A0A5K4F915_SCHMA Loading...

Annexin

AlphaFold DB , UniProt , Accession A0A5K4F915, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 334 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	31.3	Very low	34	Very low	231 Å²	231	139.5 Å²	139.5	100%	1.138	74%	0.741	S	S	*	*				0	99.9	0	-61.4	174.5	177.5	0	0	104.7
2	N	34	Very low	34.5	Very low	157 Å²	157	130.3 Å²	130.3	84%	0.84	71%	0.705	S	S	*	*				56.8	134.3	81.8	-63.5	32.4	0	0	0	111.3
3	S	32.3	Very low	34.5	Very low	103 Å²	103	127.5 Å²	127.5	72%	0.72	69%	0.688	S	S	*	*			cis	-177.3	151.9	-10.5	44.4	0	0	0	0	106.8
4	T	32.5	Very low	34.8	Very low	115 Å²	115	125.1 Å²	125.1	71%	0.706	67%	0.673	S	S	*	*			cis	-150.2	172.2	9.6	-25.8	0	0	0	0	109.2
5	T	30.8	Very low	35.1	Very low	109 Å²	109	122.1 Å²	122.1	67%	0.669	67%	0.665	S	S	*	*			trans	-115.8	109.9	155.1	-49.2	0	0	0	0	108.1	Y7	T5-Y7 WeakPolarHBondContact O-CD2 3.39Å; T5-Y7 PolarHBondContact O-N 2.86Å
6	D	33.4	Very low	35.1	Very low	147 Å²	147	122.9 Å²	122.9	79%	0.786	67%	0.668	S	S	*	*			trans	-73.4	110.5	178.7	-70.2	-31.6	0	0	0	110.1
7	Y	32.7	Very low	35.3	Very low	204 Å²	204	119.2 Å²	119.2	80%	0.8	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-78.8	120.1	172	-76.5	-94.1	0	0	0	109.5	T5 T9	T5-Y7 WeakPolarHBondContact O-CD2 3.39Å; T5-Y7 PolarHBondContact O-N 2.86Å; Y7-T9 PolarHBondContact O-N 3.22Å
8	I	35.4	Very low	35.3	Very low	138 Å²	138	121.8 Å²	121.8	71%	0.708	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-64	117.8	168.1	-60.3	176.3	0	0	0	107.6	I13	I8-I13 HydrophobicContact CG2-CD1 4.31Å; I8-I13 HydrophobicContact CG2-CG1 3.83Å
9	T	35.8	Very low	35.5	Very low	94 Å²	94	123.2 Å²	123.2	58%	0.577	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-70.4	151.6	179.2	53.2	0	0	0	0	111.4	Y7 E11 G12 I13	Y7-T9 PolarHBondContact O-N 3.22Å; T9-E11 PolarHBondContact O-N 3.03Å; T9-G12 PolarHBondContact O-N 3.43Å; T9-I13 PolarHBondContact O-N 3.37Å
10	T	35.5	Very low	35.4	Very low	74 Å²	74	122.7 Å²	122.7	45%	0.454	66%	0.664	S	S	.	*	H	α-helix	trans	-55	-37.3	179.9	-48.1	0	0	0	0	112.7	G12 I13 I14 Y31	T10-G12 VanDerWaalsContact C-N 3.33Å; T10-G12 PolarHBondContact O-N 2.95Å; T10-I13 PolarHBondContact O-N 3.27Å; T10-I14 HydrophobicContact CG2-CD1 4.3Å; T10-I14 WeakPolarHBondContact O-CG1 3.28Å; T10-I14 PolarHBondContact O-N 2.58Å; T10-Y31 WeakPolarHBondContact CG2-OH 3.35Å
