakPolarHBondContact O-CB 3.49Å; T344-W348 PolarHBondContact O-N 3.46Å; C345-W348 WeakPolarHBondContact O-CB 3.32Å; C345-W348 PolarHBondContact O-N 2.94Å; W348-N350 PolarHBondContact O-N 3.35Å; W348-S351 WeakPolarHBondContact O-CB 3.31Å; W348-S351 PolarHBondContact O-N 3.48Å; W348-S351 VanDerWaalsContact O-N 3.13Å; W348-S351 PolarHBondContact O-OG 3.38Å; W348-M352 HydrophobicContact CD2-CG 4.21Å; W348-M352 HydrophobicContact CE3-CG 4.23Å; W348-M352 HydrophobicContact CH2-CE 3.77Å; W348-M352 HydrophobicContact CH2-CG 4.03Å; W348-M352 HydrophobicContact CZ2-CE 3.23Å; W348-M352 HydrophobicContact CZ2-CG 4.02Å; W348-M352 HydrophobicContact CZ2-SD 4.47Å; W348-M352 HydrophobicContact CZ3-CG 4.12Å; W348-M352 PolarHBondContact O-N 2.99Å
349	F	49.9	Very low	49.1	Very low	21 Å²	21	60.4 Å²	60.4	9%	0.092	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-46	175.5	-175	-90.6	0	0	0	112.8	I212 Y260 Y263 C345 Q346 L347 S351 M352 N353	I212-F349 HydrophobicContact CB-CZ 4.45Å; I212-F349 HydrophobicContact CD1-CE1 4.27Å; I212-F349 HydrophobicContact CD1-CZ 4.43Å; I212-F349 HydrophobicContact CG1-CZ 4.44Å; I212-F349 HydrophobicContact CG2-CD2 4.27Å; I212-F349 HydrophobicContact CG2-CE1 4.12Å; I212-F349 HydrophobicContact CG2-CE2 3.31Å; I212-F349 HydrophobicContact CG2-CZ 3.25Å; Y260-F349 AromaticContact CD1-CE2 3.87Å; Y260-F349 HydrophobicContact CD1-CE2 3.87Å; Y260-F349 HydrophobicContact CE1-CD2 4.27Å; Y260-F349 AromaticContact CE1-CE2 3.35Å; Y260-F349 HydrophobicContact CE1-CE2 3.35Å; Y260-F349 AromaticContact CE1-CZ 3.89Å; Y260-F349 HydrophobicContact CE1-CZ 3.89Å; Y263-F349 HydrophobicContact CD1-CD2 4.06Å; Y263-F349 AromaticContact CE1-CD2 3.72Å; Y263-F349 HydrophobicContact CE1-CD2 3.72Å; Y263-F349 HydrophobicContact CE1-CE2 4.26Å; Y263-F349 HydrophobicContact CE1-CG 4.42Å; Y263-F349 HydrophobicContact CE2-CB 3.99Å; Y263-F349 HydrophobicContact CE2-CD2 4.35Å; Y263-F349 AromaticContact CZ-CD2 3.89Å; C345-F349 WeakPolarHBondContact O-CB 3.15Å; C345-F349 PolarHBondContact O-N 3.16Å; Q346-F349 WeakPolarHBondContact O-CB 3.32Å; Q346-F349 PolarHBondContact O-N 2.91Å; L347-F349 VanDerWaalsContact C-N 3.29Å; L347-F349 PolarHBondContact O-N 2.85Å; F349-S351 PolarHBondContact O-N 3.49Å; F349-M352 PolarHBondContact O-N 3.38Å; F349-N353 WeakPolarHBondContact CE1-ND2 3.38Å; F349-N353 PolarHBondContact O-N 2.85Å
350	N	48.1	Very low	49.1	Very low	81 Å²	81	65.9 Å²	65.9	43%	0.433	33%	0.327	S	S	.	.	H	α-helix	trans	-63.6	-29.3	176.5	-71	-18.4	0	0	0	112.4	K161 Q346 L347 W348	K161-N350 PolarHBondContact NZ-O 3Å; Q346-N350 WeakPolarHBondContact O-CB 3.48Å; Q346-N350 PolarHBondContact O-N 3.14Å; Q346-N350 PolarHBondContact O-ND2 3.18Å; L347-N350 PolarHBondContact O-N 2.97Å; W348-N350 PolarHBondContact O-N 3.35Å
351	S	47.2	Very low	48.8	Very low	41 Å²	41	64.2 Å²	64.2	29%	0.287	32%	0.318	S	S	.	.	H	α-helix	trans	-72.8	-41.6	174.4	82.4	0	0	0	0	112.1	L347 W348 F349 N353 S354 I357	L347-S351 PolarHBondContact O-N 3.34Å; W348-S351 WeakPolarHBondContact O-CB 3.31Å; W348-S351 PolarHBondContact O-N 3.48Å; W348-S351 VanDerWaalsContact O-N 3.13Å; W348-S351 PolarHBondContact O-OG 3.38Å; F349-S351 PolarHBondContact O-N 3.49Å; S351-N353 PolarHBondContact O-N 3.11Å; S351-S354 WeakPolarHBondContact O-CB 3.23Å; S351-S354 PolarHBondContact O-N 3.49Å; S351-I357 VanDerWaalsContact O-CD1 3.27Å; S351-I357 WeakPolarHBondContact O-CD1 3.29Å
352	M	47.4	Very low	48.5	Very low	18 Å²	18	64.2 Å²	64.2	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-63.4	-26.6	176.5	-77.9	-63.8	-156.3	0	0	113.4	W256 W348 F349 S354 I357 L361	W256-M352 HydrophobicContact CH2-SD 3.9Å; W256-M352 HydrophobicContact CZ3-CB 4.48Å; W256-M352 HydrophobicContact CZ3-CE 4.33Å; W256-M352 HydrophobicContact CZ3-SD 3.57Å; W256-M352 VanDerWaalsContact CZ3-SD 3.57Å; W348-M352 HydrophobicContact CD2-CG 4.21Å; W348-M352 HydrophobicContact CE3-CG 4.23Å; W348-M352 HydrophobicContact CH2-CE 3.77Å; W348-M352 HydrophobicContact CH2-CG 4.03Å; W348-M352 HydrophobicContact CZ2-CE 3.23Å; W348-M352 HydrophobicContact CZ2-CG 4.02Å; W348-M352 HydrophobicContact CZ2-SD 4.47Å; W348-M352 HydrophobicContact CZ3-CG 4.12Å; W348-M352 PolarHBondContact O-N 2.99Å; F349-M352 PolarHBondContact O-N 3.38Å; M352-S354 VanDerWaalsContact C-N 3.27Å; M352-S354 PolarHBondContact O-N 2.88Å; M352-I357 HydrophobicContact SD-CG2 4.38Å; M352-L361 HydrophobicContact CE-CD1 3.69Å; M352-L361 HydrophobicContact SD-CD1 3.33Å; M352-L361 WeakPolarHBondContact SD-CD1 3.48Å
353	N	45.1	Very low	48	Very low	67 Å²	67	67.4 Å²	67.4	36%	0.358	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-5.8	172.8	-82.8	-34.2	0	0	0	114.6	Y260 F349 S351 L355 R358	Y260-N353 PolarHBondContact OH-OD1 2.76Å; F349-N353 WeakPolarHBondContact CE1-ND2 3.38Å; F349-N353 PolarHBondContact O-N 2.85Å; S351-N353 PolarHBondContact O-N 3.11Å; N353-L355 PolarHBondContact O-N 3.43Å; N353-R358 PolarHBondContact OD1-NH2 3.49Å
354	S	50	Low	47.7	Very low	16 Å²	16	64.3 Å²	64.3	11%	0.112	32%	0.323	C	S	.	.			trans	-68.3	118.6	168.8	-172.3	0	0	0	0	109.8	S351 M352 N356 I357 R358	S351-S354 WeakPolarHBondContact O-CB 3.23Å; S351-S354 PolarHBondContact O-N 3.49Å; M352-S354 VanDerWaalsContact C-N 3.27Å; M352-S354 PolarHBondContact O-N 2.88Å; S354-N356 PolarHBondContact O-N 3.5Å; S354-N356 VanDerWaalsContact O-N 3.15Å; S354-I357 PolarHBondContact O-N 3.13Å; S354-R358 PolarHBondContact O-N 3.11Å
355	L	44.5	Very low	47.4	Very low	121 Å²	121	63 Å²	63	63%	0.634	31%	0.31	S	S	*	.	H	α-helix	trans	-52.2	-37.9	178.3	-168.2	76	0	0	0	111.7	N353 R358 Q359	N353-L355 PolarHBondContact O-N 3.43Å; L355-R358 WeakPolarHBondContact O-CB 3.35Å; L355-R358 PolarHBondContact O-N 3.43Å; L355-Q359 WeakPolarHBondContact O-CB 3.15Å; L355-Q359 PolarHBondContact O-N 3.03Å
356	N	45.5	Very low	47.2	Very low	118 Å²	118	66.2 Å²	66.2	63%	0.631	32%	0.322	S	S	*	.	H	α-helix	trans	-63.5	-42	176.7	-77.6	-21.8	0	0	0	112.8	S354 K360	S354-N356 PolarHBondContact O-N 3.5Å; S354-N356 VanDerWaalsContact O-N 3.15Å; N356-K360 WeakPolarHBondContact O-CB 3.33Å; N356-K360 VanDerWaalsContact O-CG 3.24Å; N356-K360 WeakPolarHBondContact O-CG 3.43Å; N356-K360 PolarHBondContact O-N 3.49Å
357	I	46.4	Very low	46.6	Very low	37 Å²	37	66.8 Å²	66.8	19%	0.19	33%	0.329	C	S	.	.	H	α-helix	trans	-70.7	-41	177.8	-67.5	173.4	0	0	0	109.6	S351 M352 S354 Q359 K360 L361	S351-I357 VanDerWaalsContact O-CD1 3.27Å; S351-I357 WeakPolarHBondContact O-CD1 3.29Å; M352-I357 HydrophobicContact SD-CG2 4.38Å; S354-I357 PolarHBondContact O-N 3.13Å; I357-Q359 PolarHBondContact O-N 2.93Å; I357-K360 PolarHBondContact O-N 2.85Å; I357-L361 HydrophobicContact CG2-CD1 3.7Å; I357-L361 HydrophobicContact CG2-CG 4.3Å; I357-L361 WeakPolarHBondContact O-CB 3.44Å; I357-L361 WeakPolarHBondContact O-CG 3.42Å; I357-L361 PolarHBondContact O-N 3.27Å
358	R	46.9	Very low	45.9	Very low	89 Å²	89	64.4 Å²	64.4	34%	0.336	32%	0.317	S	S	.	.	H	α-helix	trans	-57.5	-46.9	175	-163.7	-177.1	-66.1	173.9	-1.6	112	W256 N353 S354 L355 Y362	W256-R358 HydrophobicContact CH2-CB 4.19Å; W256-R358 HydrophobicContact CH2-CG 3.84Å; W256-R358 HydrophobicContact CZ2-CB 3.97Å; W256-R358 HydrophobicContact CZ2-CG 3.28Å; N353-R358 PolarHBondContact OD1-NH2 3.49Å; S354-R358 PolarHBondContact O-N 3.11Å; L355-R358 WeakPolarHBondContact O-CB 3.35Å; L355-R358 PolarHBondContact O-N 3.43Å; R358-Y362 WeakPolarHBondContact O-CB 3.47Å; R358-Y362 PolarHBondContact O-N 3.25Å
359	Q	46.2	Very low	45.3	Very low	101 Å²	101	63.9 Å²	63.9	47%	0.472	32%	0.316	S	S	.	.	H	α-helix	trans	-67.8	-42.2	178.7	-162.6	68.5	30.4	0	0	112	L355 I357 Y362 N363	L355-Q359 WeakPolarHBondContact O-CB 3.15Å; L355-Q359 PolarHBondContact O-N 3.03Å; I357-Q359 PolarHBondContact O-N 2.93Å; Q359-Y362 PolarHBondContact O-N 2.88Å; Q359-N363 WeakPolarHBondContact O-CB 3.32Å; Q359-N363 VanDerWaalsContact O-CG 3.27Å; Q359-N363 PolarHBondContact O-N 3.4Å; Q359-N363 PolarHBondContact O-ND2 2.84Å
360	K	49.1	Very low	44.7	Very low	146 Å²	146	66.5 Å²	66.5	64%	0.635	33%	0.33	S	S	*	.	H	α-helix	trans	-61.3	-47.7	176.3	-77.8	177.1	-179.6	-175.3	0	111.5	N356 I357 N363 L364	N356-K360 WeakPolarHBondContact O-CB 3.33Å; N356-K360 VanDerWaalsContact O-CG 3.24Å; N356-K360 WeakPolarHBondContact O-CG 3.43Å; N356-K360 PolarHBondContact O-N 3.49Å; I357-K360 PolarHBondContact O-N 2.85Å; K360-N363 PolarHBondContact O-N 3.25Å; K360-L364 WeakPolarHBondContact O-CB 3.42Å; K360-L364 PolarHBondContact O-N 2.86Å
361	L	46	Very low	43.8	Very low	38 Å²	38	65.9 Å²	65.9	20%	0.199	33%	0.325	C	S	.	.	H	α-helix	trans	-64.2	-40.6	177.9	-73.6	169.1	0	0	0	112	F255 W256 M352 I357 L364 Y365	F255-L361 HydrophobicContact CE1-CB 4.22Å; W256-L361 HydrophobicContact CH2-CB 4.17Å; W256-L361 HydrophobicContact CH2-CD1 3.7Å; W256-L361 HydrophobicContact CZ2-CB 4.18Å; W256-L361 HydrophobicContact CZ3-CD1 4.41Å; M352-L361 HydrophobicContact CE-CD1 3.69Å; M352-L361 HydrophobicContact SD-CD1 3.33Å; M352-L361 WeakPolarHBondContact SD-CD1 3.48Å; I357-L361 HydrophobicContact CG2-CD1 3.7Å; I357-L361 HydrophobicContact CG2-CG 4.3Å; I357-L361 WeakPolarHBondContact O-CB 3.44Å; I357-L361 WeakPolarHBondContact O-CG 3.42Å; I357-L361 PolarHBondContact O-N 3.27Å; L361-L364 PolarHBondContact O-N 3.34Å; L361-Y365 VanDerWaalsContact O-CB 3.32Å; L361-Y365 WeakPolarHBondContact O-CB 3.35Å; L361-Y365 PolarHBondContact O-N 3.34Å
362	Y	46.2	Very low	43.3	Very low	52 Å²	52	72.1 Å²	72.1	20%	0.204	35%	0.347	C	S	.	.	H	α-helix	trans	-64.1	-44.1	174.8	176.5	-116.5	0	0	0	112.5	N248 R358 Q359 L364 Y365 K366	N248-Y362 PolarHBondContact O-OH 2.84Å; R358-Y362 WeakPolarHBondContact O-CB 3.47Å; R358-Y362 PolarHBondContact O-N 3.25Å; Q359-Y362 PolarHBondContact O-N 2.88Å; Y362-L364 VanDerWaalsContact C-N 3.32Å; Y362-L364 PolarHBondContact O-N 2.89Å; Y362-Y365 PolarHBondContact O-N 3.2Å; Y362-K366 HydrophobicContact CE1-CD 4.43Å; Y362-K366 VanDerWaalsContact O-CB 3.29Å; Y362-K366 WeakPolarHBondContact O-CB 3.3Å; Y362-K366 PolarHBondContact O-N 3.14Å
363	N	42.6	Very low	42.8	Very low	79 Å²	79	74.7 Å²	74.7	42%	0.422	36%	0.361	S	S	.	.	H	α-helix	trans	-61.6	-43.5	176.4	-74.8	-19.8	0	0	0	110.8	Q359 K360 K366 T367	Q359-N363 WeakPolarHBondContact O-CB 3.32Å; Q359-N363 VanDerWaalsContact O-CG 3.27Å; Q359-N363 PolarHBondContact O-N 3.4Å; Q359-N363 PolarHBondContact O-ND2 2.84Å; K360-N363 PolarHBondContact O-N 3.25Å; N363-K366 PolarHBondContact O-N 3.14Å; N363-T367 PolarHBondContact O-N 3.08Å; N363-T367 PolarHBondContact O-OG1 2.71Å
364	L	44.9	Very low	42.2	Very low	41 Å²	41	80.7 Å²	80.7	22%	0.215	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-45.5	177.6	-152.3	81.1	0	0	0	111.6	I119 K360 L361 Y362 T367 N368	I119-L364 HydrophobicContact CD1-CD2 4.03Å; I119-L364 HydrophobicContact CD1-CG 4.4Å; I119-L364 HydrophobicContact CG1-CD2 3.61Å; I119-L364 HydrophobicContact CG1-CG 4.44Å; K360-L364 WeakPolarHBondContact O-CB 3.42Å; K360-L364 PolarHBondContact O-N 2.86Å; L361-L364 PolarHBondContact O-N 3.34Å; Y362-L364 VanDerWaalsContact C-N 3.32Å; Y362-L364 PolarHBondContact O-N 2.89Å; L364-T367 WeakPolarHBondContact CA-OG1 3.38Å; L364-T367 PolarHBondContact O-N 2.72Å; L364-T367 PolarHBondContact O-OG1 2.96Å; L364-N368 WeakPolarHBondContact O-CB 3.45Å; L364-N368 PolarHBondContact O-N 2.92Å; L364-N368 PolarHBondContact O-ND2 3.4Å; L364-N368 VanDerWaalsContact O-ND2 3.1Å
365	Y	43.3	Very low	41.1	Very low	40 Å²	40	83.5 Å²	83.5	16%	0.157	40%	0.399	C	S	.	.	H	α-helix	trans	-60.5	-45	173.7	176.9	-89.1	0	0	0	111.8	K251 F255 L361 Y362 N368 Y369	K251-Y365 HydrophobicContact CB-CE1 3.6Å; K251-Y365 WeakPolarHBondContact CB-OH 3.4Å; K251-Y365 HydrophobicContact CD-CE1 4.41Å; F255-Y365 HydrophobicContact CB-CD2 4.12Å; F255-Y365 HydrophobicContact CB-CE2 4.16Å; F255-Y365 AromaticContact CD2-CD2 3.91Å; F255-Y365 HydrophobicContact CD2-CD2 3.91Å; F255-Y365 HydrophobicContact CD2-CE2 4.41Å; F255-Y365 HydrophobicContact CG-CD2 4.14Å; L361-Y365 VanDerWaalsContact O-CB 3.32Å; L361-Y365 WeakPolarHBondContact O-CB 3.35Å; L361-Y365 PolarHBondContact O-N 3.34Å; Y362-Y365 PolarHBondContact O-N 3.2Å; Y365-N368 PolarHBondContact O-N 3.37Å; Y365-Y369 WeakPolarHBondContact O-CB 3.03Å; Y365-Y369 PolarHBondContact O-N 3.28Å
366	K	42.5	Very low	40.5	Very low	88 Å²	88	82.9 Å²	82.9	38%	0.383	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-44	178.2	-175.9	180	178.7	-178.5	0	111.8	Y362 N363 Y369 I370	Y362-K366 HydrophobicContact CE1-CD 4.43Å; Y362-K366 VanDerWaalsContact O-CB 3.29Å; Y362-K366 WeakPolarHBondContact O-CB 3.3Å; Y362-K366 PolarHBondContact O-N 3.14Å; N363-K366 PolarHBondContact O-N 3.14Å; K366-Y369 PolarHBondContact O-N 3.45Å; K366-I370 HydrophobicContact CG-CD1 4.13Å; K366-I370 VanDerWaalsContact O-CG1 3.28Å; K366-I370 WeakPolarHBondContact O-CG1 3.44Å; K366-I370 PolarHBondContact O-N 3.07Å; K366-I370 VanDerWaalsContact O-N 3.11Å
367	T	41.5	Very low	39.7	Very low	71 Å²	71	82.7 Å²	82.7	44%	0.436	40%	0.401	S	S	.	.	H	α-helix	trans	-61.3	-45.5	173	21.5	0	0	0	0	111.6	N363 L364 Y369 I370 M371	N363-T367 PolarHBondContact O-N 3.08Å; N363-T367 PolarHBondContact O-OG1 2.71Å; L364-T367 WeakPolarHBondContact CA-OG1 3.38Å; L364-T367 PolarHBondContact O-N 2.72Å; L364-T367 PolarHBondContact O-OG1 2.96Å; T367-Y369 PolarHBondContact O-N 2.92Å; T367-I370 PolarHBondContact O-N 3.15Å; T367-M371 WeakPolarHBondContact O-CB 3.49Å; T367-M371 VanDerWaalsContact O-CG 3.25Å; T367-M371 WeakPolarHBondContact O-CG 3.42Å; T367-M371 PolarHBondContact O-N 2.97Å
368	N	39	Very low	39	Very low	30 Å²	30	86.8 Å²	86.8	16%	0.16	42%	0.421	C	S	.	.	H	α-helix	trans	-65.9	-37.5	179.6	-87.1	-62	0	0	0	113	N115 I116 I119 L364 Y365 M371 K372	N115-N368 PolarHBondContact O-ND2 3.47Å; I116-N368 WeakPolarHBondContact CG1-OD1 3.46Å; I119-N368 HydrophobicContact CD1-CB 4.32Å; I119-N368 WeakPolarHBondContact CD1-ND2 3.2Å; L364-N368 WeakPolarHBondContact O-CB 3.45Å; L364-N368 PolarHBondContact O-N 2.92Å; L364-N368 PolarHBondContact O-ND2 3.4Å; L364-N368 VanDerWaalsContact O-ND2 3.1Å; Y365-N368 PolarHBondContact O-N 3.37Å; N368-M371 PolarHBondContact O-N 3.42Å; N368-K372 WeakPolarHBondContact O-CB 3.3Å; N368-K372 PolarHBondContact O-N 3.46Å
369	Y	39.4	Very low	38.3	Very low	47 Å²	47	91.4 Å²	91.4	18%	0.184	45%	0.446	C	S	.	.	H	α-helix	trans	-65.1	-42.7	175.8	-174.6	-93.6	0	0	0	112.3	K251 Y365 K366 T367 M371 K372 N373	K251-Y369 HydrophobicContact CD-CD1 4.17Å; K251-Y369 HydrophobicContact CD-CD2 3.44Å; K251-Y369 VanDerWaalsContact CD-CD2 3.44Å; K251-Y369 HydrophobicContact CD-CE1 4.1Å; K251-Y369 HydrophobicContact CD-CE2 3.34Å; K251-Y369 HydrophobicContact CD-CG 3.89Å; K251-Y369 VanDerWaalsContact CE-OH 3.25Å; K251-Y369 WeakPolarHBondContact CE-OH 3.37Å; K251-Y369 VanDerWaalsContact NZ-CE2 3.33Å; K251-Y369 PolarHBondContact NZ-OH 2.76Å; Y365-Y369 WeakPolarHBondContact O-CB 3.03Å; Y365-Y369 PolarHBondContact O-N 3.28Å; K366-Y369 PolarHBondContact O-N 3.45Å; T367-Y369 PolarHBondContact O-N 2.92Å; Y369-M371 VanDerWaalsContact C-N 3.34Å; Y369-K372 PolarHBondContact O-N 2.86Å; Y369-N373 WeakPolarHBondContact CE1-ND2 3.26Å; Y369-N373 WeakPolarHBondContact CE2-ND2 3.39Å; Y369-N373 PolarHBondContact O-N 3.13Å; Y369-N373 PolarHBondContact O-ND2 3.2Å; Y369-N373 PolarHBondContact OH-ND2 3.4Å
370	I	36.2	Very low	37.7	Very low	75 Å²	75	90.9 Å²	90.9	39%	0.385	45%	0.45	S	S	.	.	H	α-helix	trans	-64.1	-43.1	176.2	-67.7	167.7	0	0	0	109.9	K366 T367 K372 N373 Y374	K366-I370 HydrophobicContact CG-CD1 4.13Å; K366-I370 VanDerWaalsContact O-CG1 3.28Å; K366-I370 WeakPolarHBondContact O-CG1 3.44Å; K366-I370 PolarHBondContact O-N 3.07Å; K366-I370 VanDerWaalsContact O-N 3.11Å; T367-I370 PolarHBondContact O-N 3.15Å; I370-K372 PolarHBondContact O-N 3.1Å; I370-N373 PolarHBondContact O-N 3.5Å; I370-Y374 HydrophobicContact CG2-CD2 4.1Å; I370-Y374 WeakPolarHBondContact O-CB 3.43Å; I370-Y374 PolarHBondContact O-N 3.39Å; I370-Y374 VanDerWaalsContact O-N 3.09Å
371	M	29.3	Very low	36.8	Very low	69 Å²	69	88.9 Å²	88.9	34%	0.34	45%	0.445	S	S	.	.	H	α-helix	trans	-64.2	-40.6	178.9	-72.1	-57	-47.1	0	0	113.1	L112 T367 N368 Y369 N373 C375	L112-M371 HydrophobicContact CD2-CE 3.18Å; L112-M371 HydrophobicContact CD2-SD 3.83Å; L112-M371 HydrophobicContact CG-CE 4.23Å; L112-M371 HydrophobicContact CG-SD 4.48Å; T367-M371 WeakPolarHBondContact O-CB 3.49Å; T367-M371 VanDerWaalsContact O-CG 3.25Å; T367-M371 WeakPolarHBondContact O-CG 3.42Å; T367-M371 PolarHBondContact O-N 2.97Å; N368-M371 PolarHBondContact O-N 3.42Å; Y369-M371 VanDerWaalsContact C-N 3.34Å; M371-N373 VanDerWaalsContact C-N 3.31Å; M371-N373 PolarHBondContact O-N 3.48Å; M371-C375 PolarHBondContact O-N 3.45Å
372	K	36.7	Very low	36.2	Very low	172 Å²	172	91.6 Å²	91.6	75%	0.748	46%	0.455	S	S	*	.	H	α-helix	trans	-69.6	-24.1	-179.6	-158.6	173.7	-176.6	-179.6	0	113.5	N368 Y369 I370	N368-K372 WeakPolarHBondContact O-CB 3.3Å; N368-K372 PolarHBondContact O-N 3.46Å; Y369-K372 PolarHBondContact O-N 2.86Å; I370-K372 PolarHBondContact O-N 3.1Å
373	N	36.7	Very low	35.6	Very low	72 Å²	72	96.3 Å²	96.3	39%	0.385	48%	0.481	S	S	.	.	H	α-helix	trans	-101.2	-17.5	-179.4	-69.2	-76.4	0	0	0	114.8	Y369 I370 M371	Y369-N373 WeakPolarHBondContact CE1-ND2 3.26Å; Y369-N373 WeakPolarHBondContact CE2-ND2 3.39Å; Y369-N373 PolarHBondContact O-N 3.13Å; Y369-N373 PolarHBondContact O-ND2 3.2Å; Y369-N373 PolarHBondContact OH-ND2 3.4Å; I370-N373 PolarHBondContact O-N 3.5Å; M371-N373 VanDerWaalsContact C-N 3.31Å; M371-N373 PolarHBondContact O-N 3.48Å
374	Y	33.8	Very low	35	Very low	193 Å²	193	98.7 Å²	98.7	76%	0.757	49%	0.494	S	S	*	.	H	α-helix	trans	-101	1.3	178.9	-84.3	-88.8	0	0	0	114.5	I370 P376	I370-Y374 HydrophobicContact CG2-CD2 4.1Å; I370-Y374 WeakPolarHBondContact O-CB 3.43Å; I370-Y374 PolarHBondContact O-N 3.39Å; I370-Y374 VanDerWaalsContact O-N 3.09Å; Y374-P376 VanDerWaalsContact C-CD 3.42Å
375	C	27.2	Very low	34.5	Very low	75 Å²	75	103 Å²	103	51%	0.507	51%	0.513	S	S	.	.			trans	-118.6	60.6	170.8	-79.4	0	0	0	0	114.3	M371 N377	M371-C375 PolarHBondContact O-N 3.45Å; C375-N377 PolarHBondContact O-N 2.86Å; C375-N377 VanDerWaalsContact O-N 3.08Å
376	P	30.8	Very low	34	Very low	107 Å²	107	107.6 Å²	107.6	70%	0.695	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	7.2	177.9	-11	28.1	0	0	0	115.6	Y374	Y374-P376 VanDerWaalsContact C-CD 3.42Å
377	N	29.7	Very low	33.5	Very low	114 Å²	114	113.5 Å²	113.5	61%	0.61	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	14.8	-170.8	-79.3	-5.8	0	0	0	115.3	C375 I381	C375-N377 PolarHBondContact O-N 2.86Å; C375-N377 VanDerWaalsContact O-N 3.08Å; N377-I381 WeakPolarHBondContact O-CD1 3.18Å
378	M	30.9	Very low	33.1	Very low	124 Å²	124	115.1 Å²	115.1	61%	0.611	58%	0.576	S	S	*	*	S	Bend	trans	-90.1	-23.6	179.4	-112.9	-91.8	176.7	0	0	113.8
379	E	32.6	Very low	32.7	Very low	185 Å²	185	120.5 Å²	120.5	86%	0.864	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-17.6	178.5	-78.4	169.8	169.1	0	0	113.6
380	T	34	Very low	32.3	Very low	91 Å²	91	125.9 Å²	125.9	56%	0.558	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-0.8	175.8	42.1	0	0	0	0	114.4
381	I	30.4	Very low	32.1	Very low	104 Å²	104	130.2 Å²	130.2	53%	0.533	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.4	-16.7	-178.1	-62.6	178.7	0	0	0	112.9	N377	N377-I381 WeakPolarHBondContact O-CD1 3.18Å
382	K	32.4	Very low	32.1	Very low	94 Å²	94	133.5 Å²	133.5	41%	0.409	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.6	-11	173.9	-77.2	-174.5	175.1	-176.2	0	115.6
383	M	32.8	Very low	31.7	Very low	152 Å²	152	132.1 Å²	132.1	75%	0.749	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	8.3	175.8	-68.7	-63.9	-167.2	0	0	114.1
384	N	31.5	Very low	31.5	Very low	129 Å²	129	136.4 Å²	136.4	69%	0.69	70%	0.699	S	S	*	*	S	Bend	trans	-114.3	4.5	173.8	-81.3	-31.1	0	0	0	113.9
385	E	33.1	Very low	31.4	Very low	131 Å²	131	132.9 Å²	132.9	61%	0.612	70%	0.697	S	S	*	*	S	Bend	trans	-101.6	-15	178	-74.8	-177.1	154.5	0	0	114.1
386	D	33.5	Very low	31.5	Very low	136 Å²	136	136 Å²	136	73%	0.727	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	1.4	177.6	-74.7	-25.6	0	0	0	115.1
387	Y	31.8	Very low	31.4	Very low	213 Å²	213	137.3 Å²	137.3	84%	0.835	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	10.3	170.6	-82.1	-75	0	0	0	114.2
388	S	33.1	Very low	31.5	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	72%	0.718	S	S	*	*	S	Bend	trans	-130.8	9.4	-179.8	-91.8	0	0	0	0	116.9
389	L	30.2	Very low	31.5	Very low	143 Å²	143	141.2 Å²	141.2	75%	0.749	73%	0.734	S	S	*	*	S	Bend	trans	-130.3	7.8	-177.8	-78.4	165.7	0	0	0	117.2
390	N	32.1	Very low	31.7	Very low	159 Å²	159	139.4 Å²	139.4	85%	0.85	73%	0.73	S	S	*	*	S	Bend	trans	-116.9	20.1	177	-87.1	-21.3	0	0	0	115.9
391	N	30.7	Very low	31.7	Very low	166 Å²	166	140.8 Å²	140.8	89%	0.888	73%	0.734	S	S	*	*	S	Bend	trans	-112.3	21.6	172	-113.8	2.8	0	0	0	114.4
392	I	30.9	Very low	32	Very low	138 Å²	138	141.9 Å²	141.9	71%	0.708	74%	0.741	S	S	*	*	S	Bend	trans	-122.7	114.2	174.2	-61	178.2	0	0	0	109
393	N	28.4	Very low	32.1	Very low	143 Å²	143	144.1 Å²	144.1	77%	0.765	76%	0.757	S	S	*	*			trans	86.1	94	170	-55.6	-29	0	0	0	116.9
394	I	31	Very low	32.3	Very low	162 Å²	162	140.5 Å²	140.5	83%	0.831	75%	0.747	S	S	*	*				-170.6	93.7	123.5	-85.7	146.9	0	0	0	106
395	V	31.9	Very low	32.5	Very low	119 Å²	119	142.2 Å²	142.2	72%	0.721	76%	0.756	S	S	*	*				88.2	107.9	103.9	172.4	0	0	0	0	113.9
396	N	29.1	Very low	32.6	Very low	140 Å²	140	139 Å²	139	75%	0.749	76%	0.759	S	S	*	*			trans	57.9	136.7	139.6	-72.8	-16.1	0	0	0	123.2
397	N	28.9	Very low	32.6	Very low	136 Å²	136	138 Å²	138	73%	0.727	76%	0.762	S	S	*	*			trans	82.7	92.8	144	-80.6	-3.6	0	0	0	118.7
398	N	31.7	Very low	32.7	Very low	145 Å²	145	132.5 Å²	132.5	78%	0.775	75%	0.754	S	S	*	*				149.7	86.4	103.9	-80.8	-21.6	0	0	0	110
399	N	31.3	Very low	32.8	Very low	174 Å²	174	131.8 Å²	131.8	93%	0.93	75%	0.749	S	S	*	*			trans	-111.6	96.4	163.3	-98.2	-9.8	0	0	0	108.9
400	N	36.1	Very low	33.1	Very low	147 Å²	147	131.4 Å²	131.4	79%	0.786	75%	0.748	S	S	*	*			trans	-102	130	166.1	-107.8	-9.1	0	0	0	109.2
401	N	34.3	Very low	33.3	Very low	120 Å²	120	128.4 Å²	128.4	64%	0.642	74%	0.74	S	S	*	*			trans	90.9	110.7	141.3	-71.6	-6.5	0	0	0	120.7
402	N	36.5	Very low	33.4	Very low	127 Å²	127	128.8 Å²	128.8	68%	0.679	74%	0.742	S	S	*	*			trans	79.9	134.2	131.4	-55.9	-14.2	0	0	0	114.3
403	N	34.4	Very low	33.6	Very low	141 Å²	141	125.6 Å²	125.6	75%	0.754	74%	0.743	S	S	*	*			cis	-176.7	152.6	13.9	-118.8	-9.4	0	0	0	101.1
404	S	38.4	Very low	33.8	Very low	77 Å²	77	123.9 Å²	123.9	54%	0.538	74%	0.742	S	S	.	*			cis	172.6	143.3	16.9	33.5	0	0	0	0	105.4
405	N	35.7	Very low	34.1	Very low	165 Å²	165	123.9 Å²	123.9	88%	0.882	74%	0.741	S	S	*	*			trans	68	130.8	149.7	-51.2	-16.3	0	0	0	117.5
406	G	34.6	Very low	34.3	Very low	64 Å²	64	124.2 Å²	124.2	66%	0.66	74%	0.738	S	S	*	*			cis	174.7	149.9	5.6	0	0	0	0	0	108.6
407	S	34.4	Very low	34.8	Very low	114 Å²	114	122.6 Å²	122.6	80%	0.797	73%	0.73	S	S	*	*			trans	15.8	142.6	139.5	59.7	0	0	0	0	118
408	S	33.8	Very low	35.4	Very low	97 Å²	97	121.5 Å²	121.5	68%	0.678	72%	0.724	S	S	*	*			cis	168.2	155.1	7.2	44.5	0	0	0	0	104
409	S	34.8	Very low	35.9	Very low	90 Å²	90	120.2 Å²	120.2	63%	0.629	72%	0.717	S	S	*	*			trans	64.8	148.1	147.2	65.9	0	0	0	0	121
410	D	36.8	Very low	36.4	Very low	136 Å²	136	117.5 Å²	117.5	73%	0.727	70%	0.703	S	S	*	*			trans	98.8	93.9	151.3	-51.4	-42.4	0	0	0	119.5
411	S	36.8	Very low	36.5	Very low	96 Å²	96	116.7 Å²	116.7	67%	0.671	70%	0.698	S	S	*	*				41.8	121.6	108.5	-47.6	0	0	0	0	119.9
412	N	32.7	Very low	36.7	Very low	173 Å²	173	117 Å²	117	93%	0.925	70%	0.7	S	S	*	*			trans	67.3	138.5	143.9	-63.1	-28.1	0	0	0	120.4
413	G	34.5	Very low	36.6	Very low	71 Å²	71	116.7 Å²	116.7	73%	0.732	70%	0.703	S	S	*	*			trans	122.1	94.8	161.5	0	0	0	0	0	112.1
414	S	32	Very low	36.7	Very low	107 Å²	107	115.3 Å²	115.3	75%	0.748	70%	0.699	S	S	*	*				72.6	128.9	74.8	-156.2	0	0	0	0	113.9
415	M	37.5	Very low	36.6	Very low	162 Å²	162	118.1 Å²	118.1	80%	0.798	71%	0.708	S	S	*	*			trans	72.1	122.1	163.1	-40	-164.3	116.4	0	0	114.4
416	N	36.5	Very low	36.4	Very low	126 Å²	126	117.5 Å²	117.5	67%	0.674	71%	0.705	S	S	*	*				143.7	150.4	71.5	-122.1	-0.5	0	0	0	102.1
417	N	40.3	Very low	36.5	Very low	106 Å²	106	122.2 Å²	122.2	57%	0.567	72%	0.715	S	S	*	*			cis	-175.8	147.5	15.8	-128.4	-13	0	0	0	105.5
418	N	41.1	Very low	36.4	Very low	113 Å²	113	121.9 Å²	121.9	60%	0.604	71%	0.71	S	S	*	*			trans	68.3	136.1	136.6	-64.4	-7.4	0	0	0	118.6
419	N	41.4	Very low	36.5	Very low	118 Å²	118	125.3 Å²	125.3	63%	0.631	72%	0.721	S	S	*	*			cis	-174.7	153.5	17.2	-115.3	-5.4	0	0	0	110.7
420	N	41.1	Very low	36.3	Very low	118 Å²	118	126.9 Å²	126.9	63%	0.631	72%	0.722	S	S	*	*			trans	83.3	104.5	149.5	-55.9	-12.6	0	0	0	117.9
421	N	39.8	Very low	36.3	Very low	130 Å²	130	128.7 Å²	128.7	70%	0.695	73%	0.73	S	S	*	*				98.1	133.8	87.9	-80.3	12.7	0	0	0	108.5
422	D	37.5	Very low	36.2	Very low	126 Å²	126	129.5 Å²	129.5	67%	0.674	73%	0.727	S	S	*	*			cis	-160	131.4	7	-93	-42.6	0	0	0	107.3
423	T	33.9	Very low	36.1	Very low	120 Å²	120	128.5 Å²	128.5	74%	0.736	72%	0.721	S	S	*	*			trans	41	126.4	132.8	7	0	0	0	0	123.4
424	V	37.8	Very low	36.1	Very low	112 Å²	112	133.4 Å²	133.4	68%	0.679	73%	0.73	S	S	*	*			trans	123	103.9	130	-171.5	0	0	0	0	117.3
425	N	36.4	Very low	36.2	Very low	136 Å²	136	134.2 Å²	134.2	73%	0.727	74%	0.736	S	S	*	*			trans	74.4	107.4	141	-59.9	-13.9	0	0	0	123.5
426	N	31.9	Very low	36	Very low	153 Å²	153	133.9 Å²	133.9	82%	0.818	74%	0.736	S	S	*	*				39.4	104.2	124	-62.7	-22.3	0	0	0	120.4
427	D	35.2	Very low	36.1	Very low	162 Å²	162	133.5 Å²	133.5	87%	0.866	74%	0.74	S	S	*	*				-167.1	134.2	125.3	-122.9	-21.6	0	0	0	110.6
428	P	32.9	Very low	35.8	Very low	108 Å²	108	132.6 Å²	132.6	70%	0.701	74%	0.742	S	S	*	*			trans	-99.2	99	-176.5	34.3	-24.1	0	0	0	110.3
429	N	35.5	Very low	36	Very low	168 Å²	168	135 Å²	135	90%	0.898	76%	0.755	S	S	*	*			trans	-173.8	82.4	161.8	-86.8	-35.1	0	0	0	111.5
430	N	31.3	Very low	36.4	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	75%	0.748	S	S	*	*			trans	-174.8	114.9	148.4	-147.7	-14.7	0	0	0	112.2	N432	N430-N432 PolarHBondContact OD1-N 2.9Å; N430-N432 PolarHBondContact OD1-ND2 3.19Å
431	I	35.7	Very low	36.9	Very low	173 Å²	173	131.1 Å²	131.1	89%	0.887	75%	0.751	S	S	*	*			trans	-133.4	86.8	148.8	-58.6	-177.7	0	0	0	106.7
432	N	35.3	Very low	37.3	Very low	113 Å²	113	129.9 Å²	129.9	60%	0.604	74%	0.744	S	S	*	*			trans	-64.6	138.2	151.1	-72.9	-31.2	0	0	0	109	N430	N430-N432 PolarHBondContact OD1-N 2.9Å; N430-N432 PolarHBondContact OD1-ND2 3.19Å
433	N	31.3	Very low	37.9	Very low	152 Å²	152	127.8 Å²	127.8	81%	0.813	73%	0.733	S	S	*	*				166	108.7	124.4	-82.3	-14	0	0	0	110.6
434	L	33.3	Very low	39.3	Very low	175 Å²	175	124.7 Å²	124.7	92%	0.916	72%	0.719	S	S	*	*			trans	-157.8	117.2	134.1	-127.5	75.9	0	0	0	107.8
435	S	33.8	Very low	40.4	Very low	124 Å²	124	124.1 Å²	124.1	87%	0.867	71%	0.712	S	S	*	*			trans	-78.2	129.4	-169.8	71.8	0	0	0	0	111.5
436	I	34.7	Very low	42	Very low	155 Å²	155	121.5 Å²	121.5	80%	0.795	70%	0.697	S	S	*	*			trans	-117.8	137.1	172.3	-60.2	175.1	0	0	0	107.8	S438	I436-S438 PolarHBondContact O-N 2.99Å
437	P	38.1	Very low	43.6	Very low	117 Å²	117	121.1 Å²	121.1	76%	0.76	69%	0.69	S	S	*	*			trans	-68.5	122.4	-166.7	-12.8	27.9	0	0	0	112.1	N439	P437-N439 PolarHBondContact O-N 3.42Å
438	S	34.5	Very low	45	Very low	88 Å²	88	119 Å²	119	62%	0.615	68%	0.676	S	S	*	*	S	Bend	trans	-58.3	115.5	163	51.5	0	0	0	0	109	I436	I436-S438 PolarHBondContact O-N 2.99Å
439	N	43.7	Very low	46.2	Very low	164 Å²	164	117.1 Å²	117.1	88%	0.877	66%	0.663	S	S	*	*			trans	169.6	15	158.1	-82.6	-17.4	0	0	0	114.7	P437	P437-N439 PolarHBondContact O-N 3.42Å
440	S	51.2	Low	47.8	Very low	70 Å²	70	111.7 Å²	111.7	49%	0.49	64%	0.636	S	S	.	*			trans	-77.4	140.5	178	-178.9	0	0	0	0	112.2	L442 D443 A444	S440-L442 PolarHBondContact O-N 2.87Å; S440-L442 PolarHBondContact OG-N 3.41Å; S440-D443 WeakPolarHBondContact O-CB 3.47Å; S440-D443 PolarHBondContact O-N 3.35Å; S440-A444 PolarHBondContact O-N 3.26Å
441	A	52.3	Low	49.4	Very low	84 Å²	84	108 Å²	108	69%	0.694	62%	0.619	S	S	*	*	H	α-helix	trans	-54.7	-26.3	173.3	0	0	0	0	0	112.7	A444 L445	A441-A444 PolarHBondContact O-N 3.33Å; A441-L445 WeakPolarHBondContact O-CB 3.42Å; A441-L445 PolarHBondContact O-N 2.6Å
442	L	47.7	Very low	50.8	Low	104 Å²	104	103.3 Å²	103.3	55%	0.545	60%	0.599	S	S	.	*	H	α-helix	trans	-67.1	-40.6	174	-171.7	66.1	0	0	0	112.1	S440 L445 I446	S440-L442 PolarHBondContact O-N 2.87Å; S440-L442 PolarHBondContact OG-N 3.41Å; L442-L445 PolarHBondContact O-N 2.92Å; L442-I446 HydrophobicContact CD1-CD1 4.47Å; L442-I446 HydrophobicContact CG-CD1 3.98Å; L442-I446 WeakPolarHBondContact O-CB 3.37Å; L442-I446 VanDerWaalsContact O-CG1 3.23Å; L442-I446 WeakPolarHBondContact O-CG1 3.29Å; L442-I446 PolarHBondContact O-N 3.39Å
443	D	49.5	Very low	52	Low	82 Å²	82	103.4 Å²	103.4	44%	0.439	60%	0.597	S	S	.	*	H	α-helix	trans	-66.2	-39	175.7	-93.9	-10.2	0	0	0	111.3	S440 L445 I446 H447	S440-D443 WeakPolarHBondContact O-CB 3.47Å; S440-D443 PolarHBondContact O-N 3.35Å; D443-L445 VanDerWaalsContact C-N 3.34Å; D443-L445 PolarHBondContact O-N 3.21Å; D443-I446 PolarHBondContact O-N 3.24Å; D443-H447 WeakPolarHBondContact O-CB 3.44Å; D443-H447 PolarHBondContact O-N 2.76Å
444	A	64.3	Low	53.3	Low	54 Å²	54	102 Å²	102	45%	0.446	59%	0.586	S	S	.	*	H	α-helix	trans	-64.7	-38	174.4	0	0	0	0	0	112	S440 A441 M448	S440-A444 PolarHBondContact O-N 3.26Å; A441-A444 PolarHBondContact O-N 3.33Å; A444-M448 WeakPolarHBondContact O-CB 3.29Å; A444-M448 PolarHBondContact O-N 3.26Å
445	L	59.3	Low	54.4	Low	101 Å²	101	99.2 Å²	99.2	53%	0.529	57%	0.568	S	S	.	*	H	α-helix	trans	-70.2	-40.6	176.9	-156.6	102.5	0	0	0	111.9	A441 L442 D443 M448 T449	A441-L445 WeakPolarHBondContact O-CB 3.42Å; A441-L445 PolarHBondContact O-N 2.6Å; L442-L445 PolarHBondContact O-N 2.92Å; D443-L445 VanDerWaalsContact C-N 3.34Å; D443-L445 PolarHBondContact O-N 3.21Å; L445-M448 PolarHBondContact O-N 3.24Å; L445-T449 WeakPolarHBondContact O-CB 3.43Å; L445-T449 WeakPolarHBondContact O-CG2 3.27Å; L445-T449 PolarHBondContact O-N 3.35Å; L445-T449 PolarHBondContact O-OG1 2.83Å
446	I	69.9	Low	55.2	Low	80 Å²	80	99.7 Å²	99.7	41%	0.41	56%	0.561	S	S	.	*	H	α-helix	trans	-65.1	-44.4	174.1	-68.5	166.7	0	0	0	109.7	L442 D443 T449 T450	L442-I446 HydrophobicContact CD1-CD1 4.47Å; L442-I446 HydrophobicContact CG-CD1 3.98Å; L442-I446 WeakPolarHBondContact O-CB 3.37Å; L442-I446 VanDerWaalsContact O-CG1 3.23Å; L442-I446 WeakPolarHBondContact O-CG1 3.29Å; L442-I446 PolarHBondContact O-N 3.39Å; D443-I446 PolarHBondContact O-N 3.24Å; I446-T449 WeakPolarHBondContact CA-OG1 3.4Å; I446-T449 PolarHBondContact O-N 3.38Å; I446-T449 PolarHBondContact O-OG1 3.39Å; I446-T449 VanDerWaalsContact O-OG1 3.11Å; I446-T450 WeakPolarHBondContact O-CB 3.34Å; I446-T450 PolarHBondContact O-N 2.82Å; I446-T450 PolarHBondContact O-OG1 2.86Å
447	H	66	Low	55.8	Low	145 Å²	145	101 Å²	101	67%	0.671	56%	0.56	S	S	*	*	H	α-helix	trans	-63.3	-41.7	175.1	-108.7	-80.1	0	0	0	112.4	D443 S451	D443-H447 WeakPolarHBondContact O-CB 3.44Å; D443-H447 PolarHBondContact O-N 2.76Å; H447-S451 WeakPolarHBondContact O-CB 3.19Å; H447-S451 PolarHBondContact O-N 2.92Å
448	M	65.4	Low	56.4	Low	118 Å²	118	102.4 Å²	102.4	58%	0.581	56%	0.556	S	S	*	*	H	α-helix	trans	-62.7	-53.9	175.2	-92.7	-172.5	-74.8	0	0	111.3	A444 L445 T450 S451 T452	A444-M448 WeakPolarHBondContact O-CB 3.29Å; A444-M448 PolarHBondContact O-N 3.26Å; L445-M448 PolarHBondContact O-N 3.24Å; M448-T450 VanDerWaalsContact C-N 3.33Å; M448-T450 PolarHBondContact O-N 3.21Å; M448-S451 PolarHBondContact O-N 2.92Å; M448-T452 PolarHBondContact O-N 3.48Å; M448-T452 PolarHBondContact O-OG1 3.29Å
449	T	58	Low	56.8	Low	68 Å²	68	104.8 Å²	104.8	42%	0.417	56%	0.562	S	S	.	*	H	α-helix	trans	-62	-39.3	-179.1	48.5	0	0	0	0	112.5	L445 I446 M453	L445-T449 WeakPolarHBondContact O-CB 3.43Å; L445-T449 WeakPolarHBondContact O-CG2 3.27Å; L445-T449 PolarHBondContact O-N 3.35Å; L445-T449 PolarHBondContact O-OG1 2.83Å; I446-T449 WeakPolarHBondContact CA-OG1 3.4Å; I446-T449 PolarHBondContact O-N 3.38Å; I446-T449 PolarHBondContact O-OG1 3.39Å; I446-T449 VanDerWaalsContact O-OG1 3.11Å; T449-M453 WeakPolarHBondContact O-CB 3.28Å; T449-M453 VanDerWaalsContact O-CG 3.32Å; T449-M453 WeakPolarHBondContact O-CG 3.37Å; T449-M453 PolarHBondContact O-N 3.24Å
450	T	68.3	Low	56.6	Low	54 Å²	54	100.5 Å²	100.5	33%	0.331	56%	0.557	S	S	.	*	H	α-helix	trans	-70.5	-40	177.4	-47.6	0	0	0	0	111.4	I446 M448 M453 Q454	I446-T450 WeakPolarHBondContact O-CB 3.34Å; I446-T450 PolarHBondContact O-N 2.82Å; I446-T450 PolarHBondContact O-OG1 2.86Å; M448-T450 VanDerWaalsContact C-N 3.33Å; M448-T450 PolarHBondContact O-N 3.21Å; T450-M453 PolarHBondContact O-N 3.42Å; T450-Q454 WeakPolarHBondContact O-CB 2.74Å; T450-Q454 VanDerWaalsContact O-CG 3.3Å; T450-Q454 WeakPolarHBondContact O-CG 2.99Å; T450-Q454 PolarHBondContact O-N 2.82Å