11	E	40.5	Very low	35.1	Very low	162 Å²	162	123.5 Å²	123.5	76%	0.757	67%	0.673	S	S	*	*	H	α-helix	trans	-62.6	-36.3	175.2	-66.1	-171.4	146	0	0	113.2	T9 I13 I14 S15	T9-E11 PolarHBondContact O-N 3.03Å; E11-I13 VanDerWaalsContact C-N 3.26Å; E11-I13 PolarHBondContact O-N 3.27Å; E11-I14 PolarHBondContact O-N 2.81Å; E11-S15 PolarHBondContact O-N 3.27Å
12	G	40	Very low	35.2	Very low	30 Å²	30	119.8 Å²	119.8	31%	0.309	65%	0.653	S	S	.	*	H	α-helix	trans	-63.1	-33.7	176.7	0	0	0	0	0	112.6	T9 T10 S15	T9-G12 PolarHBondContact O-N 3.43Å; T10-G12 VanDerWaalsContact C-N 3.33Å; T10-G12 PolarHBondContact O-N 2.95Å; G12-S15 PolarHBondContact O-OG 2.86Å; G12-S15 VanDerWaalsContact O-OG 3.09Å
13	I	34.7	Very low	35.1	Very low	93 Å²	93	117.5 Å²	117.5	48%	0.477	65%	0.646	S	S	.	*	H	α-helix	trans	-75.3	-39.7	178.4	-59.9	177	0	0	0	110.9	I8 T9 T10 E11 S15 L16	I8-I13 HydrophobicContact CG2-CD1 4.31Å; I8-I13 HydrophobicContact CG2-CG1 3.83Å; T9-I13 PolarHBondContact O-N 3.37Å; T10-I13 PolarHBondContact O-N 3.27Å; E11-I13 VanDerWaalsContact C-N 3.26Å; E11-I13 PolarHBondContact O-N 3.27Å; I13-S15 VanDerWaalsContact C-N 3.33Å; I13-S15 PolarHBondContact O-N 2.88Å; I13-L16 PolarHBondContact O-N 3.15Å; I13-L16 VanDerWaalsContact O-N 3.15Å
14	I	38.1	Very low	35.2	Very low	95 Å²	95	121.1 Å²	121.1	49%	0.487	65%	0.654	S	S	.	*	H	α-helix	trans	-58.5	-44.2	-178.9	-69.5	165.7	0	0	0	111.1	T10 E11 L16 T17	T10-I14 HydrophobicContact CG2-CD1 4.3Å; T10-I14 WeakPolarHBondContact O-CG1 3.28Å; T10-I14 PolarHBondContact O-N 2.58Å; E11-I14 PolarHBondContact O-N 2.81Å; I14-L16 PolarHBondContact O-N 3.16Å; I14-L16 VanDerWaalsContact O-N 3.1Å; I14-T17 PolarHBondContact O-N 3.06Å; I14-T17 PolarHBondContact O-OG1 3.5Å
15	S	38.9	Very low	35.3	Very low	79 Å²	79	122.1 Å²	122.1	55%	0.552	66%	0.655	S	S	*	*	H	α-helix	trans	-62.6	-19.2	-179.9	70.4	0	0	0	0	115.3	E11 G12 I13	E11-S15 PolarHBondContact O-N 3.27Å; G12-S15 PolarHBondContact O-OG 2.86Å; G12-S15 VanDerWaalsContact O-OG 3.09Å; I13-S15 VanDerWaalsContact C-N 3.33Å; I13-S15 PolarHBondContact O-N 2.88Å
16	L	36.2	Very low	35.6	Very low	135 Å²	135	120.7 Å²	120.7	71%	0.707	65%	0.645	S	S	*	*	H	α-helix	trans	-88.3	-13.9	177.6	-68.2	170.5	0	0	0	113.2	I13 I14	I13-L16 PolarHBondContact O-N 3.15Å; I13-L16 VanDerWaalsContact O-N 3.15Å; I14-L16 PolarHBondContact O-N 3.16Å; I14-L16 VanDerWaalsContact O-N 3.1Å
17	T	38.2	Very low	35.7	Very low	60 Å²	60	118.3 Å²	118.3	37%	0.368	64%	0.636	S	S	.	*	H	α-helix	trans	-91.6	-19.5	-172.1	52.7	0	0	0	0	115.1	I14 I19 V20	I14-T17 PolarHBondContact O-N 3.06Å; I14-T17 PolarHBondContact O-OG1 3.5Å; T17-I19 PolarHBondContact O-N 3.11Å; T17-I19 VanDerWaalsContact O-N 3.09Å; T17-V20 PolarHBondContact O-N 3.1Å