451	S	64.9	Low	55.9	Low	46 Å²	46	102.7 Å²	102.7	32%	0.322	56%	0.563	S	S	.	*	H	α-helix	trans	-66.8	-40.8	175.4	-169.8	0	0	0	0	111.8	H447 M448 M453 Q454 Q455	H447-S451 WeakPolarHBondContact O-CB 3.19Å; H447-S451 PolarHBondContact O-N 2.92Å; M448-S451 PolarHBondContact O-N 2.92Å; S451-M453 PolarHBondContact O-N 2.72Å; S451-Q454 PolarHBondContact O-N 2.96Å; S451-Q455 WeakPolarHBondContact O-CG 3.12Å; S451-Q455 PolarHBondContact O-N 2.87Å; S451-Q455 PolarHBondContact OG-NE2 3Å
452	T	65.8	Low	55.3	Low	75 Å²	75	108.7 Å²	108.7	46%	0.46	57%	0.574	S	S	.	*	H	α-helix	trans	-64.7	-39.9	173.9	-45.8	0	0	0	0	111.5	M448 Q454 Q455 L456	M448-T452 PolarHBondContact O-N 3.48Å; M448-T452 PolarHBondContact O-OG1 3.29Å; T452-Q454 VanDerWaalsContact C-N 3.33Å; T452-Q454 PolarHBondContact O-N 3.03Å; T452-Q455 PolarHBondContact O-N 2.98Å; T452-L456 HydrophobicContact CG2-CD1 4.29Å; T452-L456 WeakPolarHBondContact O-CB 3.29Å; T452-L456 VanDerWaalsContact O-CG 3.29Å; T452-L456 WeakPolarHBondContact O-CG 3.38Å; T452-L456 PolarHBondContact O-N 2.96Å
453	M	59.6	Low	54.6	Low	115 Å²	115	107.9 Å²	107.9	57%	0.567	58%	0.577	S	S	*	*	H	α-helix	trans	-69.5	-28.2	175.5	-75.8	-166.2	-70.5	0	0	113.5	T449 T450 S451 K457	T449-M453 WeakPolarHBondContact O-CB 3.28Å; T449-M453 VanDerWaalsContact O-CG 3.32Å; T449-M453 WeakPolarHBondContact O-CG 3.37Å; T449-M453 PolarHBondContact O-N 3.24Å; T450-M453 PolarHBondContact O-N 3.42Å; S451-M453 PolarHBondContact O-N 2.72Å; M453-K457 WeakPolarHBondContact O-CG 3.34Å; M453-K457 PolarHBondContact O-N 2.79Å
454	Q	58.4	Low	54	Low	124 Å²	124	111 Å²	111	58%	0.579	59%	0.594	S	S	*	*	H	α-helix	trans	-77.3	-39.4	174.2	-75.6	174.4	-5.7	0	0	111.8	T450 S451 T452 K457 H458	T450-Q454 WeakPolarHBondContact O-CB 2.74Å; T450-Q454 VanDerWaalsContact O-CG 3.3Å; T450-Q454 WeakPolarHBondContact O-CG 2.99Å; T450-Q454 PolarHBondContact O-N 2.82Å; S451-Q454 PolarHBondContact O-N 2.96Å; T452-Q454 VanDerWaalsContact C-N 3.33Å; T452-Q454 PolarHBondContact O-N 3.03Å; Q454-K457 PolarHBondContact O-N 3.48Å; Q454-K457 VanDerWaalsContact O-N 3.11Å; Q454-H458 PolarHBondContact O-N 3.35Å; Q454-H458 VanDerWaalsContact O-N 3.13Å
455	Q	57	Low	52.6	Low	116 Å²	116	116.6 Å²	116.6	54%	0.542	61%	0.61	S	S	.	*	H	α-helix	trans	-61.4	-43.9	173.3	-73.7	172.7	27.4	0	0	111.2	S451 T452 K457 H458 D459	S451-Q455 WeakPolarHBondContact O-CG 3.12Å; S451-Q455 PolarHBondContact O-N 2.87Å; S451-Q455 PolarHBondContact OG-NE2 3Å; T452-Q455 PolarHBondContact O-N 2.98Å; Q455-K457 PolarHBondContact O-N 3.18Å; Q455-K457 VanDerWaalsContact O-N 3.12Å; Q455-H458 PolarHBondContact O-N 3.34Å; Q455-H458 VanDerWaalsContact O-N 3.16Å; Q455-D459 PolarHBondContact O-N 3.49Å
456	L	49.6	Very low	51.8	Low	134 Å²	134	118.8 Å²	118.8	70%	0.702	62%	0.622	S	S	*	*	H	α-helix	trans	-67.7	-11.2	175.8	-68.7	170.9	0	0	0	114.6	T452	T452-L456 HydrophobicContact CG2-CD1 4.29Å; T452-L456 WeakPolarHBondContact O-CB 3.29Å; T452-L456 VanDerWaalsContact O-CG 3.29Å; T452-L456 WeakPolarHBondContact O-CG 3.38Å; T452-L456 PolarHBondContact O-N 2.96Å
457	K	48.9	Very low	50.3	Low	182 Å²	182	121.1 Å²	121.1	79%	0.791	64%	0.635	S	S	*	*	H	α-helix	trans	-99.9	-17	174.4	-80.1	-178.1	176.8	-176.6	0	113.6	M453 Q454 Q455	M453-K457 WeakPolarHBondContact O-CG 3.34Å; M453-K457 PolarHBondContact O-N 2.79Å; Q454-K457 PolarHBondContact O-N 3.48Å; Q454-K457 VanDerWaalsContact O-N 3.11Å; Q455-K457 PolarHBondContact O-N 3.18Å; Q455-K457 VanDerWaalsContact O-N 3.12Å
458	H	50.7	Low	48.7	Very low	146 Å²	146	123 Å²	123	68%	0.676	65%	0.645	S	S	*	*	H	α-helix	trans	-98.6	-11.4	-177.2	-132	-63.6	0	0	0	113.9	Q454 Q455 G460	Q454-H458 PolarHBondContact O-N 3.35Å; Q454-H458 VanDerWaalsContact O-N 3.13Å; Q455-H458 PolarHBondContact O-N 3.34Å; Q455-H458 VanDerWaalsContact O-N 3.16Å; H458-G460 PolarHBondContact O-N 3.01Å; H458-G460 VanDerWaalsContact O-N 3.16Å
459	D	42.6	Very low	47.7	Very low	139 Å²	139	122.9 Å²	122.9	74%	0.743	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	17.5	176.7	-66.7	-27.1	0	0	0	114.2	Q455	Q455-D459 PolarHBondContact O-N 3.49Å
460	G	40	Very low	47	Very low	74 Å²	74	123.9 Å²	123.9	76%	0.763	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	2.9	179.7	0	0	0	0	0	115.3	H458	H458-G460 PolarHBondContact O-N 3.01Å; H458-G460 VanDerWaalsContact O-N 3.16Å
461	D	36.5	Very low	45.8	Very low	116 Å²	116	125.5 Å²	125.5	62%	0.62	67%	0.67	S	S	*	*			trans	-112.6	68.6	-173.5	-152.8	2.5	0	0	0	111.3
462	F	38.2	Very low	44.8	Very low	210 Å²	210	129 Å²	129	92%	0.921	68%	0.684	S	S	*	*			trans	-102	87.6	152.5	-86.4	-82.5	0	0	0	106.8	D464	F462-D464 PolarHBondContact O-N 3.4Å
463	S	33.7	Very low	43.8	Very low	86 Å²	86	132.8 Å²	132.8	60%	0.601	70%	0.697	S	S	*	*			trans	-66.4	109.9	159	24	0	0	0	0	107.7
464	D	37.9	Very low	43	Very low	148 Å²	148	134.6 Å²	134.6	79%	0.791	70%	0.702	S	S	*	*			trans	-172.3	115.9	137.9	-90.8	-21.1	0	0	0	109.5	F462	F462-D464 PolarHBondContact O-N 3.4Å
465	E	35	Very low	42.2	Very low	171 Å²	171	137.3 Å²	137.3	80%	0.799	71%	0.708	S	S	*	*			trans	39.8	104.1	138.2	-100.9	-179.3	161	0	0	118.1
466	L	40.8	Very low	41.6	Very low	148 Å²	148	136.5 Å²	136.5	78%	0.775	71%	0.707	S	S	*	*				144.9	122.7	121.9	-71.9	161.3	0	0	0	113.3
467	N	38.1	Very low	41.3	Very low	129 Å²	129	137.7 Å²	137.7	69%	0.69	71%	0.707	S	S	*	*			trans	72.6	68.3	153.1	-62.1	-19.2	0	0	0	118.7	T469	N467-T469 PolarHBondContact O-N 3.09Å; N467-T469 VanDerWaalsContact O-N 3.09Å
468	E	33.4	Very low	41.1	Very low	185 Å²	185	133.8 Å²	133.8	86%	0.864	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.4	93.7	149.2	-168.9	175.5	-147.8	0	0	112.2
469	T	44.7	Very low	40.7	Very low	115 Å²	115	129.4 Å²	129.4	71%	0.706	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	179.6	-17.4	150.5	19.7	0	0	0	0	114.4	N467	N467-T469 PolarHBondContact O-N 3.09Å; N467-T469 VanDerWaalsContact O-N 3.09Å
470	S	43.7	Very low	40.7	Very low	89 Å²	89	130.7 Å²	130.7	62%	0.622	69%	0.685	S	S	*	*	S	Bend	trans	-92.8	-29.1	-172.5	-41.7	0	0	0	0	114.8
471	T	42.3	Very low	40.9	Very low	88 Å²	88	135.3 Å²	135.3	54%	0.54	69%	0.687	S	S	.	*	H	α-helix	trans	-80.5	-26	-168.5	-32.3	0	0	0	0	112.9	Q473 F474 Y475	T471-Q473 VanDerWaalsContact C-N 3.28Å; T471-Q473 PolarHBondContact O-N 2.96Å; T471-F474 PolarHBondContact O-N 3.34Å; T471-Y475 HydrophobicContact CG2-CD2 4.15Å; T471-Y475 HydrophobicContact CG2-CE2 4.1Å; T471-Y475 PolarHBondContact O-N 2.94Å
472	I	43.2	Very low	41.4	Very low	119 Å²	119	139.7 Å²	139.7	61%	0.61	70%	0.695	S	S	*	*	H	α-helix	trans	-70	-25	-179.8	-58.2	176.7	0	0	0	111.5	N476	I472-N476 PolarHBondContact O-ND2 3.39Å
473	Q	45.6	Very low	42.1	Very low	155 Å²	155	139.4 Å²	139.4	72%	0.724	69%	0.693	S	S	*	*	H	α-helix	trans	-79.5	-28	177.1	-68.4	-173.3	-4.7	0	0	113.2	T471	T471-Q473 VanDerWaalsContact C-N 3.28Å; T471-Q473 PolarHBondContact O-N 2.96Å
474	F	41.9	Very low	43.3	Very low	153 Å²	153	146.8 Å²	146.8	67%	0.671	71%	0.708	S	S	*	*	H	α-helix	trans	-78.3	-37.7	178.3	-124.3	-90.4	0	0	0	112.3	T471 N476 K477 V478	T471-F474 PolarHBondContact O-N 3.34Å; F474-N476 VanDerWaalsContact C-N 3.27Å; F474-N476 PolarHBondContact O-N 3.22Å; F474-K477 PolarHBondContact O-N 3.38Å; F474-K477 VanDerWaalsContact O-N 3.11Å; F474-V478 PolarHBondContact O-N 3.16Å
475	Y	43.2	Very low	44.5	Very low	181 Å²	181	151.3 Å²	151.3	71%	0.71	71%	0.714	S	S	*	*	H	α-helix	trans	-67.8	-24.6	175.2	-88.3	-84.4	0	0	0	113.7	T471 S479	T471-Y475 HydrophobicContact CG2-CD2 4.15Å; T471-Y475 HydrophobicContact CG2-CE2 4.1Å; T471-Y475 PolarHBondContact O-N 2.94Å; Y475-S479 PolarHBondContact O-OG 3.05Å
476	N	44	Very low	46.1	Very low	99 Å²	99	153.1 Å²	153.1	53%	0.529	72%	0.719	S	S	.	*	H	α-helix	trans	-79.9	-16.3	172.6	-78	-48.5	0	0	0	113.8	I472 F474 S479	I472-N476 PolarHBondContact O-ND2 3.39Å; F474-N476 VanDerWaalsContact C-N 3.27Å; F474-N476 PolarHBondContact O-N 3.22Å; N476-S479 WeakPolarHBondContact CA-OG 3.35Å; N476-S479 PolarHBondContact O-OG 3Å
477	K	43.7	Very low	47.8	Very low	159 Å²	159	152.3 Å²	152.3	69%	0.691	72%	0.72	S	S	*	*	H	α-helix	trans	-91.8	-26.5	177.7	-135.7	175.6	-176.4	-178.5	0	113.1	F474	F474-K477 PolarHBondContact O-N 3.38Å; F474-K477 VanDerWaalsContact O-N 3.11Å
478	V	44.8	Very low	49.9	Very low	100 Å²	100	156.9 Å²	156.9	61%	0.606	73%	0.728	S	S	*	*	H	α-helix	trans	-83.7	-22.8	176.2	-178.3	0	0	0	0	112.4	F474 Q480	F474-V478 PolarHBondContact O-N 3.16Å; V478-Q480 VanDerWaalsContact C-N 3.34Å
479	S	41.9	Very low	52.1	Low	54 Å²	54	152.5 Å²	152.5	38%	0.378	71%	0.714	S	S	.	*	G	3₁₀ helix	trans	-79	-12.3	176	44.9	0	0	0	0	114.3	Y475 N476	Y475-S479 PolarHBondContact O-OG 3.05Å; N476-S479 WeakPolarHBondContact CA-OG 3.35Å; N476-S479 PolarHBondContact O-OG 3Å
480	Q	42.4	Very low	54.3	Low	166 Å²	166	153 Å²	153	78%	0.776	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-89.7	-0.3	176	-68.9	-174.2	0.2	0	0	114.6	V478	V478-Q480 VanDerWaalsContact C-N 3.34Å
481	Q	43.3	Very low	56.7	Low	171 Å²	171	151.2 Å²	151.2	80%	0.799	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-109.1	17.4	175.4	-73	-171.4	-18.1	0	0	114.3	K483	Q481-K483 VanDerWaalsContact C-N 3.34Å; Q481-K483 PolarHBondContact O-N 2.98Å
482	R	48.5	Very low	59.2	Low	208 Å²	208	149.7 Å²	149.7	79%	0.785	69%	0.691	S	S	*	*	S	Bend	trans	-70	94.4	165.6	-67	-175.5	-178.5	170.3	1.3	108.1	R484	R482-R484 PolarHBondContact O-N 3.16Å
483	K	52.9	Low	61.7	Low	203 Å²	203	150.2 Å²	150.2	88%	0.883	70%	0.695	S	S	*	*			trans	-39.1	104.8	172	-73.9	175	179.3	172	0	108.6	Q481 R485	Q481-K483 VanDerWaalsContact C-N 3.34Å; Q481-K483 PolarHBondContact O-N 2.98Å; K483-R485 PolarHBondContact O-N 2.92Å
484	R	58.5	Low	64.1	Low	242 Å²	242	147.1 Å²	147.1	91%	0.913	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-52.3	119.1	176.2	-74.7	-172	170	-170.9	-3.3	107	R482 K486	R482-R484 PolarHBondContact O-N 3.16Å; R484-K486 PolarHBondContact O-N 3.38Å; R484-K486 VanDerWaalsContact O-N 3.16Å
485	R	63.3	Low	66.7	Low	242 Å²	242	141.8 Å²	141.8	91%	0.913	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-53.5	124.8	172.9	-75.8	-179.2	168.4	174.2	-3.8	106.7	K483 T487	K483-R485 PolarHBondContact O-N 2.92Å; R485-T487 PolarHBondContact O-N 3.33Å; R485-T487 VanDerWaalsContact O-N 3.13Å
486	K	68.6	Low	69.3	Low	209 Å²	209	135.9 Å²	135.9	91%	0.909	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-58.7	119.9	177.9	-77.8	157.8	178.9	171.1	0	107.5	R484 R488	R484-K486 PolarHBondContact O-N 3.38Å; R484-K486 VanDerWaalsContact O-N 3.16Å; K486-R488 PolarHBondContact O-N 3.4Å
487	T	76.6	Confident	71.8	Confident	132 Å²	132	134.9 Å²	134.9	81%	0.81	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-54.4	129.5	176	-54.6	0	0	0	0	108.9	R485 T489	R485-T487 PolarHBondContact O-N 3.33Å; R485-T487 VanDerWaalsContact O-N 3.13Å; T487-T489 PolarHBondContact O-N 3Å
488	R	81.5	Confident	74.4	Confident	224 Å²	224	130.2 Å²	130.2	85%	0.845	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-62.1	124.1	175.6	-170.8	178.6	-173.5	-148	2.5	108.1	K486	K486-R488 PolarHBondContact O-N 3.4Å
489	T	79.2	Confident	76.9	Confident	94 Å²	94	125.4 Å²	125.4	58%	0.577	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-76.3	131.2	172.7	46.6	0	0	0	0	108.9	T487	T487-T489 PolarHBondContact O-N 3Å
490	T	90.3	Very high	79.6	Confident	126 Å²	126	125.5 Å²	125.5	77%	0.773	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-99.7	136.9	171.5	53.2	0	0	0	0	108.6
491	F	94.3	Very high	82.2	Confident	50 Å²	50	121.6 Å²	121.6	22%	0.219	57%	0.573	C	S	.	*	P	Polyproline II helix	trans	-79.1	142.5	171.6	-59.3	-61.3	0	0	0	109	Q495 L496 L523 Q527 W531	F491-Q495 HydrophobicContact CB-CB 4.24Å; F491-L496 HydrophobicContact CB-CD2 3.8Å; F491-L496 HydrophobicContact CB-CG 3.88Å; F491-L496 HydrophobicContact CD2-CD2 4.08Å; F491-L496 HydrophobicContact CG-CD2 4.36Å; F491-L523 HydrophobicContact CD1-CD1 3.96Å; F491-L523 HydrophobicContact CD1-CD2 3.82Å; F491-L523 HydrophobicContact CE1-CD1 3.82Å; F491-L523 HydrophobicContact CE1-CD2 3.74Å; F491-L523 HydrophobicContact CE1-CG 4.41Å; F491-Q527 HydrophobicContact CE1-CB 4.21Å; F491-Q527 HydrophobicContact CE1-CG 4.43Å; F491-Q527 HydrophobicContact CZ-CB 4.18Å; F491-Q527 HydrophobicContact CZ-CG 4.47Å; F491-W531 AromaticContact CD2-CD1 3.77Å; F491-W531 HydrophobicContact CE2-CB 4.32Å; F491-W531 AromaticContact CE2-CD1 3.58Å; F491-W531 HydrophobicContact CE2-CG 4.31Å
492	S	95.5	Very high	84.7	Confident	57 Å²	57	114.5 Å²	114.5	40%	0.399	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-66.5	157.6	171.5	65.4	0	0	0	0	111.3	C494 Q495 L496	S492-C494 PolarHBondContact O-N 3.05Å; S492-Q495 WeakPolarHBondContact O-CB 3.4Å; S492-Q495 PolarHBondContact O-N 3.48Å; S492-Q495 WeakPolarHBondContact OG-CB 3.43Å; S492-Q495 VanDerWaalsContact OG-CG 3.24Å; S492-Q495 WeakPolarHBondContact OG-CG 3.45Å; S492-Q495 PolarHBondContact OG-N 2.87Å; S492-Q495 PolarHBondContact OG-OE1 3.31Å; S492-Q495 VanDerWaalsContact OG-OE1 3.05Å; S492-L496 WeakPolarHBondContact O-CG 3.41Å; S492-L496 PolarHBondContact O-N 3.11Å
493	N	95.8	Very high	87.1	Confident	129 Å²	129	104.6 Å²	104.6	69%	0.69	50%	0.503	S	S	*	.	H	α-helix	trans	-57	-36.7	176.8	-72	-36.7	0	0	0	112.6	L496 N497	N493-L496 PolarHBondContact O-N 2.97Å; N493-N497 WeakPolarHBondContact O-CB 3.2Å; N493-N497 VanDerWaalsContact O-CG 3.29Å; N493-N497 PolarHBondContact O-N 3Å
494	C	96	Very high	89.1	Confident	90 Å²	90	99.2 Å²	99.2	61%	0.608	48%	0.483	S	S	*	.	H	α-helix	trans	-63.7	-44.7	175.1	-172.5	0	0	0	0	111.8	S492 N497 E498	S492-C494 PolarHBondContact O-N 3.05Å; C494-N497 PolarHBondContact O-N 3.29Å; C494-E498 PolarHBondContact O-N 3.04Å; C494-E498 VanDerWaalsContact O-N 3.12Å
495	Q	97.2	Very high	90.9	Very high	42 Å²	42	97.1 Å²	97.1	20%	0.196	48%	0.476	C	S	.	.	H	α-helix	trans	-63.6	-41.5	176.3	-72.9	167.2	-35.1	0	0	111.5	F491 S492 E498 L499 L521	F491-Q495 HydrophobicContact CB-CB 4.24Å; S492-Q495 WeakPolarHBondContact O-CB 3.4Å; S492-Q495 PolarHBondContact O-N 3.48Å; S492-Q495 WeakPolarHBondContact OG-CB 3.43Å; S492-Q495 VanDerWaalsContact OG-CG 3.24Å; S492-Q495 WeakPolarHBondContact OG-CG 3.45Å; S492-Q495 PolarHBondContact OG-N 2.87Å; S492-Q495 PolarHBondContact OG-OE1 3.31Å; S492-Q495 VanDerWaalsContact OG-OE1 3.05Å; Q495-E498 PolarHBondContact O-N 3.38Å; Q495-L499 WeakPolarHBondContact O-CB 3.43Å; Q495-L499 WeakPolarHBondContact O-CD1 3.4Å; Q495-L499 WeakPolarHBondContact O-CG 3.29Å; Q495-L499 PolarHBondContact O-N 3.16Å; Q495-L521 HydrophobicContact CG-CB 4.4Å; Q495-L521 PolarHBondContact NE2-O 3.26Å
496	L	97.2	Very high	92.4	Very high	56 Å²	56	88.7 Å²	88.7	29%	0.293	45%	0.447	S	S	.	.	H	α-helix	trans	-62.6	-47.5	177.4	-71.1	174.1	0	0	0	111.9	F491 S492 N493 E498 L499 E500	F491-L496 HydrophobicContact CB-CD2 3.8Å; F491-L496 HydrophobicContact CB-CG 3.88Å; F491-L496 HydrophobicContact CD2-CD2 4.08Å; F491-L496 HydrophobicContact CG-CD2 4.36Å; S492-L496 WeakPolarHBondContact O-CG 3.41Å; S492-L496 PolarHBondContact O-N 3.11Å; N493-L496 PolarHBondContact O-N 2.97Å; L496-E498 VanDerWaalsContact C-N 3.35Å; L496-E498 PolarHBondContact O-N 3.47Å; L496-L499 PolarHBondContact O-N 3.4Å; L496-E500 WeakPolarHBondContact O-CB 3.23Å; L496-E500 PolarHBondContact O-N 3.4Å
497	N	97.1	Very high	93.7	Very high	78 Å²	78	83 Å²	83	42%	0.417	42%	0.42	S	S	.	.	H	α-helix	trans	-59.7	-44.1	178.5	-73.9	-15	0	0	0	111.7	N493 C494 E500 N501	N493-N497 WeakPolarHBondContact O-CB 3.2Å; N493-N497 VanDerWaalsContact O-CG 3.29Å; N493-N497 PolarHBondContact O-N 3Å; C494-N497 PolarHBondContact O-N 3.29Å; N497-E500 PolarHBondContact O-N 3.44Å; N497-N501 WeakPolarHBondContact O-CB 3.23Å; N497-N501 PolarHBondContact O-N 3.35Å; N497-N501 PolarHBondContact O-ND2 3.42Å
498	E	97.2	Very high	94.7	Very high	61 Å²	61	84.5 Å²	84.5	29%	0.285	41%	0.411	S	S	.	.	H	α-helix	trans	-67.4	-39.8	177.7	-78.6	-59.5	133.8	0	0	113	C494 Q495 L496 E500 N501 N502 L521	C494-E498 PolarHBondContact O-N 3.04Å; C494-E498 VanDerWaalsContact O-N 3.12Å; Q495-E498 PolarHBondContact O-N 3.38Å; L496-E498 VanDerWaalsContact C-N 3.35Å; L496-E498 PolarHBondContact O-N 3.47Å; E498-E500 VanDerWaalsContact C-N 3.32Å; E498-E500 PolarHBondContact O-N 2.96Å; E498-N501 PolarHBondContact O-N 3.42Å; E498-N502 PolarHBondContact O-N 3.35Å; E498-N502 PolarHBondContact O-ND2 2.83Å; E498-L521 HydrophobicContact CB-CD1 4.03Å; E498-L521 HydrophobicContact CB-CD2 3.5Å; E498-L521 VanDerWaalsContact CB-CD2 3.5Å; E498-L521 HydrophobicContact CB-CG 4.37Å; E498-L521 HydrophobicContact CG-CD2 3.83Å