18	E	35.6	Very low	35.9	Very low	167 Å²	167	116.3 Å²	116.3	78%	0.78	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-7.2	-173.5	-64.2	-169.5	138.5	0	0	115.2
19	I	38.4	Very low	36.1	Very low	147 Å²	147	112.7 Å²	112.7	75%	0.754	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-7.4	-175.1	-53.7	-179.5	0	0	0	112.4	T17 T21	T17-I19 PolarHBondContact O-N 3.11Å; T17-I19 VanDerWaalsContact O-N 3.09Å; I19-T21 PolarHBondContact O-N 3.43Å
20	V	33	Very low	36	Very low	113 Å²	113	112.9 Å²	112.9	69%	0.685	61%	0.613	S	S	*	*			trans	-93.2	84.6	-171.1	-170.6	0	0	0	0	112.9	T17 H22	T17-V20 PolarHBondContact O-N 3.1Å; V20-H22 PolarHBondContact O-N 3.43Å; V20-H22 VanDerWaalsContact O-N 3.15Å
21	T	30	Very low	35.9	Very low	141 Å²	141	117.1 Å²	117.1	87%	0.865	62%	0.621	S	S	*	*			trans	-82.6	77.4	167.5	43.7	0	0	0	0	111.8	I19	I19-T21 PolarHBondContact O-N 3.43Å
22	H	33.8	Very low	35.6	Very low	152 Å²	152	119.3 Å²	119.3	70%	0.704	62%	0.623	S	S	*	*			trans	-138.8	122.4	167.5	-152.2	-66.7	0	0	0	111.5	V20 M24	V20-H22 PolarHBondContact O-N 3.43Å; V20-H22 VanDerWaalsContact O-N 3.15Å; H22-M24 PolarHBondContact O-N 2.95Å
23	P	31.5	Very low	35.5	Very low	109 Å²	109	124.7 Å²	124.7	71%	0.708	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	119.7	178.8	29.2	-32.9	0	0	0	109.8
24	M	33.9	Very low	35.4	Very low	180 Å²	180	123.2 Å²	123.2	89%	0.887	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	167.1	-7.6	150.3	-95.5	-73.2	161.7	0	0	114.8	H22	H22-M24 PolarHBondContact O-N 2.95Å
25	L	35.9	Very low	35.3	Very low	136 Å²	136	125.4 Å²	125.4	71%	0.712	66%	0.664	S	S	*	*			trans	-129.4	129.3	177.6	-71.3	169.4	0	0	0	110.8	D29	L25-D29 HydrophobicContact CD2-CB 4.24Å
26	T	37	Very low	35.1	Very low	78 Å²	78	130 Å²	130	48%	0.479	68%	0.676	S	S	.	*			trans	-86.1	158.8	170.8	70.2	0	0	0	0	110.4	E28 D29 I30	T26-E28 PolarHBondContact O-N 2.93Å; T26-D29 WeakPolarHBondContact CB-OD2 3.14Å; T26-D29 PolarHBondContact N-OD2 3.4Å; T26-D29 WeakPolarHBondContact O-CB 3.48Å; T26-D29 PolarHBondContact O-N 3.48Å; T26-D29 VanDerWaalsContact OG1-CG 3.24Å; T26-D29 PolarHBondContact OG1-N 3.4Å; T26-D29 PolarHBondContact OG1-OD2 3.49Å; T26-I30 PolarHBondContact O-N 3.21Å
27	V	34.9	Very low	35.1	Very low	98 Å²	98	127.7 Å²	127.7	59%	0.594	67%	0.668	S	S	*	*	H	α-helix	trans	-60.8	-27.3	174.5	178.6	0	0	0	0	111.5	I30 Y31	V27-I30 PolarHBondContact O-N 3.12Å; V27-Y31 PolarHBondContact O-N 3.16Å; V27-Y31 VanDerWaalsContact O-N 3.1Å