499	L	98.1	Very high	95.4	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-61.7	-42.4	174	-73.4	165.7	0	0	0	111.1	Q495 L496 N502 F503 I517 L521 L523 V528 W531 F532	Q495-L499 WeakPolarHBondContact O-CB 3.43Å; Q495-L499 WeakPolarHBondContact O-CD1 3.4Å; Q495-L499 WeakPolarHBondContact O-CG 3.29Å; Q495-L499 PolarHBondContact O-N 3.16Å; L496-L499 PolarHBondContact O-N 3.4Å; L499-N502 PolarHBondContact O-N 2.92Å; L499-F503 WeakPolarHBondContact O-CB 3.48Å; L499-F503 PolarHBondContact O-N 3.38Å; L499-I517 HydrophobicContact CD2-CG2 3.95Å; L499-L521 HydrophobicContact CD1-CD1 4.45Å; L499-L521 HydrophobicContact CD2-CD1 3.76Å; L499-L521 HydrophobicContact CG-CD1 3.63Å; L499-L523 HydrophobicContact CD1-CD1 3.99Å; L499-V528 HydrophobicContact CD2-CG1 4.44Å; L499-W531 HydrophobicContact CB-CD2 3.77Å; L499-W531 HydrophobicContact CB-CE3 3.82Å; L499-W531 HydrophobicContact CB-CH2 3.66Å; L499-W531 HydrophobicContact CB-CZ2 3.55Å; L499-W531 HydrophobicContact CB-CZ3 3.78Å; L499-W531 HydrophobicContact CD1-CB 4.45Å; L499-W531 HydrophobicContact CD1-CD2 3.85Å; L499-W531 HydrophobicContact CD1-CG 3.77Å; L499-W531 HydrophobicContact CD2-CD2 4.28Å; L499-W531 HydrophobicContact CD2-CE3 4.18Å; L499-W531 HydrophobicContact CG-CD2 4.18Å; L499-W531 HydrophobicContact CG-CE3 4.39Å; L499-W531 WeakPolarHBondContact O-CH2 3.47Å; L499-W531 WeakPolarHBondContact O-CZ3 3.46Å; L499-F532 HydrophobicContact CD2-CE2 4.09Å
500	E	97.9	Very high	96.2	Very high	55 Å²	55	73.9 Å²	73.9	26%	0.257	37%	0.37	S	S	.	.	H	α-helix	trans	-66.7	-42.8	177.2	-163.5	124.3	-134.3	0	0	112.1	L496 N497 E498 N502 F503 N504 W531 R535	L496-E500 WeakPolarHBondContact O-CB 3.23Å; L496-E500 PolarHBondContact O-N 3.4Å; N497-E500 PolarHBondContact O-N 3.44Å; E498-E500 VanDerWaalsContact C-N 3.32Å; E498-E500 PolarHBondContact O-N 2.96Å; E500-N502 PolarHBondContact O-N 3.16Å; E500-F503 WeakPolarHBondContact O-CB 3.34Å; E500-F503 PolarHBondContact O-N 3.12Å; E500-N504 WeakPolarHBondContact O-CB 3.49Å; E500-N504 VanDerWaalsContact O-CG 3.27Å; E500-N504 PolarHBondContact O-N 3.04Å; E500-N504 PolarHBondContact O-ND2 3.48Å; E500-W531 HydrophobicContact CB-CH2 4.38Å; E500-R535 IonicContact OE1-CZ 3.13Å; E500-R535 IonicContact OE1-NE 3.94Å; E500-R535 PolarHBondContact OE1-NE 2.82Å; E500-R535 IonicContact OE1-NH2 2.85Å; E500-R535 PolarHBondContact OE1-NH2 3.11Å
501	N	97.1	Very high	96.5	Very high	85 Å²	85	72 Å²	72	46%	0.455	36%	0.359	S	S	.	.	H	α-helix	trans	-58.6	-46.6	173.5	-75.3	-14.2	0	0	0	111.7	N497 E498 N504 R505	N497-N501 WeakPolarHBondContact O-CB 3.23Å; N497-N501 PolarHBondContact O-N 3.35Å; N497-N501 PolarHBondContact O-ND2 3.42Å; E498-N501 PolarHBondContact O-N 3.42Å; N501-N504 PolarHBondContact O-N 3.29Å; N501-R505 WeakPolarHBondContact O-CG 3.29Å; N501-R505 PolarHBondContact O-N 2.95Å
502	N	96.4	Very high	96.6	Very high	22 Å²	22	74.8 Å²	74.8	12%	0.118	38%	0.381	C	S	.	.	H	α-helix	trans	-66.5	-38	176.9	-79.1	-86.5	0	0	0	111.9	E498 L499 E500 R505 Q506 I517 F532	E498-N502 PolarHBondContact O-N 3.35Å; E498-N502 PolarHBondContact O-ND2 2.83Å; L499-N502 PolarHBondContact O-N 2.92Å; E500-N502 PolarHBondContact O-N 3.16Å; N502-R505 PolarHBondContact O-N 3.34Å; N502-Q506 PolarHBondContact O-N 3.31Å; N502-I517 HydrophobicContact CB-CD1 3.77Å; N502-I517 HydrophobicContact CB-CG1 4.5Å; N502-F532 HydrophobicContact CB-CZ 4.2Å
503	F	97.8	Very high	96.6	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-64	-41.7	176.8	-175.5	-102.9	0	0	0	113.1	L499 E500 R505 Q506 R507 W531 F532 R535 R536 L539	L499-F503 WeakPolarHBondContact O-CB 3.48Å; L499-F503 PolarHBondContact O-N 3.38Å; E500-F503 WeakPolarHBondContact O-CB 3.34Å; E500-F503 PolarHBondContact O-N 3.12Å; F503-R505 PolarHBondContact O-N 3.4Å; F503-Q506 CarbonylContact O-C 3.6Å; F503-Q506 PolarHBondContact O-N 3.24Å; F503-R507 HydrophobicContact CE2-CB 4.26Å; F503-R507 HydrophobicContact CZ-CB 4.48Å; F503-R507 HydrophobicContact CZ-CG 4.48Å; F503-R507 VanDerWaalsContact O-CD 3.31Å; F503-R507 WeakPolarHBondContact O-CD 3.5Å; F503-R507 PolarHBondContact O-N 3.39Å; F503-R507 PolarHBondContact O-NE 2.99Å; F503-W531 HydrophobicContact CB-CH2 3.99Å; F503-W531 HydrophobicContact CB-CZ3 3.84Å; F503-W531 HydrophobicContact CD2-CZ3 4.26Å; F503-W531 HydrophobicContact CG-CH2 4.44Å; F503-W531 HydrophobicContact CG-CZ3 4.22Å; F503-F532 HydrophobicContact CB-CE1 4.14Å; F503-F532 HydrophobicContact CB-CZ 4.28Å; F503-F532 AromaticContact CD2-CD1 3.73Å; F503-F532 HydrophobicContact CD2-CD1 3.73Å; F503-F532 AromaticContact CD2-CE1 3.81Å; F503-F532 HydrophobicContact CD2-CE1 3.81Å; F503-F532 HydrophobicContact CE2-CD1 4.41Å; F503-F532 HydrophobicContact CG-CE1 4.48Å; F503-R535 HydrophobicContact CD1-CG 3.52Å; F503-R535 HydrophobicContact CD2-CB 4.18Å; F503-R535 HydrophobicContact CD2-CG 3.79Å; F503-R535 HydrophobicContact CE1-CB 4.49Å; F503-R535 HydrophobicContact CE1-CG 3.4Å; F503-R535 HydrophobicContact CE2-CB 3.99Å; F503-R535 HydrophobicContact CE2-CG 3.71Å; F503-R535 HydrophobicContact CG-CG 3.71Å; F503-R535 HydrophobicContact CZ-CB 4.15Å; F503-R535 HydrophobicContact CZ-CG 3.51Å; F503-R536 HydrophobicContact CE2-CG 3.73Å; F503-R536 HydrophobicContact CZ-CG 4.02Å; F503-L539 HydrophobicContact CZ-CD2 4.42Å
504	N	96.2	Very high	96.7	Very high	89 Å²	89	70.3 Å²	70.3	48%	0.476	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-33.2	177.5	-72	-22.1	0	0	0	111.6	E500 N501	E500-N504 WeakPolarHBondContact O-CB 3.49Å; E500-N504 VanDerWaalsContact O-CG 3.27Å; E500-N504 PolarHBondContact O-N 3.04Å; E500-N504 PolarHBondContact O-ND2 3.48Å; N501-N504 PolarHBondContact O-N 3.29Å
505	R	95.8	Very high	96.8	Very high	198 Å²	198	68.8 Å²	68.8	75%	0.747	33%	0.333	S	S	*	.	H	α-helix	trans	-73.1	-40.7	172.5	-66.1	174.8	68.1	-165.2	2.1	112.5	N501 N502 F503	N501-R505 WeakPolarHBondContact O-CG 3.29Å; N501-R505 PolarHBondContact O-N 2.95Å; N502-R505 PolarHBondContact O-N 3.34Å; F503-R505 PolarHBondContact O-N 3.4Å
506	Q	95.3	Very high	96.8	Very high	66 Å²	66	73 Å²	73	31%	0.308	35%	0.347	S	S	.	.			trans	-151.5	112.6	-174.5	-178.4	175.7	2.3	0	0	111.4	N502 F503 Y508 D513 F532	N502-Q506 PolarHBondContact O-N 3.31Å; F503-Q506 CarbonylContact O-C 3.6Å; F503-Q506 PolarHBondContact O-N 3.24Å; Q506-Y508 VanDerWaalsContact C-N 3.29Å; Q506-Y508 VanDerWaalsContact CD-O 3.24Å; Q506-Y508 WeakPolarHBondContact CG-O 3.35Å; Q506-Y508 PolarHBondContact NE2-O 3.41Å; Q506-Y508 PolarHBondContact O-N 3.18Å; Q506-D513 PolarHBondContact OE1-OD2 3.42Å; Q506-F532 WeakPolarHBondContact O-CE1 3.48Å
507	R	95.5	Very high	96.8	Very high	90 Å²	90	70.5 Å²	70.5	34%	0.34	33%	0.334	S	S	.	.	S	Bend	trans	-73.1	-19.4	-176	-56.2	-69.1	173.7	129.4	-1.8	114.1	F503 R536 L539	F503-R507 HydrophobicContact CE2-CB 4.26Å; F503-R507 HydrophobicContact CZ-CB 4.48Å; F503-R507 HydrophobicContact CZ-CG 4.48Å; F503-R507 VanDerWaalsContact O-CD 3.31Å; F503-R507 WeakPolarHBondContact O-CD 3.5Å; F503-R507 PolarHBondContact O-N 3.39Å; F503-R507 PolarHBondContact O-NE 2.99Å; R507-R536 PolarHBondContact O-NH1 3.27Å; R507-R536 VanDerWaalsContact O-NH1 3.07Å; R507-L539 VanDerWaalsContact NH1-CD1 3.25Å
508	Y	97.3	Very high	96.8	Very high	162 Å²	162	67 Å²	67	64%	0.635	32%	0.317	S	S	*	.	S	Bend	trans	-130.4	112.8	-179.5	-66.3	-93.7	0	0	0	110	Q506	Q506-Y508 VanDerWaalsContact C-N 3.29Å; Q506-Y508 VanDerWaalsContact CD-O 3.24Å; Q506-Y508 WeakPolarHBondContact CG-O 3.35Å; Q506-Y508 PolarHBondContact NE2-O 3.41Å; Q506-Y508 PolarHBondContact O-N 3.18Å
509	L	95.3	Very high	96.8	Very high	40 Å²	40	72.8 Å²	72.8	21%	0.209	34%	0.341	C	S	.	.			trans	-72	139	-177.9	-67	174.6	0	0	0	112.4	D513 R514 I517 V528 F532	L509-D513 HydrophobicContact CD2-CB 4.03Å; L509-R514 HydrophobicContact CB-CB 4.37Å; L509-R514 HydrophobicContact CD1-CB 4.29Å; L509-I517 HydrophobicContact CD1-CD1 4.2Å; L509-I517 HydrophobicContact CD2-CD1 3.41Å; L509-I517 VanDerWaalsContact CD2-CD1 3.41Å; L509-I517 HydrophobicContact CG-CD1 4.45Å; L509-V528 HydrophobicContact CD1-CG1 3.4Å; L509-V528 VanDerWaalsContact CD1-CG1 3.4Å; L509-F532 HydrophobicContact CD1-CD1 3.95Å; L509-F532 HydrophobicContact CD1-CD2 3.48Å; L509-F532 VanDerWaalsContact CD1-CD2 3.48Å; L509-F532 HydrophobicContact CD1-CE1 3.94Å; L509-F532 HydrophobicContact CD1-CE2 3.5Å; L509-F532 VanDerWaalsContact CD1-CE2 3.5Å; L509-F532 HydrophobicContact CD1-CG 3.73Å; L509-F532 HydrophobicContact CD1-CZ 3.73Å; L509-F532 HydrophobicContact CD2-CD1 4.29Å; L509-F532 HydrophobicContact CD2-CE1 3.6Å; L509-F532 HydrophobicContact CD2-CE2 4.17Å; L509-F532 HydrophobicContact CD2-CZ 3.54Å; L509-F532 HydrophobicContact CG-CD1 3.65Å; L509-F532 HydrophobicContact CG-CD2 4.11Å; L509-F532 HydrophobicContact CG-CE1 3.48Å; L509-F532 VanDerWaalsContact CG-CE1 3.48Å; L509-F532 HydrophobicContact CG-CE2 3.99Å; L509-F532 HydrophobicContact CG-CG 3.97Å; L509-F532 HydrophobicContact CG-CZ 3.68Å
510	T	96.3	Very high	96.7	Very high	55 Å²	55	79.2 Å²	79.2	34%	0.337	37%	0.371	S	S	.	.			trans	-74	159.8	161.3	72.4	0	0	0	0	110.3	T512 D513 R514	T510-T512 PolarHBondContact O-N 3.28Å; T510-D513 PolarHBondContact O-N 2.96Å; T510-D513 VanDerWaalsContact OG1-CG 3.3Å; T510-D513 PolarHBondContact OG1-N 3.2Å; T510-D513 VanDerWaalsContact OG1-N 3.1Å; T510-D513 PolarHBondContact OG1-OD2 3.04Å; T510-R514 WeakPolarHBondContact O-CB 3.49Å; T510-R514 PolarHBondContact O-N 3.4Å
511	P	96.4	Very high	96.7	Very high	86 Å²	86	77.4 Å²	77.4	56%	0.558	36%	0.363	S	S	*	.	H	α-helix	trans	-53.2	-40.9	173.9	-27.5	35.7	0	0	0	113.1	R514 D515	P511-R514 PolarHBondContact O-N 3.35Å; P511-D515 VanDerWaalsContact O-CG 3.31Å; P511-D515 PolarHBondContact O-N 3.15Å; P511-D515 VanDerWaalsContact O-N 3.13Å
512	T	96.5	Very high	96.6	Very high	110 Å²	110	76.6 Å²	76.6	68%	0.675	37%	0.374	S	S	*	.	H	α-helix	trans	-66.5	-44.7	178.7	-49.7	0	0	0	0	112.2	T510 D515 R516	T510-T512 PolarHBondContact O-N 3.28Å; T512-D515 PolarHBondContact O-N 3.21Å; T512-R516 PolarHBondContact O-N 3.42Å
513	D	96.2	Very high	96.6	Very high	25 Å²	25	76.4 Å²	76.4	13%	0.134	37%	0.373	C	S	.	.	H	α-helix	trans	-66.8	-38.8	178.6	-69.4	-57.8	0	0	0	111.6	Q506 L509 T510 D515 R516 I517	Q506-D513 PolarHBondContact OE1-OD2 3.42Å; L509-D513 HydrophobicContact CD2-CB 4.03Å; T510-D513 PolarHBondContact O-N 2.96Å; T510-D513 VanDerWaalsContact OG1-CG 3.3Å; T510-D513 PolarHBondContact OG1-N 3.2Å; T510-D513 VanDerWaalsContact OG1-N 3.1Å; T510-D513 PolarHBondContact OG1-OD2 3.04Å; D513-D515 PolarHBondContact O-N 3.32Å; D513-R516 PolarHBondContact O-N 3.1Å; D513-R516 IonicContact OD1-CZ 2.76Å; D513-R516 VanDerWaalsContact OD1-CZ 3.31Å; D513-R516 IonicContact OD1-NH1 2.6Å; D513-R516 PolarHBondContact OD1-NH1 2.95Å; D513-R516 IonicContact OD1-NH2 3.42Å; D513-R516 PolarHBondContact OD1-NH2 3.15Å; D513-I517 WeakPolarHBondContact O-CB 3.43Å; D513-I517 VanDerWaalsContact O-CG1 3.27Å; D513-I517 WeakPolarHBondContact O-CG1 3.45Å; D513-I517 PolarHBondContact O-N 2.81Å
514	R	97.6	Very high	96.6	Very high	66 Å²	66	80 Å²	80	25%	0.249	40%	0.395	C	S	.	.	H	α-helix	trans	-56.2	-50.9	174.3	-179.4	-161.7	65.3	-157.7	-5	110.8	L509 T510 P511 R516 I517 A518 N525 V528 I529	L509-R514 HydrophobicContact CB-CB 4.37Å; L509-R514 HydrophobicContact CD1-CB 4.29Å; T510-R514 WeakPolarHBondContact O-CB 3.49Å; T510-R514 PolarHBondContact O-N 3.4Å; P511-R514 PolarHBondContact O-N 3.35Å; R514-R516 VanDerWaalsContact C-N 3.3Å; R514-R516 PolarHBondContact O-N 3.15Å; R514-I517 PolarHBondContact O-N 3.36Å; R514-A518 VanDerWaalsContact O-CB 3.24Å; R514-A518 WeakPolarHBondContact O-CB 3.49Å; R514-A518 PolarHBondContact O-N 3.37Å; R514-N525 HydrophobicContact CG-CB 4.39Å; R514-N525 PolarHBondContact NE-OD1 2.98Å; R514-V528 HydrophobicContact CG-CG1 4.45Å; R514-I529 HydrophobicContact CG-CG1 4.28Å
515	D	97.5	Very high	96.6	Very high	58 Å²	58	78.5 Å²	78.5	31%	0.31	39%	0.387	S	S	.	.	H	α-helix	trans	-66.2	-34.5	-178.2	-65.9	-10.2	0	0	0	111.6	P511 T512 D513 K519 N525	P511-D515 VanDerWaalsContact O-CG 3.31Å; P511-D515 PolarHBondContact O-N 3.15Å; P511-D515 VanDerWaalsContact O-N 3.13Å; T512-D515 PolarHBondContact O-N 3.21Å; D513-D515 PolarHBondContact O-N 3.32Å; D515-K519 WeakPolarHBondContact O-CB 3.37Å; D515-K519 WeakPolarHBondContact O-CG 3.35Å; D515-K519 PolarHBondContact O-N 3Å; D515-K519 VanDerWaalsContact O-N 3.14Å; D515-N525 VanDerWaalsContact OD1-CG 3.32Å; D515-N525 PolarHBondContact OD1-ND2 3.4Å; D515-N525 PolarHBondContact OD1-OD1 3.5Å; D515-N525 VanDerWaalsContact OD1-OD1 3.12Å
516	R	97.5	Very high	96.6	Very high	130 Å²	130	73.8 Å²	73.8	49%	0.491	38%	0.38	S	S	.	.	H	α-helix	trans	-64	-50.3	174	-174.8	-176.5	70.2	-147.8	-12.3	111.7	T512 D513 R514 K519 H520	T512-R516 PolarHBondContact O-N 3.42Å; D513-R516 PolarHBondContact O-N 3.1Å; D513-R516 IonicContact OD1-CZ 2.76Å; D513-R516 VanDerWaalsContact OD1-CZ 3.31Å; D513-R516 IonicContact OD1-NH1 2.6Å; D513-R516 PolarHBondContact OD1-NH1 2.95Å; D513-R516 IonicContact OD1-NH2 3.42Å; D513-R516 PolarHBondContact OD1-NH2 3.15Å; R514-R516 VanDerWaalsContact C-N 3.3Å; R514-R516 PolarHBondContact O-N 3.15Å; R516-K519 PolarHBondContact O-N 3.49Å; R516-H520 VanDerWaalsContact O-CB 3.3Å; R516-H520 WeakPolarHBondContact O-CB 3.45Å; R516-H520 PolarHBondContact O-N 3.33Å
517	I	97.2	Very high	96.7	Very high	4 Å²	4	73 Å²	73	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-64.9	-43.6	-178.5	-66.8	166.2	0	0	0	110.4	L499 N502 L509 D513 R514 K519 H520 L521 V528 F532	L499-I517 HydrophobicContact CD2-CG2 3.95Å; N502-I517 HydrophobicContact CB-CD1 3.77Å; N502-I517 HydrophobicContact CB-CG1 4.5Å; L509-I517 HydrophobicContact CD1-CD1 4.2Å; L509-I517 HydrophobicContact CD2-CD1 3.41Å; L509-I517 VanDerWaalsContact CD2-CD1 3.41Å; L509-I517 HydrophobicContact CG-CD1 4.45Å; D513-I517 WeakPolarHBondContact O-CB 3.43Å; D513-I517 VanDerWaalsContact O-CG1 3.27Å; D513-I517 WeakPolarHBondContact O-CG1 3.45Å; D513-I517 PolarHBondContact O-N 2.81Å; R514-I517 PolarHBondContact O-N 3.36Å; I517-K519 PolarHBondContact O-N 2.95Å; I517-H520 PolarHBondContact O-N 3Å; I517-L521 HydrophobicContact CG2-CD1 3.73Å; I517-L521 HydrophobicContact CG2-CG 4.28Å; I517-L521 WeakPolarHBondContact O-CB 3.44Å; I517-L521 WeakPolarHBondContact O-CG 3.45Å; I517-L521 PolarHBondContact O-N 2.93Å; I517-V528 HydrophobicContact CB-CG1 4.42Å; I517-V528 HydrophobicContact CG2-CG1 4.01Å; I517-V528 HydrophobicContact CG2-CG2 4.18Å; I517-F532 HydrophobicContact CD1-CZ 4.36Å
518	A	97.7	Very high	96.8	Very high	6 Å²	6	68.8 Å²	68.8	5%	0.05	36%	0.361	C	S	.	.	H	α-helix	trans	-56.2	-50.2	177	0	0	0	0	0	111.6	R514 G522 L523 N525 V528	R514-A518 VanDerWaalsContact O-CB 3.24Å; R514-A518 WeakPolarHBondContact O-CB 3.49Å; R514-A518 PolarHBondContact O-N 3.37Å; A518-G522 PolarHBondContact O-N 2.97Å; A518-G522 VanDerWaalsContact O-N 3.11Å; A518-L523 CarbonylContact C-O 3.56Å; A518-L523 WeakPolarHBondContact CA-O 3.47Å; A518-L523 VanDerWaalsContact CB-O 3.32Å; A518-L523 WeakPolarHBondContact CB-O 3.43Å; A518-L523 PolarHBondContact O-N 3.31Å; A518-L523 VanDerWaalsContact O-O 3.08Å; A518-N525 VanDerWaalsContact CB-OD1 3.27Å; A518-N525 WeakPolarHBondContact CB-OD1 2.85Å; A518-V528 HydrophobicContact CB-CG2 4.09Å
519	K	97.2	Very high	96.8	Very high	181 Å²	181	64 Å²	64	79%	0.787	35%	0.346	S	S	*	.	H	α-helix	trans	-63.6	-43.6	176.6	-72.6	175.9	-177.7	178	0	112.5	D515 R516 I517	D515-K519 WeakPolarHBondContact O-CB 3.37Å; D515-K519 WeakPolarHBondContact O-CG 3.35Å; D515-K519 PolarHBondContact O-N 3Å; D515-K519 VanDerWaalsContact O-N 3.14Å; R516-K519 PolarHBondContact O-N 3.49Å; I517-K519 PolarHBondContact O-N 2.95Å
520	H	96.7	Very high	96.8	Very high	136 Å²	136	64.9 Å²	64.9	63%	0.63	35%	0.353	S	S	*	.	H	α-helix	trans	-65.3	-39.8	-176.8	-175.5	63.5	0	0	0	112.6	R516 I517	R516-H520 VanDerWaalsContact O-CB 3.3Å; R516-H520 WeakPolarHBondContact O-CB 3.45Å; R516-H520 PolarHBondContact O-N 3.33Å; I517-H520 PolarHBondContact O-N 3Å
521	L	96.3	Very high	96.9	Very high	17 Å²	17	63.6 Å²	63.6	9%	0.089	34%	0.342	C	S	.	.	H	α-helix	trans	-93.9	-1.7	-176.5	-59.2	-176.4	0	0	0	114.2	Q495 E498 L499 I517 L523	Q495-L521 HydrophobicContact CG-CB 4.4Å; Q495-L521 PolarHBondContact NE2-O 3.26Å; E498-L521 HydrophobicContact CB-CD1 4.03Å; E498-L521 HydrophobicContact CB-CD2 3.5Å; E498-L521 VanDerWaalsContact CB-CD2 3.5Å; E498-L521 HydrophobicContact CB-CG 4.37Å; E498-L521 HydrophobicContact CG-CD2 3.83Å; L499-L521 HydrophobicContact CD1-CD1 4.45Å; L499-L521 HydrophobicContact CD2-CD1 3.76Å; L499-L521 HydrophobicContact CG-CD1 3.63Å; I517-L521 HydrophobicContact CG2-CD1 3.73Å; I517-L521 HydrophobicContact CG2-CG 4.28Å; I517-L521 WeakPolarHBondContact O-CB 3.44Å; I517-L521 WeakPolarHBondContact O-CG 3.45Å; I517-L521 PolarHBondContact O-N 2.93Å; L521-L523 VanDerWaalsContact C-N 3.28Å; L521-L523 HydrophobicContact CB-CD1 4.01Å; L521-L523 HydrophobicContact CB-CG 3.9Å; L521-L523 HydrophobicContact CD1-CD1 4.29Å; L521-L523 PolarHBondContact O-N 2.96Å
522	G	96.5	Very high	97	Very high	67 Å²	67	59.7 Å²	59.7	69%	0.691	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	32.5	-174.1	0	0	0	0	0	112.9	A518	A518-G522 PolarHBondContact O-N 2.97Å; A518-G522 VanDerWaalsContact O-N 3.11Å
523	L	96.3	Very high	97	Very high	19 Å²	19	59.1 Å²	59.1	10%	0.099	31%	0.306	C	S	.	.			trans	-108.6	156.8	-179.3	-61.5	-178.1	0	0	0	110.9	F491 L499 A518 L521 Q527 V528	F491-L523 HydrophobicContact CD1-CD1 3.96Å; F491-L523 HydrophobicContact CD1-CD2 3.82Å; F491-L523 HydrophobicContact CE1-CD1 3.82Å; F491-L523 HydrophobicContact CE1-CD2 3.74Å; F491-L523 HydrophobicContact CE1-CG 4.41Å; L499-L523 HydrophobicContact CD1-CD1 3.99Å; A518-L523 CarbonylContact C-O 3.56Å; A518-L523 WeakPolarHBondContact CA-O 3.47Å; A518-L523 VanDerWaalsContact CB-O 3.32Å; A518-L523 WeakPolarHBondContact CB-O 3.43Å; A518-L523 PolarHBondContact O-N 3.31Å; A518-L523 VanDerWaalsContact O-O 3.08Å; L521-L523 VanDerWaalsContact C-N 3.28Å; L521-L523 HydrophobicContact CB-CD1 4.01Å; L521-L523 HydrophobicContact CB-CG 3.9Å; L521-L523 HydrophobicContact CD1-CD1 4.29Å; L521-L523 PolarHBondContact O-N 2.96Å; L523-Q527 HydrophobicContact CB-CB 4.41Å; L523-V528 HydrophobicContact CB-CG2 4.02Å; L523-V528 HydrophobicContact CD1-CG2 4.42Å
524	T	96.7	Very high	97.1	Very high	76 Å²	76	62.6 Å²	62.6	47%	0.466	32%	0.324	S	S	.	.			trans	-76.5	151.6	171.1	61.2	0	0	0	0	111.2	T526 Q527 V528	T524-T526 PolarHBondContact O-N 3.07Å; T524-Q527 WeakPolarHBondContact O-CB 3.46Å; T524-Q527 PolarHBondContact O-N 2.92Å; T524-Q527 WeakPolarHBondContact OG1-CB 3.36Å; T524-Q527 WeakPolarHBondContact OG1-CG 3.48Å; T524-Q527 PolarHBondContact OG1-N 3.34Å; T524-Q527 PolarHBondContact OG1-OE1 3.44Å; T524-V528 PolarHBondContact O-N 3.05Å; T524-V528 VanDerWaalsContact O-N 3.08Å
525	N	97.2	Very high	97.1	Very high	57 Å²	57	60.7 Å²	60.7	31%	0.305	32%	0.317	S	S	.	.	H	α-helix	trans	-52.2	-39.6	173.7	-83	-22.1	0	0	0	112.4	R514 D515 A518 V528 I529	R514-N525 HydrophobicContact CG-CB 4.39Å; R514-N525 PolarHBondContact NE-OD1 2.98Å; D515-N525 VanDerWaalsContact OD1-CG 3.32Å; D515-N525 PolarHBondContact OD1-ND2 3.4Å; D515-N525 PolarHBondContact OD1-OD1 3.5Å; D515-N525 VanDerWaalsContact OD1-OD1 3.12Å; A518-N525 VanDerWaalsContact CB-OD1 3.27Å; A518-N525 WeakPolarHBondContact CB-OD1 2.85Å; N525-V528 PolarHBondContact O-N 2.82Å; N525-I529 VanDerWaalsContact O-CG1 3.25Å; N525-I529 WeakPolarHBondContact O-CG1 2.92Å; N525-I529 PolarHBondContact O-N 3.47Å
526	T	96.4	Very high	97.1	Very high	98 Å²	98	60.9 Å²	60.9	60%	0.601	31%	0.313	S	S	*	.	H	α-helix	trans	-63.3	-44.8	175.9	-50.6	0	0	0	0	111.9	T524 V528 I529 T530	T524-T526 PolarHBondContact O-N 3.07Å; T526-V528 VanDerWaalsContact C-N 3.33Å; T526-V528 PolarHBondContact O-N 3.09Å; T526-I529 PolarHBondContact O-N 2.71Å; T526-T530 WeakPolarHBondContact O-CB 3.36Å; T526-T530 PolarHBondContact O-N 3.36Å; T526-T530 PolarHBondContact O-OG1 3.37Å
527	Q	96.5	Very high	97.1	Very high	51 Å²	51	57 Å²	57	24%	0.238	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-42.2	177.2	-78.2	167.1	-48.8	0	0	112.2	F491 L523 T524 T530 W531	F491-Q527 HydrophobicContact CE1-CB 4.21Å; F491-Q527 HydrophobicContact CE1-CG 4.43Å; F491-Q527 HydrophobicContact CZ-CB 4.18Å; F491-Q527 HydrophobicContact CZ-CG 4.47Å; L523-Q527 HydrophobicContact CB-CB 4.41Å; T524-Q527 WeakPolarHBondContact O-CB 3.46Å; T524-Q527 PolarHBondContact O-N 2.92Å; T524-Q527 WeakPolarHBondContact OG1-CB 3.36Å; T524-Q527 WeakPolarHBondContact OG1-CG 3.48Å; T524-Q527 PolarHBondContact OG1-N 3.34Å; T524-Q527 PolarHBondContact OG1-OE1 3.44Å; Q527-T530 PolarHBondContact O-N 3.1Å; Q527-W531 VanDerWaalsContact O-CB 3.31Å; Q527-W531 WeakPolarHBondContact O-CB 3.48Å; Q527-W531 PolarHBondContact O-N 3.04Å
528	V	97.4	Very high	97	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.9	-46.1	176.7	179.6	0	0	0	0	110.4	L499 L509 R514 I517 A518 L523 T524 N525 T526 T530 W531 F532	L499-V528 HydrophobicContact CD2-CG1 4.44Å; L509-V528 HydrophobicContact CD1-CG1 3.4Å; L509-V528 VanDerWaalsContact CD1-CG1 3.4Å; R514-V528 HydrophobicContact CG-CG1 4.45Å; I517-V528 HydrophobicContact CB-CG1 4.42Å; I517-V528 HydrophobicContact CG2-CG1 4.01Å; I517-V528 HydrophobicContact CG2-CG2 4.18Å; A518-V528 HydrophobicContact CB-CG2 4.09Å; L523-V528 HydrophobicContact CB-CG2 4.02Å; L523-V528 HydrophobicContact CD1-CG2 4.42Å; T524-V528 PolarHBondContact O-N 3.05Å; T524-V528 VanDerWaalsContact O-N 3.08Å; N525-V528 PolarHBondContact O-N 2.82Å; T526-V528 VanDerWaalsContact C-N 3.33Å; T526-V528 PolarHBondContact O-N 3.09Å; V528-T530 PolarHBondContact O-N 2.95Å; V528-W531 PolarHBondContact O-N 3.14Å; V528-F532 HydrophobicContact CG1-CD2 3.95Å; V528-F532 HydrophobicContact CG1-CE2 4.05Å; V528-F532 VanDerWaalsContact O-CD2 3.32Å; V528-F532 WeakPolarHBondContact O-CD2 3.49Å; V528-F532 PolarHBondContact O-N 3.23Å
529	I	96.9	Very high	97	Very high	63 Å²	63	62.1 Å²	62.1	32%	0.323	33%	0.333	S	S	.	.	H	α-helix	trans	-58.5	-49.5	176.5	-70.3	165.1	0	0	0	111	R514 N525 T526 W531 F532 Q533	R514-I529 HydrophobicContact CG-CG1 4.28Å; N525-I529 VanDerWaalsContact O-CG1 3.25Å; N525-I529 WeakPolarHBondContact O-CG1 2.92Å; N525-I529 PolarHBondContact O-N 3.47Å; T526-I529 PolarHBondContact O-N 2.71Å; I529-W531 VanDerWaalsContact C-N 3.34Å; I529-W531 PolarHBondContact O-N 2.91Å; I529-F532 PolarHBondContact O-N 2.94Å; I529-Q533 HydrophobicContact CG2-CG 4.41Å; I529-Q533 WeakPolarHBondContact O-CG 3.44Å; I529-Q533 PolarHBondContact O-N 3.38Å
530	T	96.5	Very high	96.9	Very high	58 Å²	58	60.1 Å²	60.1	36%	0.356	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-40.9	180	-60.9	0	0	0	0	111.4	T526 Q527 V528 Q533 N534	T526-T530 WeakPolarHBondContact O-CB 3.36Å; T526-T530 PolarHBondContact O-N 3.36Å; T526-T530 PolarHBondContact O-OG1 3.37Å; Q527-T530 PolarHBondContact O-N 3.1Å; V528-T530 PolarHBondContact O-N 2.95Å; T530-Q533 PolarHBondContact O-N 3.28Å; T530-N534 WeakPolarHBondContact O-CB 3.47Å; T530-N534 PolarHBondContact O-N 3.49Å; T530-N534 PolarHBondContact O-ND2 3.28Å
531	W	97.7	Very high	96.8	Very high	28 Å²	28	59.8 Å²	59.8	11%	0.106	32%	0.317	C	S	.	.	H	α-helix	trans	-63.4	-45.2	176.2	-173.2	99.1	0	0	0	111.2	F491 L499 E500 F503 Q527 V528 I529 Q533 N534 R535	F491-W531 AromaticContact CD2-CD1 3.77Å; F491-W531 HydrophobicContact CE2-CB 4.32Å; F491-W531 AromaticContact CE2-CD1 3.58Å; F491-W531 HydrophobicContact CE2-CG 4.31Å; L499-W531 HydrophobicContact CB-CD2 3.77Å; L499-W531 HydrophobicContact CB-CE3 3.82Å; L499-W531 HydrophobicContact CB-CH2 3.66Å; L499-W531 HydrophobicContact CB-CZ2 3.55Å; L499-W531 HydrophobicContact CB-CZ3 3.78Å; L499-W531 HydrophobicContact CD1-CB 4.45Å; L499-W531 HydrophobicContact CD1-CD2 3.85Å; L499-W531 HydrophobicContact CD1-CG 3.77Å; L499-W531 HydrophobicContact CD2-CD2 4.28Å; L499-W531 HydrophobicContact CD2-CE3 4.18Å; L499-W531 HydrophobicContact CG-CD2 4.18Å; L499-W531 HydrophobicContact CG-CE3 4.39Å; L499-W531 WeakPolarHBondContact O-CH2 3.47Å; L499-W531 WeakPolarHBondContact O-CZ3 3.46Å; E500-W531 HydrophobicContact CB-CH2 4.38Å; F503-W531 HydrophobicContact CB-CH2 3.99Å; F503-W531 HydrophobicContact CB-CZ3 3.84Å; F503-W531 HydrophobicContact CD2-CZ3 4.26Å; F503-W531 HydrophobicContact CG-CH2 4.44Å; F503-W531 HydrophobicContact CG-CZ3 4.22Å; Q527-W531 VanDerWaalsContact O-CB 3.31Å; Q527-W531 WeakPolarHBondContact O-CB 3.48Å; Q527-W531 PolarHBondContact O-N 3.04Å; V528-W531 PolarHBondContact O-N 3.14Å; I529-W531 VanDerWaalsContact C-N 3.34Å; I529-W531 PolarHBondContact O-N 2.91Å; W531-Q533 PolarHBondContact O-N 3.49Å; W531-N534 PolarHBondContact O-N 2.94Å; W531-R535 HydrophobicContact CE3-CB 4.17Å; W531-R535 HydrophobicContact CH2-CB 4Å; W531-R535 HydrophobicContact CH2-CG 3.79Å; W531-R535 HydrophobicContact CZ2-CB 4.46Å; W531-R535 HydrophobicContact CZ2-CG 4.41Å; W531-R535 HydrophobicContact CZ3-CB 3.85Å; W531-R535 HydrophobicContact CZ3-CG 4.02Å; W531-R535 WeakPolarHBondContact O-CB 3.1Å; W531-R535 PolarHBondContact O-N 2.86Å
532	F	98.1	Very high	96.7	Very high	4 Å²	4	61.5 Å²	61.5	2%	0.018	33%	0.325	C	S	.	.	H	α-helix	trans	-64.4	-38	177.5	-90.7	-104.9	0	0	0	112.5	L499 N502 F503 Q506 L509 I517 V528 I529 R536	L499-F532 HydrophobicContact CD2-CE2 4.09Å; N502-F532 HydrophobicContact CB-CZ 4.2Å; F503-F532 HydrophobicContact CB-CE1 4.14Å; F503-F532 HydrophobicContact CB-CZ 4.28Å; F503-F532 AromaticContact CD2-CD1 3.73Å; F503-F532 HydrophobicContact CD2-CD1 3.73Å; F503-F532 AromaticContact CD2-CE1 3.81Å; F503-F532 HydrophobicContact CD2-CE1 3.81Å; F503-F532 HydrophobicContact CE2-CD1 4.41Å; F503-F532 HydrophobicContact CG-CE1 4.48Å; Q506-F532 WeakPolarHBondContact O-CE1 3.48Å; L509-F532 HydrophobicContact CD1-CD1 3.95Å; L509-F532 HydrophobicContact CD1-CD2 3.48Å; L509-F532 VanDerWaalsContact CD1-CD2 3.48Å; L509-F532 HydrophobicContact CD1-CE1 3.94Å; L509-F532 HydrophobicContact CD1-CE2 3.5Å; L509-F532 VanDerWaalsContact CD1-CE2 3.5Å; L509-F532 HydrophobicContact CD1-CG 3.73Å; L509-F532 HydrophobicContact CD1-CZ 3.73Å; L509-F532 HydrophobicContact CD2-CD1 4.29Å; L509-F532 HydrophobicContact CD2-CE1 3.6Å; L509-F532 HydrophobicContact CD2-CE2 4.17Å; L509-F532 HydrophobicContact CD2-CZ 3.54Å; L509-F532 HydrophobicContact CG-CD1 3.65Å; L509-F532 HydrophobicContact CG-CD2 4.11Å; L509-F532 HydrophobicContact CG-CE1 3.48Å; L509-F532 VanDerWaalsContact CG-CE1 3.48Å; L509-F532 HydrophobicContact CG-CE2 3.99Å; L509-F532 HydrophobicContact CG-CG 3.97Å; L509-F532 HydrophobicContact CG-CZ 3.68Å; I517-F532 HydrophobicContact CD1-CZ 4.36Å; V528-F532 HydrophobicContact CG1-CD2 3.95Å; V528-F532 HydrophobicContact CG1-CE2 4.05Å; V528-F532 VanDerWaalsContact O-CD2 3.32Å; V528-F532 WeakPolarHBondContact O-CD2 3.49Å; V528-F532 PolarHBondContact O-N 3.23Å; I529-F532 PolarHBondContact O-N 2.94Å; F532-R536 WeakPolarHBondContact O-CG 3.24Å; F532-R536 PolarHBondContact O-N 3.39Å
533	Q	97.2	Very high	96.5	Very high	97 Å²	97	61.1 Å²	61.1	45%	0.453	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-50.5	172.7	-75.4	171.9	-16.6	0	0	111.4	I529 T530 W531 R535 R536 A537	I529-Q533 HydrophobicContact CG2-CG 4.41Å; I529-Q533 WeakPolarHBondContact O-CG 3.44Å; I529-Q533 PolarHBondContact O-N 3.38Å; T530-Q533 PolarHBondContact O-N 3.28Å; W531-Q533 PolarHBondContact O-N 3.49Å; Q533-R535 VanDerWaalsContact C-N 3.3Å; Q533-R535 PolarHBondContact O-N 3.33Å; Q533-R536 PolarHBondContact O-N 2.82Å; Q533-A537 PolarHBondContact O-N 3.36Å
534	N	97.7	Very high	96.3	Very high	98 Å²	98	64.2 Å²	64.2	52%	0.524	33%	0.329	S	S	.	.	H	α-helix	trans	-61.7	-39.2	178.5	-71.3	-19.3	0	0	0	111.8	T530 W531 A537 K538	T530-N534 WeakPolarHBondContact O-CB 3.47Å; T530-N534 PolarHBondContact O-N 3.49Å; T530-N534 PolarHBondContact O-ND2 3.28Å; W531-N534 PolarHBondContact O-N 2.94Å; N534-A537 PolarHBondContact O-N 3.36Å; N534-K538 WeakPolarHBondContact O-CB 3.47Å; N534-K538 PolarHBondContact O-N 3.34Å
535	R	97.9	Very high	96	Very high	26 Å²	26	64.2 Å²	64.2	10%	0.098	32%	0.324	C	S	.	.	H	α-helix	trans	-67.6	-38.3	178	-173.8	63.3	-175.1	102.2	-12.2	112.2	E500 F503 W531 Q533 K538 L539 E542	E500-R535 IonicContact OE1-CZ 3.13Å; E500-R535 IonicContact OE1-NE 3.94Å; E500-R535 PolarHBondContact OE1-NE 2.82Å; E500-R535 IonicContact OE1-NH2 2.85Å; E500-R535 PolarHBondContact OE1-NH2 3.11Å; F503-R535 HydrophobicContact CD1-CG 3.52Å; F503-R535 HydrophobicContact CD2-CB 4.18Å; F503-R535 HydrophobicContact CD2-CG 3.79Å; F503-R535 HydrophobicContact CE1-CB 4.49Å; F503-R535 HydrophobicContact CE1-CG 3.4Å; F503-R535 HydrophobicContact CE2-CB 3.99Å; F503-R535 HydrophobicContact CE2-CG 3.71Å; F503-R535 HydrophobicContact CG-CG 3.71Å; F503-R535 HydrophobicContact CZ-CB 4.15Å; F503-R535 HydrophobicContact CZ-CG 3.51Å; W531-R535 HydrophobicContact CE3-CB 4.17Å; W531-R535 HydrophobicContact CH2-CB 4Å; W531-R535 HydrophobicContact CH2-CG 3.79Å; W531-R535 HydrophobicContact CZ2-CB 4.46Å; W531-R535 HydrophobicContact CZ2-CG 4.41Å; W531-R535 HydrophobicContact CZ3-CB 3.85Å; W531-R535 HydrophobicContact CZ3-CG 4.02Å; W531-R535 WeakPolarHBondContact O-CB 3.1Å; W531-R535 PolarHBondContact O-N 2.86Å; Q533-R535 VanDerWaalsContact C-N 3.3Å; Q533-R535 PolarHBondContact O-N 3.33Å; R535-K538 PolarHBondContact O-N 3Å; R535-L539 WeakPolarHBondContact O-CB 3.44Å; R535-L539 PolarHBondContact O-N 3.24Å; R535-E542 IonicContact NH1-OE2 3.39Å; R535-E542 PolarHBondContact NH1-OE2 2.9Å; R535-E542 VanDerWaalsContact NH1-OE2 3.13Å
536	R	97.8	Very high	95.7	Very high	62 Å²	62	67 Å²	67	23%	0.234	34%	0.338	C	S	.	.	H	α-helix	trans	-65.1	-41.8	171.1	-73	-166.8	-60.7	-86	-0.7	112.2	F503 R507 F532 Q533 K538 L539 K540	F503-R536 HydrophobicContact CE2-CG 3.73Å; F503-R536 HydrophobicContact CZ-CG 4.02Å; R507-R536 PolarHBondContact O-NH1 3.27Å; R507-R536 VanDerWaalsContact O-NH1 3.07Å; F532-R536 WeakPolarHBondContact O-CG 3.24Å; F532-R536 PolarHBondContact O-N 3.39Å; Q533-R536 PolarHBondContact O-N 2.82Å; R536-K538 VanDerWaalsContact C-N 3.3Å; R536-K538 PolarHBondContact O-N 3.22Å; R536-L539 PolarHBondContact O-N 3.48Å; R536-K540 PolarHBondContact O-N 3.12Å
537	A	97.5	Very high	95.4	Very high	48 Å²	48	67.8 Å²	67.8	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-62.8	-38.8	175.6	0	0	0	0	0	111.8	Q533 N534 R541	Q533-A537 PolarHBondContact O-N 3.36Å; N534-A537 PolarHBondContact O-N 3.36Å; A537-R541 PolarHBondContact O-N 3.35Å; A537-R541 VanDerWaalsContact O-N 3.16Å
538	K	96.1	Very high	95.1	Very high	57 Å²	57	72.1 Å²	72.1	25%	0.248	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-49	172.9	-165.9	-169.7	-172.3	-170.2	0	111.7	N534 R535 R536 K540 R541 E542 E644	N534-K538 WeakPolarHBondContact O-CB 3.47Å; N534-K538 PolarHBondContact O-N 3.34Å; R535-K538 PolarHBondContact O-N 3Å; R536-K538 VanDerWaalsContact C-N 3.3Å; R536-K538 PolarHBondContact O-N 3.22Å; K538-K540 VanDerWaalsContact C-N 3.3Å; K538-K540 PolarHBondContact O-N 3.29Å; K538-R541 WeakPolarHBondContact O-CB 3.37Å; K538-R541 PolarHBondContact O-N 3.27Å; K538-R541 VanDerWaalsContact O-N 3.11Å; K538-E542 WeakPolarHBondContact CD-OE1 3.34Å; K538-E542 WeakPolarHBondContact CE-OE1 3.35Å; K538-E542 HydrophobicContact CG-CG 4.39Å; K538-E542 IonicContact NZ-OE1 3.31Å; K538-E542 WeakPolarHBondContact O-CG 3.46Å; K538-E542 PolarHBondContact O-N 3.06Å; K538-E644 WeakPolarHBondContact CE-OE1 3.24Å; K538-E644 WeakPolarHBondContact CE-OE2 2.87Å; K538-E644 IonicContact NZ-OE1 3.55Å; K538-E644 IonicContact NZ-OE2 2.93Å; K538-E644 PolarHBondContact NZ-OE2 3.46Å
539	L	96.6	Very high	94.6	Very high	62 Å²	62	75.6 Å²	75.6	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-57.1	-42.2	177.5	-178.1	74.5	0	0	0	112.5	F503 R507 R535 R536 E542 A543	F503-L539 HydrophobicContact CZ-CD2 4.42Å; R507-L539 VanDerWaalsContact NH1-CD1 3.25Å; R535-L539 WeakPolarHBondContact O-CB 3.44Å; R535-L539 PolarHBondContact O-N 3.24Å; R536-L539 PolarHBondContact O-N 3.48Å; L539-E542 PolarHBondContact O-N 2.95Å; L539-A543 WeakPolarHBondContact O-CB 3.49Å; L539-A543 PolarHBondContact O-N 3.02Å
540	K	95.6	Very high	94.3	Very high	138 Å²	138	75.3 Å²	75.3	60%	0.6	37%	0.369	S	S	*	.	H	α-helix	trans	-61.1	-45.5	176.4	-179.5	174.8	171.7	177.7	0	111	R536 K538 A543 E544	R536-K540 PolarHBondContact O-N 3.12Å; K538-K540 VanDerWaalsContact C-N 3.3Å; K538-K540 PolarHBondContact O-N 3.29Å; K540-A543 PolarHBondContact O-N 2.93Å; K540-E544 WeakPolarHBondContact CE-OE1 3.39Å; K540-E544 WeakPolarHBondContact CG-OE1 3.49Å; K540-E544 IonicContact NZ-OE1 2.84Å; K540-E544 WeakPolarHBondContact O-CG 3.44Å; K540-E544 PolarHBondContact O-N 3.39Å