28	E	37.5	Very low	34.9	Very low	161 Å²	161	132.9 Å²	132.9	75%	0.752	69%	0.685	S	S	*	*	H	α-helix	trans	-72.7	-34.1	178.3	-158.1	161.4	-159.7	0	0	112.3	T26 I30 Y31 R32	T26-E28 PolarHBondContact O-N 2.93Å; E28-I30 VanDerWaalsContact C-N 3.31Å; E28-I30 PolarHBondContact O-N 2.98Å; E28-Y31 PolarHBondContact O-N 2.88Å; E28-R32 PolarHBondContact O-N 2.82Å; E28-R32 VanDerWaalsContact O-N 3.14Å
29	D	38.1	Very low	35	Very low	62 Å²	62	131.3 Å²	131.3	33%	0.332	68%	0.678	S	S	.	*	H	α-helix	trans	-63	-38.2	170.6	-61.5	-59.1	0	0	0	111.7	L25 T26 I33	L25-D29 HydrophobicContact CD2-CB 4.24Å; T26-D29 WeakPolarHBondContact CB-OD2 3.14Å; T26-D29 PolarHBondContact N-OD2 3.4Å; T26-D29 WeakPolarHBondContact O-CB 3.48Å; T26-D29 PolarHBondContact O-N 3.48Å; T26-D29 VanDerWaalsContact OG1-CG 3.24Å; T26-D29 PolarHBondContact OG1-N 3.4Å; T26-D29 PolarHBondContact OG1-OD2 3.49Å; D29-I33 VanDerWaalsContact O-CD1 3.27Å; D29-I33 WeakPolarHBondContact O-CD1 3.48Å; D29-I33 VanDerWaalsContact O-CG1 3.31Å; D29-I33 WeakPolarHBondContact O-CG1 3.23Å
30	I	34.5	Very low	34.8	Very low	98 Å²	98	127.8 Å²	127.8	50%	0.503	66%	0.663	S	S	.	*	H	α-helix	trans	-67.8	-41	177.5	-61.4	172.4	0	0	0	110.4	T26 V27 E28 R32 I33	T26-I30 PolarHBondContact O-N 3.21Å; V27-I30 PolarHBondContact O-N 3.12Å; E28-I30 VanDerWaalsContact C-N 3.31Å; E28-I30 PolarHBondContact O-N 2.98Å; I30-R32 PolarHBondContact O-N 3.48Å; I30-I33 PolarHBondContact O-N 3.07Å
31	Y	33	Very low	34.8	Very low	163 Å²	163	126.3 Å²	126.3	64%	0.639	66%	0.655	S	S	*	*	H	α-helix	trans	-67.2	-34.7	-179.6	-124.1	-89.6	0	0	0	113.2	T10 V27 E28 I33	T10-Y31 WeakPolarHBondContact CG2-OH 3.35Å; V27-Y31 PolarHBondContact O-N 3.16Å; V27-Y31 VanDerWaalsContact O-N 3.1Å; E28-Y31 PolarHBondContact O-N 2.88Å; Y31-I33 VanDerWaalsContact C-N 3.29Å; Y31-I33 PolarHBondContact O-N 3.28Å
32	R	34.5	Very low	35	Very low	209 Å²	209	122.3 Å²	122.3	79%	0.789	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-8.4	-177.3	-146.2	177.4	76.7	-154.8	1.8	114.7	E28 I30	E28-R32 PolarHBondContact O-N 2.82Å; E28-R32 VanDerWaalsContact O-N 3.14Å; I30-R32 PolarHBondContact O-N 3.48Å
33	I	37.3	Very low	35.1	Very low	142 Å²	142	122.3 Å²	122.3	73%	0.728	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-15.4	179.9	-69.7	167.1	0	0	0	112	D29 I30 Y31	D29-I33 VanDerWaalsContact O-CD1 3.27Å; D29-I33 WeakPolarHBondContact O-CD1 3.48Å; D29-I33 VanDerWaalsContact O-CG1 3.31Å; D29-I33 WeakPolarHBondContact O-CG1 3.23Å; I30-I33 PolarHBondContact O-N 3.07Å; Y31-I33 VanDerWaalsContact C-N 3.29Å; Y31-I33 PolarHBondContact O-N 3.28Å