541	R	94.6	Very high	93.9	Very high	130 Å²	130	77.1 Å²	77.1	49%	0.491	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-44.5	175.9	-74.3	-175.7	-76.8	111.1	-6.7	112.5	A537 K538 A543 E544 E545	A537-R541 PolarHBondContact O-N 3.35Å; A537-R541 VanDerWaalsContact O-N 3.16Å; K538-R541 WeakPolarHBondContact O-CB 3.37Å; K538-R541 PolarHBondContact O-N 3.27Å; K538-R541 VanDerWaalsContact O-N 3.11Å; R541-A543 VanDerWaalsContact C-N 3.29Å; R541-A543 PolarHBondContact O-N 3.13Å; R541-E544 PolarHBondContact O-N 3.05Å; R541-E545 WeakPolarHBondContact O-CB 3.23Å; R541-E545 PolarHBondContact O-N 2.91Å
542	E	93.7	Very high	93.5	Very high	52 Å²	52	77.7 Å²	77.7	24%	0.243	39%	0.385	C	S	.	.	H	α-helix	trans	-58.9	-39.9	176.4	-71.7	167.2	167.8	0	0	111.1	R535 K538 L539 L546	R535-E542 IonicContact NH1-OE2 3.39Å; R535-E542 PolarHBondContact NH1-OE2 2.9Å; R535-E542 VanDerWaalsContact NH1-OE2 3.13Å; K538-E542 WeakPolarHBondContact CD-OE1 3.34Å; K538-E542 WeakPolarHBondContact CE-OE1 3.35Å; K538-E542 HydrophobicContact CG-CG 4.39Å; K538-E542 IonicContact NZ-OE1 3.31Å; K538-E542 WeakPolarHBondContact O-CG 3.46Å; K538-E542 PolarHBondContact O-N 3.06Å; L539-E542 PolarHBondContact O-N 2.95Å; E542-L546 WeakPolarHBondContact O-CB 3.48Å; E542-L546 PolarHBondContact O-N 2.98Å
543	A	92.5	Very high	92.8	Very high	59 Å²	59	82.5 Å²	82.5	49%	0.488	41%	0.41	S	S	.	.	H	α-helix	trans	-69.3	-44.2	176.6	0	0	0	0	0	113	L539 K540 R541 E545 L546 E547	L539-A543 WeakPolarHBondContact O-CB 3.49Å; L539-A543 PolarHBondContact O-N 3.02Å; K540-A543 PolarHBondContact O-N 2.93Å; R541-A543 VanDerWaalsContact C-N 3.29Å; R541-A543 PolarHBondContact O-N 3.13Å; A543-E545 VanDerWaalsContact C-N 3.3Å; A543-E545 PolarHBondContact O-N 3.33Å; A543-L546 PolarHBondContact O-N 2.98Å; A543-E547 WeakPolarHBondContact O-CB 3.35Å; A543-E547 PolarHBondContact O-N 3.11Å
544	E	92.1	Very high	92.2	Very high	84 Å²	84	84.8 Å²	84.8	39%	0.393	42%	0.415	S	S	.	.	H	α-helix	trans	-65.3	-33.1	176.7	-72	168.8	179.5	0	0	112.3	K540 R541 R548	K540-E544 WeakPolarHBondContact CE-OE1 3.39Å; K540-E544 WeakPolarHBondContact CG-OE1 3.49Å; K540-E544 IonicContact NZ-OE1 2.84Å; K540-E544 WeakPolarHBondContact O-CG 3.44Å; K540-E544 PolarHBondContact O-N 3.39Å; R541-E544 PolarHBondContact O-N 3.05Å; E544-R548 WeakPolarHBondContact O-CG 3.46Å; E544-R548 PolarHBondContact O-N 2.86Å; E544-R548 VanDerWaalsContact O-N 3.11Å; E544-R548 PolarHBondContact O-NE 3.41Å
545	E	90.1	Very high	91.4	Very high	76 Å²	76	86.7 Å²	86.7	36%	0.355	42%	0.418	S	S	.	.	H	α-helix	trans	-69.6	-47.1	174.3	-172.7	163.8	-158.1	0	0	111.9	R541 A543 E547 R548 D549	R541-E545 WeakPolarHBondContact O-CB 3.23Å; R541-E545 PolarHBondContact O-N 2.91Å; A543-E545 VanDerWaalsContact C-N 3.3Å; A543-E545 PolarHBondContact O-N 3.33Å; E545-E547 VanDerWaalsContact C-N 3.28Å; E545-E547 PolarHBondContact O-N 3.39Å; E545-R548 VanDerWaalsContact CA-NH2 3.33Å; E545-R548 WeakPolarHBondContact O-CB 3.49Å; E545-R548 PolarHBondContact O-N 3.06Å; E545-R548 VanDerWaalsContact O-N 3.14Å; E545-D549 PolarHBondContact O-N 3.47Å
546	L	91	Very high	90.3	Very high	115 Å²	115	91.3 Å²	91.3	60%	0.602	44%	0.441	S	S	*	.	H	α-helix	trans	-59.5	-40.6	174.9	-176.3	64.1	0	0	0	111.9	E542 A543 D549 V550	E542-L546 WeakPolarHBondContact O-CB 3.48Å; E542-L546 PolarHBondContact O-N 2.98Å; A543-L546 PolarHBondContact O-N 2.98Å; L546-D549 PolarHBondContact O-N 3.32Å; L546-V550 WeakPolarHBondContact O-CB 3.38Å; L546-V550 VanDerWaalsContact O-CG2 3.23Å; L546-V550 WeakPolarHBondContact O-CG2 3.38Å; L546-V550 PolarHBondContact O-N 2.93Å
547	E	89.7	Confident	89	Confident	115 Å²	115	96.3 Å²	96.3	54%	0.537	47%	0.465	S	S	.	.	H	α-helix	trans	-62.5	-44.4	175.7	-176.8	173.1	-170.4	0	0	111.8	A543 E545 D549 V550 M551	A543-E547 WeakPolarHBondContact O-CB 3.35Å; A543-E547 PolarHBondContact O-N 3.11Å; E545-E547 VanDerWaalsContact C-N 3.28Å; E545-E547 PolarHBondContact O-N 3.39Å; E547-D549 PolarHBondContact O-N 3.31Å; E547-V550 PolarHBondContact O-N 3.32Å; E547-M551 HydrophobicContact CG-CE 3.75Å; E547-M551 WeakPolarHBondContact O-CG 3.42Å; E547-M551 PolarHBondContact O-N 3.35Å; E547-M551 VanDerWaalsContact OE1-CE 3.24Å; E547-M551 WeakPolarHBondContact OE1-CE 3.18Å
548	R	90.4	Very high	87.4	Confident	143 Å²	143	100.4 Å²	100.4	54%	0.54	48%	0.475	S	S	.	.	H	α-helix	trans	-59.9	-44.5	174.7	-79.7	-178.3	-73	121.6	-7	112.1	E544 E545 M551 A552	E544-R548 WeakPolarHBondContact O-CG 3.46Å; E544-R548 PolarHBondContact O-N 2.86Å; E544-R548 VanDerWaalsContact O-N 3.11Å; E544-R548 PolarHBondContact O-NE 3.41Å; E545-R548 VanDerWaalsContact CA-NH2 3.33Å; E545-R548 WeakPolarHBondContact O-CB 3.49Å; E545-R548 PolarHBondContact O-N 3.06Å; E545-R548 VanDerWaalsContact O-N 3.14Å; R548-M551 PolarHBondContact O-N 3.38Å; R548-A552 WeakPolarHBondContact O-CB 3.39Å; R548-A552 PolarHBondContact O-N 3.25Å
549	D	88	Confident	85.6	Confident	72 Å²	72	103.8 Å²	103.8	39%	0.385	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-41.3	179.3	-72.8	-8.7	0	0	0	111.8	E545 L546 E547 M551 A552 L553	E545-D549 PolarHBondContact O-N 3.47Å; L546-D549 PolarHBondContact O-N 3.32Å; E547-D549 PolarHBondContact O-N 3.31Å; D549-M551 PolarHBondContact O-N 2.89Å; D549-A552 PolarHBondContact O-N 3.27Å; D549-L553 WeakPolarHBondContact O-CG 3.32Å; D549-L553 PolarHBondContact O-N 3.11Å
550	V	88.7	Confident	83.4	Confident	58 Å²	58	108.6 Å²	108.6	35%	0.352	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-41.7	174.6	170.8	0	0	0	0	111.1	L546 E547 R554	L546-V550 WeakPolarHBondContact O-CB 3.38Å; L546-V550 VanDerWaalsContact O-CG2 3.23Å; L546-V550 WeakPolarHBondContact O-CG2 3.38Å; L546-V550 PolarHBondContact O-N 2.93Å; E547-V550 PolarHBondContact O-N 3.32Å; V550-R554 WeakPolarHBondContact O-CG 3.42Å; V550-R554 PolarHBondContact O-N 3.13Å
551	M	89.1	Confident	81.2	Confident	95 Å²	95	110.2 Å²	110.2	47%	0.468	52%	0.518	S	S	.	.	H	α-helix	trans	-65.6	-39.4	175	-72.4	-172.4	-171.6	0	0	112.2	E547 R548 D549 R554 K555	E547-M551 HydrophobicContact CG-CE 3.75Å; E547-M551 WeakPolarHBondContact O-CG 3.42Å; E547-M551 PolarHBondContact O-N 3.35Å; E547-M551 VanDerWaalsContact OE1-CE 3.24Å; E547-M551 WeakPolarHBondContact OE1-CE 3.18Å; R548-M551 PolarHBondContact O-N 3.38Å; D549-M551 PolarHBondContact O-N 2.89Å; M551-R554 PolarHBondContact O-N 3.13Å; M551-K555 PolarHBondContact O-N 3.16Å
552	A	88.3	Confident	79.1	Confident	41 Å²	41	107.9 Å²	107.9	34%	0.339	52%	0.518	S	S	.	.	H	α-helix	trans	-63.4	-45.1	176.6	0	0	0	0	0	111.7	R548 D549 R554 K555 Q556	R548-A552 WeakPolarHBondContact O-CB 3.39Å; R548-A552 PolarHBondContact O-N 3.25Å; D549-A552 PolarHBondContact O-N 3.27Å; A552-R554 VanDerWaalsContact C-N 3.32Å; A552-R554 PolarHBondContact O-N 2.85Å; A552-K555 PolarHBondContact O-N 3.05Å; A552-Q556 WeakPolarHBondContact O-CG 3.36Å; A552-Q556 PolarHBondContact O-N 2.91Å
553	L	84.8	Confident	76.7	Confident	105 Å²	105	110 Å²	110	55%	0.55	54%	0.538	S	S	.	.	H	α-helix	trans	-63.7	-35.7	175.7	-71	172.4	0	0	0	112.5	D549 K557	D549-L553 WeakPolarHBondContact O-CG 3.32Å; D549-L553 PolarHBondContact O-N 3.11Å; L553-K557 PolarHBondContact O-N 3.28Å
554	R	84.4	Confident	74.3	Confident	145 Å²	145	114.4 Å²	114.4	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-66.3	-43.5	174	-77	177.7	177.2	167.8	1.9	112.1	V550 M551 A552 K557 Q558	V550-R554 WeakPolarHBondContact O-CG 3.42Å; V550-R554 PolarHBondContact O-N 3.13Å; M551-R554 PolarHBondContact O-N 3.13Å; A552-R554 VanDerWaalsContact C-N 3.32Å; A552-R554 PolarHBondContact O-N 2.85Å; R554-K557 PolarHBondContact O-N 3.3Å; R554-Q558 PolarHBondContact O-N 2.96Å; R554-Q558 VanDerWaalsContact O-N 3.15Å
555	K	80.8	Confident	71.9	Confident	137 Å²	137	114.7 Å²	114.7	60%	0.596	56%	0.564	S	S	*	*	H	α-helix	trans	-63.8	-40.6	176.3	-74.7	-178.5	178.7	-179.3	0	112.2	M551 A552 K557 Q558 Q559	M551-K555 PolarHBondContact O-N 3.16Å; A552-K555 PolarHBondContact O-N 3.05Å; K555-K557 VanDerWaalsContact C-N 3.31Å; K555-K557 PolarHBondContact O-N 2.81Å; K555-Q558 PolarHBondContact O-N 3.49Å; K555-Q559 WeakPolarHBondContact O-CG 3.31Å; K555-Q559 PolarHBondContact O-N 3.15Å
556	Q	74.8	Confident	69.6	Low	123 Å²	123	118.1 Å²	118.1	58%	0.575	58%	0.583	S	S	*	*	H	α-helix	trans	-61.5	-38.3	175.1	-75.2	-178.4	2.4	0	0	112.3	A552 K560	A552-Q556 WeakPolarHBondContact O-CG 3.36Å; A552-Q556 PolarHBondContact O-N 2.91Å; Q556-K560 PolarHBondContact O-N 2.97Å
557	K	70.7	Confident	67.1	Low	168 Å²	168	117.2 Å²	117.2	73%	0.73	59%	0.587	S	S	*	*	H	α-helix	trans	-66.9	-35.3	175.1	-75.8	-174.7	176.9	-174.9	0	113.2	L553 R554 K555	L553-K557 PolarHBondContact O-N 3.28Å; R554-K557 PolarHBondContact O-N 3.3Å; K555-K557 VanDerWaalsContact C-N 3.31Å; K555-K557 PolarHBondContact O-N 2.81Å
558	Q	64.5	Low	64.8	Low	133 Å²	133	119 Å²	119	62%	0.621	60%	0.6	S	S	*	*	H	α-helix	trans	-74.5	-40.9	177.8	-70.9	176.5	-3.2	0	0	112.1	R554 K555 K560 F561 T562	R554-Q558 PolarHBondContact O-N 2.96Å; R554-Q558 VanDerWaalsContact O-N 3.15Å; K555-Q558 PolarHBondContact O-N 3.49Å; Q558-K560 VanDerWaalsContact C-N 3.32Å; Q558-K560 PolarHBondContact O-N 3.22Å; Q558-F561 WeakPolarHBondContact O-CB 3.5Å; Q558-F561 PolarHBondContact O-N 3.46Å; Q558-T562 PolarHBondContact O-N 3.5Å; Q558-T562 VanDerWaalsContact O-N 3.1Å; Q558-T562 PolarHBondContact O-OG1 3.43Å
559	Q	57.3	Low	62.2	Low	129 Å²	129	121.3 Å²	121.3	60%	0.603	62%	0.617	S	S	*	*	H	α-helix	trans	-66.2	-32.4	178.3	-73	178.5	-3.7	0	0	113.2	K555 F561 T562 C563	K555-Q559 WeakPolarHBondContact O-CG 3.31Å; K555-Q559 PolarHBondContact O-N 3.15Å; Q559-F561 PolarHBondContact O-N 2.9Å; Q559-T562 WeakPolarHBondContact CA-OG1 3.47Å; Q559-T562 PolarHBondContact O-N 3.48Å; Q559-T562 PolarHBondContact O-OG1 3.43Å; Q559-C563 WeakPolarHBondContact O-CB 3.38Å; Q559-C563 PolarHBondContact O-N 2.86Å; Q559-C563 VanDerWaalsContact O-N 3.15Å
560	K	50.1	Low	59.8	Low	163 Å²	163	124.9 Å²	124.9	71%	0.709	64%	0.636	S	S	*	*	H	α-helix	trans	-68.4	-18.2	173.7	-153.1	173	-174.9	179.5	0	112.8	Q556 Q558 L564	Q556-K560 PolarHBondContact O-N 2.97Å; Q558-K560 VanDerWaalsContact C-N 3.32Å; Q558-K560 PolarHBondContact O-N 3.22Å; K560-L564 WeakPolarHBondContact O-CD1 3.47Å
561	F	49.4	Very low	57.1	Low	172 Å²	172	130.5 Å²	130.5	75%	0.754	66%	0.658	S	S	*	*	H	α-helix	trans	-92.9	-30.8	175.5	-130.7	-87.4	0	0	0	112.6	Q558 Q559	Q558-F561 WeakPolarHBondContact O-CB 3.5Å; Q558-F561 PolarHBondContact O-N 3.46Å; Q559-F561 PolarHBondContact O-N 2.9Å
562	T	50.4	Low	54.6	Low	81 Å²	81	134.8 Å²	134.8	50%	0.497	68%	0.677	S	S	.	*	H	α-helix	trans	-85.8	-19.8	-179.3	56.7	0	0	0	0	114.4	Q558 Q559 L564 S565	Q558-T562 PolarHBondContact O-N 3.5Å; Q558-T562 VanDerWaalsContact O-N 3.1Å; Q558-T562 PolarHBondContact O-OG1 3.43Å; Q559-T562 WeakPolarHBondContact CA-OG1 3.47Å; Q559-T562 PolarHBondContact O-N 3.48Å; Q559-T562 PolarHBondContact O-OG1 3.43Å; T562-L564 VanDerWaalsContact C-N 3.33Å; T562-S565 PolarHBondContact O-OG 3.36Å
563	C	43.3	Very low	51.9	Low	97 Å²	97	142 Å²	142	66%	0.655	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-15.3	175.6	-176	0	0	0	0	113.2	Q559	Q559-C563 WeakPolarHBondContact O-CB 3.38Å; Q559-C563 PolarHBondContact O-N 2.86Å; Q559-C563 VanDerWaalsContact O-N 3.15Å
564	L	43.3	Very low	49.6	Very low	150 Å²	150	142.7 Å²	142.7	79%	0.785	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	2.8	-177.3	-74.9	166.8	0	0	0	113.6	K560 T562	K560-L564 WeakPolarHBondContact O-CD1 3.47Å; T562-L564 VanDerWaalsContact C-N 3.33Å
565	S	41.1	Very low	47.1	Very low	91 Å²	91	144.7 Å²	144.7	64%	0.636	73%	0.728	S	S	*	*	S	Bend	trans	-124.9	15.4	-172.6	64.4	0	0	0	0	114.5	T562	T562-S565 PolarHBondContact O-OG 3.36Å
566	L	41.8	Very low	45.1	Very low	147 Å²	147	145.7 Å²	145.7	77%	0.77	74%	0.738	S	S	*	*	S	Bend	trans	-131.8	30.8	-169	-100.1	145.1	0	0	0	113.2
567	S	37.8	Very low	43.2	Very low	97 Å²	97	146.3 Å²	146.3	68%	0.678	75%	0.745	S	S	*	*			trans	-129.7	7.7	-172.6	-43.6	0	0	0	0	116.4
568	D	41	Very low	41.8	Very low	153 Å²	153	145.6 Å²	145.6	82%	0.818	75%	0.749	S	S	*	*			trans	-129.1	77	-178.5	-68.5	-39.4	0	0	0	111.6
569	H	36.2	Very low	40.6	Very low	190 Å²	190	146.9 Å²	146.9	88%	0.88	76%	0.756	S	S	*	*			trans	-162.5	87.4	154	-115.3	56.3	0	0	0	110.4
570	D	38.4	Very low	39.5	Very low	148 Å²	148	146.9 Å²	146.9	79%	0.791	76%	0.76	S	S	*	*			trans	-110	128.9	163	-79.9	-32.6	0	0	0	108.9
571	H	31.5	Very low	39	Very low	176 Å²	176	147 Å²	147	82%	0.815	76%	0.763	S	S	*	*			trans	74.5	101.7	161.1	-58	-60.9	0	0	0	120.9
572	E	36.9	Very low	38.4	Very low	185 Å²	185	147.8 Å²	147.8	86%	0.864	77%	0.769	S	S	*	*				-149.9	110.9	126.1	-116.7	175.3	-168.1	0	0	109.9	T574	E572-T574 PolarHBondContact O-N 3.36Å
573	E	30.9	Very low	37.7	Very low	192 Å²	192	147.4 Å²	147.4	90%	0.897	78%	0.781	S	S	*	*			trans	-70	113.9	164.6	-78.8	176.9	145.5	0	0	108.6
574	T	36.5	Very low	37.6	Very low	119 Å²	119	149.3 Å²	149.3	73%	0.73	79%	0.785	S	S	*	*			trans	-133.9	106.4	156	31.3	0	0	0	0	109	E572 I576	E572-T574 PolarHBondContact O-N 3.36Å; T574-I576 PolarHBondContact O-N 2.94Å
575	Q	33.1	Very low	37.6	Very low	188 Å²	188	147.5 Å²	147.5	88%	0.879	78%	0.776	S	S	*	*			trans	-57.1	117	161.5	-72.6	170.3	-30.6	0	0	109.1
576	I	39	Very low	37.5	Very low	158 Å²	158	149 Å²	149	81%	0.81	78%	0.776	S	S	*	*			trans	-137.6	102.7	153	-59.9	-177.8	0	0	0	105.8	T574	T574-I576 PolarHBondContact O-N 2.94Å
577	D	34.3	Very low	37.5	Very low	136 Å²	136	149.6 Å²	149.6	73%	0.727	78%	0.781	S	S	*	*			trans	-57.8	137.6	160.1	-57.6	-56.4	0	0	0	108.7
578	D	41.9	Very low	37.5	Very low	153 Å²	153	152.4 Å²	152.4	82%	0.818	79%	0.788	S	S	*	*			trans	173.9	111	134.8	-84.9	-25	0	0	0	111.6
579	E	39	Very low	38.1	Very low	160 Å²	160	152.9 Å²	152.9	75%	0.748	79%	0.791	S	S	*	*			trans	-4	155.4	150.7	-49.9	-176.5	158.5	0	0	122.2
580	N	34.3	Very low	38.3	Very low	129 Å²	129	151.2 Å²	151.2	69%	0.69	79%	0.788	S	S	*	*			trans	82.8	141.2	152.4	-56.2	-36.5	0	0	0	116.6
581	E	38.5	Very low	38.8	Very low	166 Å²	166	148.1 Å²	148.1	78%	0.776	79%	0.791	S	S	*	*			cis	-168.3	168.6	2.8	-121.6	175.8	167.5	0	0	107.5
582	Q	36.6	Very low	39.3	Very low	187 Å²	187	145.5 Å²	145.5	87%	0.874	78%	0.783	S	S	*	*			trans	-54.9	162	-177.8	-68.3	145.6	-40.6	0	0	116.5
583	G	37.2	Very low	39.7	Very low	73 Å²	73	144 Å²	144	75%	0.753	78%	0.781	S	S	*	*			trans	157.3	75.1	164.3	0	0	0	0	0	113.3
584	D	39.7	Very low	40.1	Very low	138 Å²	138	139.6 Å²	139.6	74%	0.738	76%	0.764	S	S	*	*				95.7	139.1	76.4	-160.7	22.2	0	0	0	113.7
585	N	44.4	Very low	40.1	Very low	112 Å²	112	140.9 Å²	140.9	60%	0.599	77%	0.766	S	S	*	*			trans	84.1	96	161.4	-61.1	-51.9	0	0	0	122.5
586	N	37.7	Very low	40.5	Very low	121 Å²	121	137.4 Å²	137.4	65%	0.647	76%	0.758	S	S	*	*				47	125.5	104.9	-58	-38.5	0	0	0	118.5
587	N	43.3	Very low	40.3	Very low	161 Å²	161	139.2 Å²	139.2	86%	0.861	76%	0.762	S	S	*	*				-172.6	101.4	118.6	-82.4	-31	0	0	0	109.2
588	D	37.4	Very low	40.5	Very low	156 Å²	156	140.9 Å²	140.9	83%	0.834	77%	0.766	S	S	*	*			trans	-69.4	135.6	153.6	-62.8	-53.4	0	0	0	107.9
589	D	52.4	Low	40.2	Very low	163 Å²	163	140.5 Å²	140.5	87%	0.872	76%	0.764	S	S	*	*			trans	-134.6	105.5	167.9	-157.2	16.1	0	0	0	108.6
590	D	41.9	Very low	40.1	Very low	155 Å²	155	140.2 Å²	140.2	83%	0.829	77%	0.767	S	S	*	*			trans	-76.9	130.2	174.8	-74.2	-53	0	0	0	109.8
591	G	47.5	Very low	40	Very low	83 Å²	83	137.2 Å²	137.2	86%	0.856	77%	0.767	S	S	*	*			trans	-121.3	91.2	173	0	0	0	0	0	111.2
592	D	41.9	Very low	39.5	Very low	121 Å²	121	138.4 Å²	138.4	65%	0.647	77%	0.772	S	S	*	*			trans	-58.3	143	166.4	-174.2	16.9	0	0	0	112	N594	D592-N594 PolarHBondContact OD1-ND2 3.46Å
593	D	46	Very low	39.3	Very low	152 Å²	152	138.8 Å²	138.8	81%	0.813	77%	0.774	S	S	*	*			trans	-177	89.2	143.6	-93.1	-25.8	0	0	0	111.7
594	N	38.9	Very low	38.9	Very low	101 Å²	101	143.5 Å²	143.5	54%	0.54	78%	0.777	S	S	.	*				34.5	124.5	125.4	-58.7	-62.4	0	0	0	121.4	D592	D592-N594 PolarHBondContact OD1-ND2 3.46Å
595	D	36.3	Very low	38.3	Very low	146 Å²	146	143.8 Å²	143.8	78%	0.781	77%	0.774	S	S	*	*			trans	57.4	126.4	132	-57.2	-26	0	0	0	121.2
596	V	42.1	Very low	37.6	Very low	115 Å²	115	145.9 Å²	145.9	70%	0.697	78%	0.778	S	S	*	*				177.3	116.2	103.3	160.5	0	0	0	0	108	E598	V596-E598 HydrophobicContact CG1-CG 3.85Å
597	E	35.2	Very low	37.1	Very low	195 Å²	195	146.3 Å²	146.3	91%	0.911	78%	0.78	S	S	*	*			trans	-78.1	127.8	158.6	-65.5	-153	167.7	0	0	108.9
598	E	39.4	Very low	36.4	Very low	172 Å²	172	146.7 Å²	146.7	80%	0.804	78%	0.776	S	S	*	*			trans	-126.2	100.4	162.3	-86.2	-179	175.1	0	0	108.7	V596	V596-E598 HydrophobicContact CG1-CG 3.85Å
599	D	34.6	Very low	35.8	Very low	144 Å²	144	145.4 Å²	145.4	77%	0.77	77%	0.774	S	S	*	*			trans	-66.8	130.9	153.7	178	26.6	0	0	0	108.3
600	D	37.4	Very low	34.6	Very low	154 Å²	154	146.4 Å²	146.4	82%	0.824	77%	0.771	S	S	*	*			trans	-163	98.6	158.2	-90.6	-30.5	0	0	0	110
601	G	31.2	Very low	34	Very low	66 Å²	66	149 Å²	149	68%	0.68	77%	0.77	S	S	*	*				64.6	112.3	106.4	0	0	0	0	0	118.5
602	E	29.3	Very low	32.9	Very low	191 Å²	191	153.2 Å²	153.2	89%	0.893	77%	0.772	S	S	*	*			trans	-41.6	131.3	160.9	-57.1	174.6	147.3	0	0	113.5
603	E	31.8	Very low	32.2	Very low	196 Å²	196	153.5 Å²	153.5	92%	0.916	78%	0.779	S	S	*	*			trans	-165.8	155.3	134.9	-114.5	176.4	-173.1	0	0	114.3
604	Q	28.5	Very low	31.3	Very low	172 Å²	172	155 Å²	155	80%	0.804	78%	0.781	S	S	*	*			trans	-85.6	162.2	-156.6	-62.3	170.7	-12.3	0	0	114
605	E	26.7	Very low	30.7	Very low	144 Å²	144	155.7 Å²	155.7	67%	0.673	79%	0.791	S	S	*	*			trans	45.8	106.6	139.2	-78.3	-166.2	167.8	0	0	118.8
606	K	30.4	Very low	30.2	Very low	156 Å²	156	154.5 Å²	154.5	68%	0.678	79%	0.791	S	S	*	*				149.6	133.1	115.1	-86.7	147	-171.2	140.5	0	112
607	N	27.7	Very low	29.5	Very low	129 Å²	129	153.6 Å²	153.6	69%	0.69	79%	0.789	S	S	*	*			trans	63.2	104.8	149.7	-49.5	-24.4	0	0	0	117.4
608	H	28	Very low	29.2	Very low	170 Å²	170	152.3 Å²	152.3	79%	0.787	79%	0.787	S	S	*	*				166.9	124.7	95.9	-99.3	-66.6	0	0	0	112.7	K610	H608-K610 PolarHBondContact O-N 2.78Å
609	T	25.4	Very low	28.7	Very low	129 Å²	129	148.4 Å²	148.4	79%	0.791	78%	0.779	S	S	*	*			trans	-32.5	107	147	50.5	0	0	0	0	114.7
610	K	26.9	Very low	28.4	Very low	184 Å²	184	148.4 Å²	148.4	80%	0.8	78%	0.779	S	S	*	*			trans	-172.8	158.7	143.1	-127.6	167.9	176.8	175.5	0	108.8	H608	H608-K610 PolarHBondContact O-N 2.78Å
611	Y	29	Very low	28.1	Very low	208 Å²	208	148.2 Å²	148.2	82%	0.816	78%	0.776	S	S	*	*			trans	89.9	72.6	-176.3	-49.7	-72.4	0	0	0	115.5	T613	Y611-T613 PolarHBondContact O-N 2.82Å
612	L	24.8	Very low	28	Very low	172 Å²	172	151.3 Å²	151.3	90%	0.901	78%	0.777	S	S	*	*			trans	-52.3	116.7	135.7	-91.3	75.6	0	0	0	108.5
613	T	26.6	Very low	27.9	Very low	128 Å²	128	146.1 Å²	146.1	79%	0.785	76%	0.759	S	S	*	*			trans	-153.5	130.1	150.9	26	0	0	0	0	108.7	Y611	Y611-T613 PolarHBondContact O-N 2.82Å
614	Q	27.2	Very low	27.8	Very low	184 Å²	184	141.5 Å²	141.5	86%	0.86	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-59.3	144.9	-175.8	-66	171.6	-10.4	0	0	111.8
615	P	27	Very low	28.2	Very low	115 Å²	115	138.7 Å²	138.7	75%	0.747	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-72.2	145.4	168.3	31.2	-30.9	0	0	0	109.7	S617	P615-S617 PolarHBondContact O-N 3.39Å
616	P	26.1	Very low	28.4	Very low	120 Å²	120	137.7 Å²	137.7	78%	0.779	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-68.7	134	-169.2	28.9	-33.3	0	0	0	111.2	I618	P616-I618 PolarHBondContact O-N 3.29Å
617	S	25.5	Very low	28.5	Very low	96 Å²	96	138.3 Å²	138.3	67%	0.671	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-56	127.1	171.6	-58.3	0	0	0	0	110.7	P615 S619	P615-S617 PolarHBondContact O-N 3.39Å; S617-S619 PolarHBondContact O-N 3.45Å
618	I	28.9	Very low	28.6	Very low	169 Å²	169	140.2 Å²	140.2	87%	0.867	75%	0.754	S	S	*	*	S	Bend	trans	-73.2	73.1	169.9	-55.8	169.2	0	0	0	107.5	P616	P616-I618 PolarHBondContact O-N 3.29Å
619	S	28.8	Very low	28.6	Very low	89 Å²	89	141.3 Å²	141.3	62%	0.622	76%	0.757	S	S	*	*			trans	-114.3	0.9	173.8	58.4	0	0	0	0	112.9	S617	S617-S619 PolarHBondContact O-N 3.45Å
620	N	29.6	Very low	28.8	Very low	145 Å²	145	140.3 Å²	140.3	78%	0.775	75%	0.753	S	S	*	*	S	Bend	trans	-113.9	19.2	-166.5	-67.6	-4.7	0	0	0	115
621	I	30.9	Very low	28.6	Very low	150 Å²	150	137.7 Å²	137.7	77%	0.769	76%	0.757	S	S	*	*			trans	-130.6	59.6	175.8	-43.8	176.6	0	0	0	109.5
622	L	28.7	Very low	28.5	Very low	131 Å²	131	133 Å²	133	69%	0.686	76%	0.755	S	S	*	*	S	Bend	trans	-135.8	132.3	167.1	-117.7	97.9	0	0	0	110.2	L626	L622-L626 HydrophobicContact CD2-CD1 3.82Å
623	P	28.6	Very low	28.7	Very low	81 Å²	81	131.1 Å²	131.1	53%	0.526	75%	0.751	S	S	.	*			trans	-60.4	144.6	178.9	-18.3	29.8	0	0	0	112	S625	P623-S625 PolarHBondContact O-N 2.95Å
624	S	29.5	Very low	28.7	Very low	99 Å²	99	132.9 Å²	132.9	69%	0.692	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-56.9	1.4	-171.7	-52.7	0	0	0	0	117.4
625	S	35.2	Very low	28.6	Very low	114 Å²	114	131.4 Å²	131.4	80%	0.797	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-90.8	0	-170.9	-38.6	0	0	0	0	115.2	P623	P623-S625 PolarHBondContact O-N 2.95Å
626	L	32.5	Very low	28.5	Very low	123 Å²	123	132.2 Å²	132.2	64%	0.644	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-117.1	16.7	-173	-80.2	161.8	0	0	0	114.6	L622 H628	L622-L626 HydrophobicContact CD2-CD1 3.82Å; L626-H628 PolarHBondContact O-N 3.3Å; L626-H628 VanDerWaalsContact O-N 3.15Å
627	K	32.6	Very low	28.5	Very low	169 Å²	169	133.9 Å²	133.9	74%	0.735	76%	0.757	S	S	*	*			trans	-77.6	11.5	-174.1	-68.1	-173.9	177.7	-178.4	0	116.1
628	H	28.9	Very low	28.5	Very low	169 Å²	169	138 Å²	138	78%	0.782	77%	0.766	S	S	*	*			trans	-134.7	67.4	-174.3	-68.1	81	0	0	0	112.7	L626	L626-H628 PolarHBondContact O-N 3.3Å; L626-H628 VanDerWaalsContact O-N 3.15Å
629	F	28.8	Very low	28.5	Very low	192 Å²	192	135.9 Å²	135.9	84%	0.842	76%	0.755	S	S	*	*	S	Bend	trans	-144.1	139.4	157.4	-89.4	-77.6	0	0	0	110.9
630	P	28	Very low	28.4	Very low	109 Å²	109	137.5 Å²	137.5	71%	0.708	76%	0.756	S	S	*	*			trans	-76.9	133.9	-167.2	-8.6	26	0	0	0	112.9	S632	P630-S632 PolarHBondContact O-N 3.02Å; P630-S632 VanDerWaalsContact O-N 3.13Å
631	S	24.4	Very low	28.4	Very low	128 Å²	128	136.6 Å²	136.6	90%	0.895	75%	0.752	S	S	*	*	S	Bend	trans	-63.4	99.3	174.6	-63.1	0	0	0	0	112.7
632	S	26.8	Very low	28.3	Very low	111 Å²	111	137 Å²	137	78%	0.776	75%	0.748	S	S	*	*			trans	-157	2.8	160.5	51.2	0	0	0	0	116.7	P630	P630-S632 PolarHBondContact O-N 3.02Å; P630-S632 VanDerWaalsContact O-N 3.13Å
633	T	29.3	Very low	28.3	Very low	131 Å²	131	135.8 Å²	135.8	80%	0.804	74%	0.739	S	S	*	*			trans	-117.6	10.5	-174.4	-15.3	0	0	0	0	115.1	N635	T633-N635 PolarHBondContact O-N 3.26Å
634	L	25.9	Very low	28.2	Very low	165 Å²	165	137.4 Å²	137.4	86%	0.864	74%	0.739	S	S	*	*			trans	-92.6	63.3	-178.8	-104	158.5	0	0	0	111.1
635	N	24.3	Very low	28.3	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	72%	0.719	S	S	*	*	S	Bend	trans	-156.2	128.3	163	-81.7	-40.4	0	0	0	106.8	T633	T633-N635 PolarHBondContact O-N 3.26Å
636	T	24.7	Very low	28	Very low	133 Å²	133	135.7 Å²	135.7	82%	0.816	71%	0.714	S	S	*	*			trans	97.9	65.3	-175.8	-30.5	0	0	0	0	115.4
637	L	26.1	Very low	27.8	Very low	155 Å²	155	135 Å²	135	81%	0.812	71%	0.711	S	S	*	*			trans	-133.2	83.9	156.4	-83	165.6	0	0	0	107.8	I639	L637-I639 PolarHBondContact O-N 3.41Å
638	E	25.4	Very low	27.6	Very low	183 Å²	183	132.4 Å²	132.4	86%	0.855	70%	0.703	S	S	*	*			trans	-67	108.9	162.2	-80.9	174.7	147.9	0	0	107.9
639	I	30	Very low	27.5	Very low	124 Å²	124	128 Å²	128	64%	0.636	69%	0.685	S	S	*	*			trans	-97.8	93.3	174.6	-61.2	174.5	0	0	0	107	L637 N641	L637-I639 PolarHBondContact O-N 3.41Å; I639-N641 WeakPolarHBondContact CG2-OD1 3.35Å; I639-N641 PolarHBondContact O-N 3.33Å
640	D	26.7	Very low	27.5	Very low	122 Å²	122	125.4 Å²	125.4	65%	0.652	68%	0.679	S	S	*	*			trans	-70.5	99.7	163.9	-80.6	-32.4	0	0	0	108.9	R214 K642	R214-D640 IonicContact CZ-OD2 2.8Å; R214-D640 IonicContact NH2-OD2 3.41Å; R214-D640 PolarHBondContact NH2-OD2 3.41Å; D640-K642 PolarHBondContact O-N 2.97Å
641	N	28.9	Very low	27.6	Very low	126 Å²	126	130.5 Å²	130.5	67%	0.674	69%	0.691	S	S	*	*			trans	-87.9	97.6	171.4	-81.2	-29.3	0	0	0	110.3	I639	I639-N641 WeakPolarHBondContact CG2-OD1 3.35Å; I639-N641 PolarHBondContact O-N 3.33Å
642	K	29.1	Very low	27.9	Very low	158 Å²	158	130 Å²	130	69%	0.687	68%	0.677	S	S	*	*			trans	-137.1	140.1	158.2	-76.3	-174.9	177.2	176.4	0	108.8	D640	D640-K642 PolarHBondContact O-N 2.97Å
643	H	29.5	Very low	28.1	Very low	107 Å²	107	129.8 Å²	129.8	50%	0.495	67%	0.667	S	S	.	*			trans	98.5	79.7	-179.2	-61.7	-91.4	0	0	0	115.3	E234 T645	E234-H643 IonicContact OE1-CE1 3.94Å; E234-H643 IonicContact OE1-ND1 2.95Å; E234-H643 IonicContact OE2-CE1 3.39Å; E234-H643 PolarHBondContact OE2-CE1 3.35Å; E234-H643 IonicContact OE2-CG 3.81Å; E234-H643 IonicContact OE2-ND1 3.92Å; E234-H643 PolarHBondContact OE2-ND1 3.35Å; H643-T645 HydrophobicContact CB-CG2 4.1Å; H643-T645 PolarHBondContact O-N 2.91Å
644	E	26.6	Very low	28.2	Very low	114 Å²	114	129 Å²	129	53%	0.533	66%	0.664	S	S	.	*			trans	-64.7	109.6	149.5	-94.3	172.8	146	0	0	107.4	K538	K538-E644 WeakPolarHBondContact CE-OE1 3.24Å; K538-E644 WeakPolarHBondContact CE-OE2 2.87Å; K538-E644 IonicContact NZ-OE1 3.55Å; K538-E644 IonicContact NZ-OE2 2.93Å; K538-E644 PolarHBondContact NZ-OE2 3.46Å
645	T	30.2	Very low	28.4	Very low	43 Å²	43	129.4 Å²	129.4	26%	0.264	66%	0.659	S	S	.	*			trans	-134.5	123.3	170.3	66.5	0	0	0	0	104.8	E234 N235 H643 N647	E234-T645 HydrophobicContact CB-CG2 3.69Å; E234-T645 PolarHBondContact O-OG1 3.14Å; N235-T645 VanDerWaalsContact ND2-C 3.29Å; N235-T645 VanDerWaalsContact ND2-CA 3.29Å; N235-T645 WeakPolarHBondContact ND2-CA 3.38Å; N235-T645 WeakPolarHBondContact ND2-CB 3.47Å; N235-T645 WeakPolarHBondContact OD1-CA 3.38Å; N235-T645 WeakPolarHBondContact OD1-CB 3.38Å; N235-T645 PolarHBondContact OD1-O 2.8Å; N235-T645 PolarHBondContact OD1-OG1 3.04Å; H643-T645 HydrophobicContact CB-CG2 4.1Å; H643-T645 PolarHBondContact O-N 2.91Å; T645-N647 PolarHBondContact O-N 2.88Å
646	L	29.4	Very low	28.8	Very low	135 Å²	135	126.3 Å²	126.3	71%	0.707	65%	0.649	S	S	*	*			trans	-50.2	102.8	170.8	-69.5	154.9	0	0	0	114.8	N235 M648	N235-L646 VanDerWaalsContact CB-O 3.29Å; N235-L646 WeakPolarHBondContact CB-O 3.5Å; N235-L646 PolarHBondContact ND2-N 2.86Å; N235-L646 PolarHBondContact ND2-O 3.16Å; N235-L646 PolarHBondContact OD1-N 2.94Å; N235-L646 PolarHBondContact OD1-O 3.42Å; L646-M648 PolarHBondContact O-N 3.33Å
647	N	28.8	Very low	29.2	Very low	109 Å²	109	126.3 Å²	126.3	58%	0.583	64%	0.644	S	S	*	*			trans	-69.5	95.6	174.4	-158.8	-8.4	0	0	0	111.3	T645 N649	T645-N647 PolarHBondContact O-N 2.88Å; N647-N649 VanDerWaalsContact C-N 3.26Å; N647-N649 PolarHBondContact O-N 2.94Å
648	M	28.4	Very low	29.8	Very low	113 Å²	113	127.2 Å²	127.2	56%	0.557	65%	0.645	S	S	*	*			trans	-85.1	46.6	179.6	-78.7	-80.3	-82.9	0	0	112.4	H236 L646	H236-M648 WeakPolarHBondContact CE1-CB 3.42Å; L646-M648 PolarHBondContact O-N 3.33Å
649	N	27.2	Very low	30.5	Very low	76 Å²	76	126.4 Å²	126.4	41%	0.406	64%	0.638	S	S	.	*			trans	-137	79.1	-178.2	-75.4	-47.1	0	0	0	112.5	N647	N647-N649 VanDerWaalsContact C-N 3.26Å; N647-N649 PolarHBondContact O-N 2.94Å
650	L	28.2	Very low	30.7	Very low	139 Å²	139	123.7 Å²	123.7	73%	0.728	63%	0.629	S	S	*	*			trans	-124.9	76	157.1	-93.4	130	0	0	0	108.7	I652	L650-I652 VanDerWaalsContact C-N 3.27Å; L650-I652 HydrophobicContact CB-CG1 4.29Å; L650-I652 HydrophobicContact CD2-CD1 3.64Å; L650-I652 HydrophobicContact CD2-CG1 3.76Å; L650-I652 PolarHBondContact O-N 3Å
651	F	28.9	Very low	31.2	Very low	215 Å²	215	123.3 Å²	123.3	94%	0.943	63%	0.627	S	S	*	*			trans	-67	91	157.5	-105.9	-92.4	0	0	0	107.4
652	I	31.4	Very low	32.2	Very low	117 Å²	117	124.7 Å²	124.7	60%	0.6	63%	0.627	S	S	*	*			trans	-94.9	123	170.9	-61	179.3	0	0	0	108.2	L650	L650-I652 VanDerWaalsContact C-N 3.27Å; L650-I652 HydrophobicContact CB-CG1 4.29Å; L650-I652 HydrophobicContact CD2-CD1 3.64Å; L650-I652 HydrophobicContact CD2-CG1 3.76Å; L650-I652 PolarHBondContact O-N 3Å
653	N	31.4	Very low	32.9	Very low	108 Å²	108	126.2 Å²	126.2	58%	0.578	63%	0.628	S	S	*	*			trans	-28.7	123.3	173.8	-163.7	-3.5	0	0	0	114.4	F655	N653-F655 PolarHBondContact O-N 2.95Å
654	P	31.2	Very low	33.6	Very low	115 Å²	115	124.9 Å²	124.9	75%	0.747	63%	0.625	S	S	*	*	S	Bend	trans	-68.4	1.9	-176	-16.9	29.9	0	0	0	116
655	F	30.1	Very low	34.9	Very low	173 Å²	173	125.8 Å²	125.8	76%	0.759	63%	0.627	S	S	*	*			trans	-120.6	67.7	-170.3	-66.7	-82	0	0	0	112	N653	N653-F655 PolarHBondContact O-N 2.95Å
656	S	31.7	Very low	36	Very low	87 Å²	87	127.5 Å²	127.5	61%	0.608	64%	0.635	S	S	*	*	S	Bend	trans	-163.6	107.9	171.6	-68.2	0	0	0	0	113.8
657	N	34.4	Very low	37.2	Very low	133 Å²	133	125.5 Å²	125.5	71%	0.711	62%	0.624	S	S	*	*			trans	66.6	123.9	156	-147.3	-22.4	0	0	0	118.7	K659 C660	N657-K659 PolarHBondContact O-N 3.27Å; N657-C660 WeakPolarHBondContact O-CB 3.3Å; N657-C660 PolarHBondContact O-N 2.94Å
658	E	38	Very low	38.5	Very low	174 Å²	174	123.8 Å²	123.8	81%	0.813	61%	0.614	S	S	*	*	H	α-helix	trans	-56.9	-27.2	-172.2	-152.7	179.2	-172	0	0	114.6	L661	E658-L661 PolarHBondContact O-N 2.9Å
659	K	39.9	Very low	39.9	Very low	167 Å²	167	127.4 Å²	127.4	73%	0.726	62%	0.622	S	S	*	*	H	α-helix	trans	-71.4	-25	175.2	-71.8	179.4	179.9	174.8	0	113.8	N657	N657-K659 PolarHBondContact O-N 3.27Å
660	C	34.5	Very low	41.3	Very low	66 Å²	66	130 Å²	130	45%	0.446	63%	0.631	S	S	.	*	H	α-helix	trans	-72.2	-35.1	175.3	-108.8	0	0	0	0	111.6	N657 K662 R663 N664	N657-C660 WeakPolarHBondContact O-CB 3.3Å; N657-C660 PolarHBondContact O-N 2.94Å; C660-K662 VanDerWaalsContact C-N 3.31Å; C660-K662 PolarHBondContact O-N 3.46Å; C660-R663 PolarHBondContact O-N 2.89Å; C660-N664 PolarHBondContact O-N 3.43Å
661	L	38.4	Very low	42.3	Very low	114 Å²	114	128 Å²	128	60%	0.597	62%	0.618	S	S	*	*	H	α-helix	trans	-63.2	-36.4	-179.5	-146.1	82	0	0	0	112.3	E658 K665	E658-L661 PolarHBondContact O-N 2.9Å; L661-K665 PolarHBondContact O-N 2.93Å; L661-K665 VanDerWaalsContact O-N 3.07Å
662	K	49.4	Very low	43.2	Very low	155 Å²	155	120 Å²	120	67%	0.674	59%	0.589	S	S	*	*	H	α-helix	trans	-72	-41.9	178.5	-161.4	142.9	-175.4	175.1	0	112.6	C660 N664 K665 D666	C660-K662 VanDerWaalsContact C-N 3.31Å; C660-K662 PolarHBondContact O-N 3.46Å; K662-N664 PolarHBondContact O-N 3.27Å; K662-K665 PolarHBondContact O-N 3.11Å; K662-D666 PolarHBondContact O-N 3.46Å; K662-D666 VanDerWaalsContact O-N 3.1Å
663	R	44.2	Very low	44.2	Very low	190 Å²	190	123.1 Å²	123.1	72%	0.717	59%	0.594	S	S	*	*	H	α-helix	trans	-62.3	-40.6	172.6	-87.1	-172.4	175	107.9	-2	112.3	C660 D666 L667	C660-R663 PolarHBondContact O-N 2.89Å; R663-D666 PolarHBondContact O-N 3.29Å; R663-L667 WeakPolarHBondContact O-CB 3.49Å; R663-L667 PolarHBondContact O-N 3.35Å
664	N	43	Very low	45.2	Very low	80 Å²	80	123.2 Å²	123.2	43%	0.428	59%	0.594	S	S	.	*	H	α-helix	trans	-64.3	-40.7	176.3	-78.9	-14.8	0	0	0	111.8	C660 K662 D666 L667 I668	C660-N664 PolarHBondContact O-N 3.43Å; K662-N664 PolarHBondContact O-N 3.27Å; N664-D666 PolarHBondContact O-N 3.48Å; N664-L667 PolarHBondContact O-N 3.22Å; N664-I668 WeakPolarHBondContact O-CB 3.32Å; N664-I668 WeakPolarHBondContact O-CD1 3.38Å; N664-I668 WeakPolarHBondContact O-CG1 3.43Å; N664-I668 PolarHBondContact O-N 3.39Å
665	K	55.1	Low	46.2	Very low	132 Å²	132	122.6 Å²	122.6	57%	0.574	58%	0.58	S	S	*	*	H	α-helix	trans	-61.1	-42	174	-82.6	-174.2	174.4	-177.7	0	112.9	L661 K662 R669	L661-K665 PolarHBondContact O-N 2.93Å; L661-K665 VanDerWaalsContact O-N 3.07Å; K662-K665 PolarHBondContact O-N 3.11Å; K665-R669 WeakPolarHBondContact O-CB 3.32Å; K665-R669 PolarHBondContact O-N 3.2Å
666	D	53.4	Low	46.9	Very low	80 Å²	80	117.9 Å²	117.9	43%	0.428	56%	0.562	S	S	.	*	H	α-helix	trans	-69.9	-37.2	178.8	-69.1	-28.3	0	0	0	112.1	K662 R663 N664 R669 Q670	K662-D666 PolarHBondContact O-N 3.46Å; K662-D666 VanDerWaalsContact O-N 3.1Å; R663-D666 PolarHBondContact O-N 3.29Å; N664-D666 PolarHBondContact O-N 3.48Å; D666-R669 PolarHBondContact O-N 3.08Å; D666-Q670 WeakPolarHBondContact O-CG 3.27Å; D666-Q670 PolarHBondContact O-N 3.42Å
667	L	53.9	Low	47.9	Very low	93 Å²	93	118.9 Å²	118.9	49%	0.487	56%	0.557	S	S	.	*	H	α-helix	trans	-66.4	-43.8	176.5	-155.7	81.4	0	0	0	111.6	R663 N664 Q670 Q671	R663-L667 WeakPolarHBondContact O-CB 3.49Å; R663-L667 PolarHBondContact O-N 3.35Å; N664-L667 PolarHBondContact O-N 3.22Å; L667-Q670 PolarHBondContact O-N 3.42Å; L667-Q671 WeakPolarHBondContact O-CG 3.31Å; L667-Q671 PolarHBondContact O-N 3.01Å
668	I	55.2	Low	48.4	Very low	72 Å²	72	118.2 Å²	118.2	37%	0.369	55%	0.55	S	S	.	.	H	α-helix	trans	-62.5	-43.2	175	-68.3	165.9	0	0	0	110.1	N664 Q670 Q671 C672 I730	N664-I668 WeakPolarHBondContact O-CB 3.32Å; N664-I668 WeakPolarHBondContact O-CD1 3.38Å; N664-I668 WeakPolarHBondContact O-CG1 3.43Å; N664-I668 PolarHBondContact O-N 3.39Å; I668-Q670 PolarHBondContact O-N 3.46Å; I668-Q671 PolarHBondContact O-N 2.88Å; I668-C672 WeakPolarHBondContact O-CB 3.21Å; I668-C672 PolarHBondContact O-N 3.33Å; I668-C672 PolarHBondContact O-SG 2.91Å; I668-I730 HydrophobicContact CD1-CD1 4.37Å