34	G	32.2	Very low	35.2	Very low	62 Å²	62	122.4 Å²	122.4	64%	0.639	62%	0.619	S	S	*	*	S	Bend	trans	-77.3	-25.9	-169.9	0	0	0	0	0	117.3
35	N	36.9	Very low	35.2	Very low	142 Å²	142	117.8 Å²	117.8	76%	0.759	60%	0.597	S	S	*	*	S	Bend	trans	-128.3	117.9	-171.7	-86.3	-16.4	0	0	0	112.9
36	E	34.3	Very low	35.2	Very low	175 Å²	175	118.6 Å²	118.6	82%	0.818	60%	0.597	S	S	*	*	S	Bend	trans	73.1	120.7	156.2	-55.1	-178	-179.3	0	0	119.8
37	T	36.9	Very low	35	Very low	86 Å²	86	118.9 Å²	118.9	53%	0.528	60%	0.602	S	S	.	*			trans	65.5	71.6	159.6	67.2	0	0	0	0	119.5	Q39 T40	T37-Q39 PolarHBondContact O-N 2.92Å; T37-T40 VanDerWaalsContact CB-OG1 3.22Å; T37-T40 WeakPolarHBondContact CB-OG1 3.33Å; T37-T40 PolarHBondContact O-N 3.38Å; T37-T40 WeakPolarHBondContact OG1-CB 3.45Å; T37-T40 PolarHBondContact OG1-OG1 3.1Å
38	K	33.8	Very low	34.8	Very low	169 Å²	169	123.6 Å²	123.6	74%	0.735	61%	0.611	S	S	*	*	H	α-helix	trans	-45.8	-27.3	160.3	-150.5	172.9	-172.5	178.5	0	114.4	L42	K38-L42 WeakPolarHBondContact O-CD1 3.3Å
39	Q	37.7	Very low	34.5	Very low	134 Å²	134	122.2 Å²	122.2	63%	0.626	61%	0.609	S	S	*	*	H	α-helix	trans	-75.5	-29	177.6	-70.6	-70.4	-13.2	0	0	114.6	T37	T37-Q39 PolarHBondContact O-N 2.92Å
40	T	35	Very low	34.2	Very low	73 Å²	73	127.9 Å²	127.9	45%	0.448	63%	0.63	S	S	.	*	H	α-helix	trans	-77.5	-43.5	-176.5	-51.1	0	0	0	0	110.6	T37 L42 K43 I44	T37-T40 VanDerWaalsContact CB-OG1 3.22Å; T37-T40 WeakPolarHBondContact CB-OG1 3.33Å; T37-T40 PolarHBondContact O-N 3.38Å; T37-T40 WeakPolarHBondContact OG1-CB 3.45Å; T37-T40 PolarHBondContact OG1-OG1 3.1Å; T40-L42 VanDerWaalsContact C-N 3.31Å; T40-L42 PolarHBondContact O-N 2.94Å; T40-K43 PolarHBondContact O-N 2.99Å; T40-I44 PolarHBondContact O-N 3.32Å
41	T	32.4	Very low	34	Very low	82 Å²	82	132.6 Å²	132.6	50%	0.503	65%	0.65	S	S	.	*	H	α-helix	trans	-61.3	-37.6	175.7	-49.6	0	0	0	0	112.2	K43 I44 I45	T41-K43 PolarHBondContact O-N 3.1Å; T41-I44 PolarHBondContact O-N 2.72Å; T41-I45 HydrophobicContact CG2-CD1 3.89Å; T41-I45 WeakPolarHBondContact O-CG1 3.37Å; T41-I45 PolarHBondContact O-N 3.35Å
42	L	34.3	Very low	34	Very low	58 Å²	58	131.9 Å²	131.9	30%	0.304	66%	0.656	S	S	.	*	H	α-helix	trans	-60.6	-42.6	176.3	-88	165.6	0	0	0	112.9	K38 T40 I44 I45 Q46	K38-L42 WeakPolarHBondContact O-CD1 3.3Å; T40-L42 VanDerWaalsContact C-N 3.31Å; T40-L42 PolarHBondContact O-N 2.94Å; L42-I44 VanDerWaalsContact C-N 3.34Å; L42-I44 PolarHBondContact O-N 3.5Å; L42-I45 PolarHBondContact O-N 2.91Å; L42-Q46 VanDerWaalsContact O-CG 3.3Å; L42-Q46 WeakPolarHBondContact O-CG 3.24Å; L42-Q46 PolarHBondContact O-N 2.87Å; L42-Q46 VanDerWaalsContact O-N 3.12Å
43	K	35.2	Very low	33.8	Very low	152 Å²	152	127.3 Å²	127.3	66%	0.661	65%	0.653	S	S	*	*	H	α-helix	trans	-67.3	-32	-178.7	-72.1	-178	177.6	-178.2	0	113.7	T40 T41	T40-K43 PolarHBondContact O-N 2.99Å; T41-K43 PolarHBondContact O-N 3.1Å
44	I	34.7	Very low	33.5	Very low	110 Å²	110	126.7 Å²	126.7	56%	0.564	66%	0.656	S	S	*	*	H	α-helix	trans	-77.7	-37.2	179	-64.5	171.2	0	0	0	110.6	T40 T41 L42 Q46 S47	T40-I44 PolarHBondContact O-N 3.32Å; T41-I44 PolarHBondContact O-N 2.72Å; L42-I44 VanDerWaalsContact C-N 3.34Å; L42-I44 PolarHBondContact O-N 3.5Å; I44-Q46 VanDerWaalsContact C-N 3.33Å; I44-Q46 PolarHBondContact O-N 3.07Å; I44-S47 PolarHBondContact O-N 2.81Å; I44-S47 PolarHBondContact O-OG 3Å
45	I	33.5	Very low	33.5	Very low	83 Å²	83	131.1 Å²	131.1	43%	0.426	66%	0.658	S	S	.	*	H	α-helix	trans	-68.2	-33.6	176.7	-67.6	170.9	0	0	0	111.4	T41 L42 S47 A82	T41-I45 HydrophobicContact CG2-CD1 3.89Å; T41-I45 WeakPolarHBondContact O-CG1 3.37Å; T41-I45 PolarHBondContact O-N 3.35Å; L42-I45 PolarHBondContact O-N 2.91Å; I45-S47 PolarHBondContact O-N 3.29Å; I45-A82 HydrophobicContact CD1-CB 4.21Å; I45-A82 HydrophobicContact CG2-CB 4.19Å
46	Q	36.3	Very low	33.2	Very low	154 Å²	154	129.1 Å²	129.1	72%	0.72	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-9.7	178.4	-76.7	173.9	-23	0	0	115.1	L42 I44	L42-Q46 VanDerWaalsContact O-CG 3.3Å; L42-Q46 WeakPolarHBondContact O-CG 3.24Å; L42-Q46 PolarHBondContact O-N 2.87Å; L42-Q46 VanDerWaalsContact O-N 3.12Å; I44-Q46 VanDerWaalsContact C-N 3.33Å; I44-Q46 PolarHBondContact O-N 3.07Å
47	S	33	Very low	33.2	Very low	83 Å²	83	123.9 Å²	123.9	58%	0.58	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-5.2	-178.7	65.2	0	0	0	0	114.8	I44 I45	I44-S47 PolarHBondContact O-N 2.81Å; I44-S47 PolarHBondContact O-OG 3Å; I45-S47 PolarHBondContact O-N 3.29Å
48	Y	30.8	Very low	33	Very low	197 Å²	197	122.2 Å²	122.2	77%	0.773	61%	0.611	S	S	*	*	S	Bend	trans	-126.6	134.8	-179.1	-75	-91	0	0	0	113.4
49	D	31.3	Very low	33.5	Very low	133 Å²	133	116.4 Å²	116.4	71%	0.711	59%	0.591	S	S	*	*	S	Bend	trans	76.6	101.6	167.8	-112.9	-19.1	0	0	0	120.5
50	K	31.5	Very low	33.7	Very low	180 Å²	180	110.5 Å²	110.5	78%	0.783	56%	0.564	S	S	*	*			trans	45.7	119	139.1	-69.8	171.9	-167.7	143.6	0	120.4	I52	K50-I52 PolarHBondContact O-N 3.33Å; K50-I52 VanDerWaalsContact O-N 3.1Å