669	R	58.3	Low	48.7	Very low	189 Å²	189	112.8 Å²	112.8	71%	0.713	53%	0.526	S	S	*	.	H	α-helix	trans	-59.6	-43.4	174.1	-85.7	-178.3	175	-178	-2.1	112.8	K665 D666 C672 Y673	K665-R669 WeakPolarHBondContact O-CB 3.32Å; K665-R669 PolarHBondContact O-N 3.2Å; D666-R669 PolarHBondContact O-N 3.08Å; R669-C672 PolarHBondContact O-N 2.88Å; R669-Y673 WeakPolarHBondContact O-CB 3.43Å; R669-Y673 PolarHBondContact O-N 3.28Å
670	Q	56.6	Low	48.8	Very low	130 Å²	130	109.7 Å²	109.7	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-64.9	-41.7	177.3	-76.8	-176	6	0	0	112	D666 L667 I668 Y673 L674	D666-Q670 WeakPolarHBondContact O-CG 3.27Å; D666-Q670 PolarHBondContact O-N 3.42Å; L667-Q670 PolarHBondContact O-N 3.42Å; I668-Q670 PolarHBondContact O-N 3.46Å; Q670-Y673 PolarHBondContact O-N 2.96Å; Q670-L674 WeakPolarHBondContact O-CG 3.46Å; Q670-L674 PolarHBondContact O-N 3.27Å
671	Q	48.3	Very low	49.2	Very low	97 Å²	97	110.2 Å²	110.2	45%	0.453	52%	0.515	S	S	.	.	H	α-helix	trans	-64.8	-43.5	176.3	-75.3	178.9	-21.7	0	0	111.9	L667 I668 Y673 L674 F675	L667-Q671 WeakPolarHBondContact O-CG 3.31Å; L667-Q671 PolarHBondContact O-N 3.01Å; I668-Q671 PolarHBondContact O-N 2.88Å; Q671-Y673 VanDerWaalsContact C-N 3.31Å; Q671-Y673 PolarHBondContact O-N 3.19Å; Q671-L674 PolarHBondContact O-N 3.47Å; Q671-F675 WeakPolarHBondContact O-CB 3.35Å; Q671-F675 PolarHBondContact O-N 2.96Å
672	C	49.4	Very low	49.3	Very low	49 Å²	49	110.1 Å²	110.1	33%	0.331	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-35.3	174.7	-71.2	0	0	0	0	112.8	I668 R669 N676	I668-C672 WeakPolarHBondContact O-CB 3.21Å; I668-C672 PolarHBondContact O-N 3.33Å; I668-C672 PolarHBondContact O-SG 2.91Å; R669-C672 PolarHBondContact O-N 2.88Å; C672-N676 WeakPolarHBondContact O-CB 3.4Å; C672-N676 PolarHBondContact O-N 3.02Å; C672-N676 PolarHBondContact O-ND2 2.85Å
673	Y	52.1	Low	48.8	Very low	182 Å²	182	106 Å²	106	71%	0.714	50%	0.498	S	S	*	.	H	α-helix	trans	-69.7	-43.4	176.7	-159.3	-88.8	0	0	0	111.8	R669 Q670 Q671 H677	R669-Y673 WeakPolarHBondContact O-CB 3.43Å; R669-Y673 PolarHBondContact O-N 3.28Å; Q670-Y673 PolarHBondContact O-N 2.96Å; Q671-Y673 VanDerWaalsContact C-N 3.31Å; Q671-Y673 PolarHBondContact O-N 3.19Å; Y673-H677 WeakPolarHBondContact O-CB 3.4Å; Y673-H677 PolarHBondContact O-N 3.39Å
674	L	52.2	Low	48.4	Very low	110 Å²	110	100.6 Å²	100.6	58%	0.576	49%	0.486	S	S	*	.	H	α-helix	trans	-63.7	-41.6	175.9	-77.2	163.7	0	0	0	111.9	Q670 Q671 H677 H678	Q670-L674 WeakPolarHBondContact O-CG 3.46Å; Q670-L674 PolarHBondContact O-N 3.27Å; Q671-L674 PolarHBondContact O-N 3.47Å; L674-H677 PolarHBondContact O-N 3.47Å; L674-H678 PolarHBondContact O-N 3.35Å
675	F	51.2	Low	48.3	Very low	102 Å²	102	101 Å²	101	45%	0.447	49%	0.492	S	S	.	.	H	α-helix	trans	-64.5	-47.2	177.2	-172.5	-105.7	0	0	0	112	Q671 H677 H678 I679	Q671-F675 WeakPolarHBondContact O-CB 3.35Å; Q671-F675 PolarHBondContact O-N 2.96Å; F675-H677 VanDerWaalsContact C-N 3.31Å; F675-H677 PolarHBondContact O-N 3.5Å; F675-H678 PolarHBondContact O-N 3.41Å; F675-H678 VanDerWaalsContact O-N 3.16Å; F675-I679 HydrophobicContact CD1-CD1 3.81Å; F675-I679 HydrophobicContact CE1-CD1 3.29Å; F675-I679 HydrophobicContact CE1-CG1 4.33Å; F675-I679 HydrophobicContact CE2-CD1 4.4Å; F675-I679 HydrophobicContact CZ-CD1 3.64Å; F675-I679 HydrophobicContact CZ-CG1 4.44Å; F675-I679 PolarHBondContact O-N 2.91Å
676	N	46.1	Very low	47.4	Very low	73 Å²	73	99.8 Å²	99.8	39%	0.39	49%	0.491	S	S	.	.	H	α-helix	trans	-63.7	-34.9	175.6	-85	-54.4	0	0	0	112.9	C672 N680	C672-N676 WeakPolarHBondContact O-CB 3.4Å; C672-N676 PolarHBondContact O-N 3.02Å; C672-N676 PolarHBondContact O-ND2 2.85Å; N676-N680 WeakPolarHBondContact O-CB 3.32Å; N676-N680 PolarHBondContact O-N 3.45Å; N676-N680 PolarHBondContact O-ND2 3.42Å; N676-N680 VanDerWaalsContact O-ND2 3.11Å
677	H	52	Low	46.6	Very low	108 Å²	108	101.5 Å²	101.5	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-68.6	-36.9	174.6	-172.8	-94	0	0	0	111.8	Y673 L674 F675 N681	Y673-H677 WeakPolarHBondContact O-CB 3.4Å; Y673-H677 PolarHBondContact O-N 3.39Å; L674-H677 PolarHBondContact O-N 3.47Å; F675-H677 VanDerWaalsContact C-N 3.31Å; F675-H677 PolarHBondContact O-N 3.5Å; H677-N681 PolarHBondContact CE1-ND2 3.12Å; H677-N681 PolarHBondContact ND1-ND2 3.3Å; H677-N681 VanDerWaalsContact ND1-ND2 3.15Å; H677-N681 PolarHBondContact NE2-ND2 3.48Å; H677-N681 PolarHBondContact O-N 3.04Å; H677-N681 VanDerWaalsContact O-N 3.16Å; H677-N681 PolarHBondContact O-ND2 3.48Å
678	H	44.5	Very low	45.8	Very low	119 Å²	119	102.9 Å²	102.9	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-65.7	-45.5	174.4	-102.7	-88.2	0	0	0	112.2	L674 F675 N681 Y682	L674-H678 PolarHBondContact O-N 3.35Å; F675-H678 PolarHBondContact O-N 3.41Å; F675-H678 VanDerWaalsContact O-N 3.16Å; H678-N681 PolarHBondContact O-N 3.28Å; H678-Y682 PolarHBondContact O-N 3.14Å
679	I	45.7	Very low	45.1	Very low	60 Å²	60	105.5 Å²	105.5	31%	0.308	52%	0.523	S	S	.	.	H	α-helix	trans	-62.5	-45.4	177.4	-69.1	179.9	0	0	0	111.4	F675 N681 Y682 C683	F675-I679 HydrophobicContact CD1-CD1 3.81Å; F675-I679 HydrophobicContact CE1-CD1 3.29Å; F675-I679 HydrophobicContact CE1-CG1 4.33Å; F675-I679 HydrophobicContact CE2-CD1 4.4Å; F675-I679 HydrophobicContact CZ-CD1 3.64Å; F675-I679 HydrophobicContact CZ-CG1 4.44Å; F675-I679 PolarHBondContact O-N 2.91Å; I679-N681 VanDerWaalsContact C-N 3.33Å; I679-N681 PolarHBondContact O-N 2.84Å; I679-Y682 PolarHBondContact O-N 2.91Å; I679-C683 PolarHBondContact O-N 3.49Å; I679-C683 PolarHBondContact O-SG 2.93Å; I679-C683 VanDerWaalsContact O-SG 3.34Å
680	N	40.6	Very low	44.1	Very low	103 Å²	103	103.2 Å²	103.2	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-66.6	-32.1	-179.5	-78.1	-40.1	0	0	0	113.3	N676 T684	N676-N680 WeakPolarHBondContact O-CB 3.32Å; N676-N680 PolarHBondContact O-N 3.45Å; N676-N680 PolarHBondContact O-ND2 3.42Å; N676-N680 VanDerWaalsContact O-ND2 3.11Å; N680-T684 WeakPolarHBondContact O-CG2 3.49Å; N680-T684 PolarHBondContact O-N 2.75Å; N680-T684 PolarHBondContact O-OG1 3.07Å
681	N	44.5	Very low	43.2	Very low	76 Å²	76	103.5 Å²	103.5	41%	0.406	53%	0.529	S	S	.	.	H	α-helix	trans	-75.4	-33.4	173.6	-75.4	-59.4	0	0	0	112.5	H677 H678 I679 T684 V685	H677-N681 PolarHBondContact CE1-ND2 3.12Å; H677-N681 PolarHBondContact ND1-ND2 3.3Å; H677-N681 VanDerWaalsContact ND1-ND2 3.15Å; H677-N681 PolarHBondContact NE2-ND2 3.48Å; H677-N681 PolarHBondContact O-N 3.04Å; H677-N681 VanDerWaalsContact O-N 3.16Å; H677-N681 PolarHBondContact O-ND2 3.48Å; H678-N681 PolarHBondContact O-N 3.28Å; I679-N681 VanDerWaalsContact C-N 3.33Å; I679-N681 PolarHBondContact O-N 2.84Å; N681-T684 PolarHBondContact O-OG1 3.38Å; N681-T684 VanDerWaalsContact O-OG1 3.09Å; N681-V685 WeakPolarHBondContact O-CG2 3.11Å; N681-V685 PolarHBondContact O-N 2.82Å
682	Y	39.8	Very low	42.7	Very low	112 Å²	112	106 Å²	106	44%	0.439	55%	0.546	S	S	.	.	H	α-helix	trans	-69.2	-37.4	173.9	-103.5	-88.2	0	0	0	112.7	H678 I679 T684	H678-Y682 PolarHBondContact O-N 3.14Å; I679-Y682 PolarHBondContact O-N 2.91Å; Y682-T684 PolarHBondContact O-N 3.13Å
683	C	37.8	Very low	42	Very low	68 Å²	68	110.7 Å²	110.7	46%	0.459	57%	0.568	S	S	.	*	H	α-helix	trans	-74.1	-22.5	178.6	-66.9	0	0	0	0	114.1	I679	I679-C683 PolarHBondContact O-N 3.49Å; I679-C683 PolarHBondContact O-SG 2.93Å; I679-C683 VanDerWaalsContact O-SG 3.34Å
684	T	37.5	Very low	41.2	Very low	78 Å²	78	109.8 Å²	109.8	48%	0.479	58%	0.575	S	S	.	*	H	α-helix	trans	-83.4	-32.9	178	46.3	0	0	0	0	112.6	N680 N681 Y682	N680-T684 WeakPolarHBondContact O-CG2 3.49Å; N680-T684 PolarHBondContact O-N 2.75Å; N680-T684 PolarHBondContact O-OG1 3.07Å; N681-T684 PolarHBondContact O-OG1 3.38Å; N681-T684 VanDerWaalsContact O-OG1 3.09Å; Y682-T684 PolarHBondContact O-N 3.13Å
685	V	40.1	Very low	40.3	Very low	89 Å²	89	112.1 Å²	112.1	54%	0.539	59%	0.588	S	S	.	*	H	α-helix	trans	-75.3	-29.5	-180	176.4	0	0	0	0	112.8	N681 N689	N681-V685 WeakPolarHBondContact O-CG2 3.11Å; N681-V685 PolarHBondContact O-N 2.82Å; V685-N689 PolarHBondContact O-ND2 3.49Å
686	N	37.1	Very low	39.5	Very low	105 Å²	105	114.5 Å²	114.5	56%	0.561	61%	0.606	S	S	*	*	H	α-helix	trans	-88.2	-15.2	-177.7	-78.2	-17.7	0	0	0	115
687	N	36.1	Very low	39	Very low	116 Å²	116	119 Å²	119	62%	0.62	63%	0.629	S	S	*	*	H	α-helix	trans	-84.2	-26.5	174.3	-89.1	-27.4	0	0	0	113.3
688	D	37.7	Very low	38.2	Very low	122 Å²	122	120.4 Å²	120.4	65%	0.652	64%	0.641	S	S	*	*	H	α-helix	trans	-79	-22.8	-179.3	-73.9	-16.8	0	0	0	113.1
689	N	38.7	Very low	37.8	Very low	127 Å²	127	120.7 Å²	120.7	68%	0.679	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-5.3	-178.3	-72.8	-33.2	0	0	0	114.7	V685	V685-N689 PolarHBondContact O-ND2 3.49Å
690	N	37.4	Very low	37.3	Very low	141 Å²	141	127.7 Å²	127.7	75%	0.754	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	5.6	-176.6	-135.3	-3.4	0	0	0	114.5
691	I	38.9	Very low	37.2	Very low	136 Å²	136	132 Å²	132	70%	0.697	68%	0.683	S	S	*	*	S	Bend	trans	-99.1	-9.7	-178.8	-67	175.4	0	0	0	112.7
692	N	37.7	Very low	36.6	Very low	150 Å²	150	136.3 Å²	136.3	80%	0.802	71%	0.706	S	S	*	*	S	Bend	trans	-108	14.1	-168.6	-101	-8.9	0	0	0	117
693	N	35.1	Very low	36.3	Very low	148 Å²	148	136.3 Å²	136.3	79%	0.791	72%	0.722	S	S	*	*	S	Bend	trans	-131.5	25.8	-170.3	-121.2	5.5	0	0	0	117.4
694	N	35.2	Very low	36.3	Very low	163 Å²	163	139.9 Å²	139.9	87%	0.872	74%	0.735	S	S	*	*			trans	-152.8	72.5	170.1	-95.8	-28.5	0	0	0	112.2
695	N	31.9	Very low	35.9	Very low	158 Å²	158	143.7 Å²	143.7	85%	0.845	75%	0.753	S	S	*	*			trans	-129.4	90.6	165.7	-97.4	-18.3	0	0	0	108.5
696	N	34.4	Very low	35.5	Very low	153 Å²	153	142.8 Å²	142.8	82%	0.818	76%	0.761	S	S	*	*			trans	-177.5	92.1	154.7	-93.9	-20.5	0	0	0	109.4
697	N	35.9	Very low	35.3	Very low	167 Å²	167	146.7 Å²	146.7	89%	0.893	78%	0.778	S	S	*	*			trans	-175.5	138.5	131.7	-92.8	-24.6	0	0	0	112.1
698	N	36.5	Very low	35.1	Very low	138 Å²	138	149 Å²	149	74%	0.738	79%	0.79	S	S	*	*			trans	-91.9	155.4	-157.8	-78.3	-51.3	0	0	0	115.1
699	N	36.4	Very low	34.7	Very low	125 Å²	125	154 Å²	154	67%	0.668	81%	0.806	S	S	*	*			trans	83	113.5	134.8	-77.2	-26	0	0	0	123.2
700	R	34.2	Very low	34.2	Very low	207 Å²	207	151.1 Å²	151.1	78%	0.781	81%	0.806	S	S	*	*				91.5	110.1	121.4	-73.6	179.9	-179.8	-176.8	0.5	121.5
701	K	37.6	Very low	33.6	Very low	193 Å²	193	156.3 Å²	156.3	84%	0.839	82%	0.815	S	S	*	*				84.9	130.5	125.2	-73	-174	174.9	-178.1	0	120.8
702	N	31.8	Very low	33.2	Very low	167 Å²	167	154.8 Å²	154.8	89%	0.893	82%	0.817	S	S	*	*			trans	-69.5	147.1	-173.5	-62.7	-21.3	0	0	0	115.4
703	S	35.3	Very low	32.7	Very low	111 Å²	111	155.2 Å²	155.2	78%	0.776	82%	0.818	S	S	*	*			trans	-154	113	148.6	-161.8	0	0	0	0	111.1
704	I	36.4	Very low	32.5	Very low	143 Å²	143	158.2 Å²	158.2	73%	0.733	82%	0.824	S	S	*	*			trans	40.8	117.3	132.5	-63.4	168.5	0	0	0	120.4
705	D	30.6	Very low	32.3	Very low	159 Å²	159	160.2 Å²	160.2	85%	0.85	83%	0.825	S	S	*	*			trans	46.2	121.6	138.5	-58.4	-32.2	0	0	0	122.8
706	G	31.1	Very low	32.3	Very low	69 Å²	69	156 Å²	156	71%	0.711	82%	0.819	S	S	*	*			trans	168.8	89.1	161.5	0	0	0	0	0	114.7
707	M	32.4	Very low	32.1	Very low	188 Å²	188	156.2 Å²	156.2	93%	0.926	82%	0.82	S	S	*	*			trans	68.9	138.8	144.3	-62.2	171.3	168.8	0	0	120.7
708	N	31.5	Very low	32	Very low	164 Å²	164	157.9 Å²	157.9	88%	0.877	82%	0.819	S	S	*	*			trans	72.3	85.6	167.6	-70.2	-16.6	0	0	0	119	G710	N708-G710 PolarHBondContact O-N 3.22Å; N708-G710 VanDerWaalsContact O-N 3.09Å
709	K	29.6	Very low	31.8	Very low	227 Å²	227	158.9 Å²	158.9	99%	0.987	82%	0.823	S	S	*	*			trans	-79.4	80.8	164.1	-72.7	179.7	178.9	172.5	0	110.7
710	G	28.8	Very low	31.5	Very low	66 Å²	66	162.6 Å²	162.6	68%	0.68	83%	0.827	S	S	*	*			trans	-99.2	132.6	167.2	0	0	0	0	0	111.5	N708	N708-G710 PolarHBondContact O-N 3.22Å; N708-G710 VanDerWaalsContact O-N 3.09Å
711	R	24.9	Very low	31.4	Very low	250 Å²	250	155.4 Å²	155.4	94%	0.943	81%	0.809	S	S	*	*			trans	-27.7	127.4	176.9	-70.1	168.5	178.5	167.4	-1	115.8
712	S	30.1	Very low	31.2	Very low	105 Å²	105	149.9 Å²	149.9	73%	0.734	79%	0.792	S	S	*	*			trans	-150.3	103.8	155.8	-91.1	0	0	0	0	112.8
713	I	27.8	Very low	31.2	Very low	159 Å²	159	143.5 Å²	143.5	82%	0.815	76%	0.763	S	S	*	*				50.5	94.5	126	-51.9	160.4	0	0	0	116.7
714	K	31	Very low	31.2	Very low	211 Å²	211	144.1 Å²	144.1	92%	0.917	76%	0.757	S	S	*	*			trans	-138.3	86.7	142.7	-83.3	-172.5	177.9	178.2	0	108.5
715	K	30.5	Very low	31.1	Very low	204 Å²	204	142.4 Å²	142.4	89%	0.887	75%	0.746	S	S	*	*			trans	-99.4	97.4	163.9	-88	-174.4	174.9	-178.5	0	107.2
716	G	30.8	Very low	31.4	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	73%	0.73	S	S	*	*			trans	-82	127.9	164.1	0	0	0	0	0	108.9	K718	G716-K718 PolarHBondContact O-N 3.1Å
717	N	30.7	Very low	31.7	Very low	157 Å²	157	142.9 Å²	142.9	84%	0.84	73%	0.727	S	S	*	*			trans	-53.3	116.1	-175.7	-67	-23	0	0	0	112.5
718	K	34.8	Very low	32.4	Very low	203 Å²	203	140.6 Å²	140.6	88%	0.883	71%	0.714	S	S	*	*			trans	-95.6	109.7	156.3	-80.1	-175.5	175.7	-176.7	0	106.9	G716	G716-K718 PolarHBondContact O-N 3.1Å
719	I	31.4	Very low	32.9	Very low	158 Å²	158	140.8 Å²	140.8	81%	0.81	71%	0.709	S	S	*	*			trans	-75.5	125.1	172.1	-63.4	171.8	0	0	0	107.3
720	W	30	Very low	33.7	Very low	203 Å²	203	134.9 Å²	134.9	77%	0.769	69%	0.688	S	S	*	*			trans	-73.9	134.2	178.9	-129.1	54.4	0	0	0	109.2
721	C	31.5	Very low	34.5	Very low	57 Å²	57	142.1 Å²	142.1	39%	0.385	70%	0.704	S	S	.	*			trans	-104.8	113.5	-178.7	-154.6	0	0	0	0	109.5	A723	C721-A723 PolarHBondContact O-N 3.39Å
722	P	33.3	Very low	35	Very low	76 Å²	76	136.8 Å²	136.8	49%	0.494	69%	0.692	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.6	-4.4	-177.5	-23.2	33.7	0	0	0	116	L724	P722-L724 VanDerWaalsContact C-N 3.3Å; P722-L724 PolarHBondContact O-N 2.62Å
723	A	33.7	Very low	35.3	Very low	34 Å²	34	138.4 Å²	138.4	28%	0.281	69%	0.689	S	S	.	*	H	α-helix	trans	-70.2	-23.1	-177	0	0	0	0	0	113.8	C721 E727	C721-A723 PolarHBondContact O-N 3.39Å; A723-E727 PolarHBondContact O-N 3.42Å
724	L	34.2	Very low	35.7	Very low	123 Å²	123	137.3 Å²	137.3	64%	0.644	68%	0.682	S	S	*	*	H	α-helix	trans	-78.5	-27.8	-178.5	-131.3	89.4	0	0	0	113.2	P722	P722-L724 VanDerWaalsContact C-N 3.3Å; P722-L724 PolarHBondContact O-N 2.62Å
725	E	34.7	Very low	36	Very low	108 Å²	108	132.9 Å²	132.9	51%	0.505	67%	0.668	S	S	.	*	H	α-helix	trans	-79.8	-34.7	-179.1	-130.3	159.9	-166.8	0	0	110.7	Q728 E729	E725-Q728 PolarHBondContact O-N 2.84Å; E725-E729 PolarHBondContact O-N 3.27Å
726	L	37.2	Very low	36.3	Very low	100 Å²	100	128.5 Å²	128.5	52%	0.524	66%	0.655	S	S	.	*	H	α-helix	trans	-69.6	-32.4	174	-107	140.6	0	0	0	113.4	Q728 I730	L726-Q728 VanDerWaalsContact C-N 3.3Å; L726-I730 HydrophobicContact CD2-CD1 3.92Å; L726-I730 WeakPolarHBondContact O-CB 3.27Å; L726-I730 WeakPolarHBondContact O-CD1 3.46Å; L726-I730 WeakPolarHBondContact O-CG1 3.24Å; L726-I730 PolarHBondContact O-N 3.24Å; L726-I730 VanDerWaalsContact O-N 3.13Å
727	E	37.7	Very low	36.7	Very low	137 Å²	137	132.4 Å²	132.4	64%	0.64	65%	0.65	S	S	*	*	H	α-helix	trans	-71.5	-24.5	171.8	-93.8	-172.3	157.4	0	0	112.7	A723 H731	A723-E727 PolarHBondContact O-N 3.42Å; E727-H731 VanDerWaalsContact O-CB 3.3Å; E727-H731 WeakPolarHBondContact O-CB 3.25Å; E727-H731 PolarHBondContact O-N 3.48Å
728	Q	46.5	Very low	37.1	Very low	141 Å²	141	130.6 Å²	130.6	66%	0.659	64%	0.637	S	S	*	*	H	α-helix	trans	-84	-25.8	174.7	-74.3	-178.4	-9	0	0	113.4	E725 L726	E725-Q728 PolarHBondContact O-N 2.84Å; L726-Q728 VanDerWaalsContact C-N 3.3Å
729	E	41.8	Very low	37.3	Very low	167 Å²	167	125.1 Å²	125.1	78%	0.78	62%	0.618	S	S	*	*	H	α-helix	trans	-84.3	-24.5	173.7	-96.5	-176.2	152.9	0	0	113.9	E725	E725-E729 PolarHBondContact O-N 3.27Å
730	I	46.2	Very low	37.8	Very low	104 Å²	104	122.3 Å²	122.3	53%	0.533	60%	0.602	S	S	.	*	H	α-helix	trans	-86	-24	178.1	-69.2	171.3	0	0	0	112.4	I668 L726	I668-I730 HydrophobicContact CD1-CD1 4.37Å; L726-I730 HydrophobicContact CD2-CD1 3.92Å; L726-I730 WeakPolarHBondContact O-CB 3.27Å; L726-I730 WeakPolarHBondContact O-CD1 3.46Å; L726-I730 WeakPolarHBondContact O-CG1 3.24Å; L726-I730 PolarHBondContact O-N 3.24Å; L726-I730 VanDerWaalsContact O-N 3.13Å
731	H	46.6	Very low	38.5	Very low	218 Å²	218	115 Å²	115	100%	1.009	59%	0.587	S	S	*	*			trans	-90.2	0	179.9	-157.2	-46.1	0	0	0	111.7	E727	E727-H731 VanDerWaalsContact O-CB 3.3Å; E727-H731 WeakPolarHBondContact O-CB 3.25Å; E727-H731 PolarHBondContact O-N 3.48Å

Retrieved 731 of 731 residues in 599.8 ms (Link to these results)

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