51	Q	29.6	Very low	34.1	Very low	198 Å²	198	108.9 Å²	108.9	93%	0.925	55%	0.552	S	S	*	*			trans	-45	107.9	164.7	-62.6	169.1	-3.2	0	0	113.1
52	I	33.2	Very low	34.7	Very low	148 Å²	148	106.3 Å²	106.3	76%	0.759	53%	0.534	S	S	*	.			trans	-101.7	132.4	152.6	-59.7	176.2	0	0	0	105.9	K50 T54	K50-I52 PolarHBondContact O-N 3.33Å; K50-I52 VanDerWaalsContact O-N 3.1Å; I52-T54 PolarHBondContact O-N 2.75Å; I52-T54 VanDerWaalsContact O-N 3.16Å
53	P	29.9	Very low	34.9	Very low	112 Å²	112	105 Å²	105	73%	0.727	53%	0.528	S	S	*	.			trans	-58.7	121.8	177.4	-23.5	33.6	0	0	0	111.1	F55	P53-F55 PolarHBondContact O-N 2.75Å
54	T	31	Very low	35.4	Very low	130 Å²	130	99.4 Å²	99.4	80%	0.798	51%	0.505	S	S	*	.			trans	-65.1	98.8	168.3	26.3	0	0	0	0	109.1	I52 I56	I52-T54 PolarHBondContact O-N 2.75Å; I52-T54 VanDerWaalsContact O-N 3.16Å; T54-I56 VanDerWaalsContact C-N 3.29Å; T54-I56 PolarHBondContact O-N 3.39Å
55	F	31.7	Very low	35.5	Very low	155 Å²	155	98.2 Å²	98.2	68%	0.68	50%	0.499	S	S	*	.			trans	-70.9	89.8	166.8	-118.9	-78.5	0	0	0	108.8	P53 R57	P53-F55 PolarHBondContact O-N 2.75Å; F55-R57 PolarHBondContact O-N 2.99Å; F55-R57 VanDerWaalsContact O-N 3.09Å
56	I	30.8	Very low	35.9	Very low	100 Å²	100	101.3 Å²	101.3	51%	0.513	51%	0.512	S	S	.	.			trans	-63.8	109.3	167.1	-60.9	179.4	0	0	0	107.2	T54 S58 I74	T54-I56 VanDerWaalsContact C-N 3.29Å; T54-I56 PolarHBondContact O-N 3.39Å; I56-S58 PolarHBondContact O-N 3.41Å; I56-S58 VanDerWaalsContact O-N 3.07Å; I56-I74 HydrophobicContact CD1-CG2 3.91Å
57	R	35	Very low	35.8	Very low	64 Å²	64	96.2 Å²	96.2	24%	0.242	50%	0.5	C	S	.	.			trans	-83.1	64	173	-86.7	-160.2	178.2	152.3	15	112.2	F55 D115 W117 E120 V288	F55-R57 PolarHBondContact O-N 2.99Å; F55-R57 VanDerWaalsContact O-N 3.09Å; R57-D115 PolarHBondContact NH1-O 2.84Å; R57-W117 VanDerWaalsContact CZ-CD1 3.43Å; R57-W117 PolarHBondContact NH2-O 2.92Å; R57-E120 IonicContact CZ-OE1 3.14Å; R57-E120 IonicContact CZ-OE2 3.7Å; R57-E120 VanDerWaalsContact NH1-CD 3.34Å; R57-E120 IonicContact NH1-OE1 2.68Å; R57-E120 PolarHBondContact NH1-OE1 2.52Å; R57-E120 IonicContact NH1-OE2 2.8Å; R57-E120 PolarHBondContact NH1-OE2 2.67Å; R57-E120 IonicContact NH2-OE1 2.75Å; R57-E120 PolarHBondContact NH2-OE1 3.4Å; R57-E120 IonicContact NH2-OE2 3.98Å; R57-E120 PolarHBondContact NH2-OE2 3.01Å; R57-V288 HydrophobicContact CB-CG1 4.27Å; R57-V288 WeakPolarHBondContact O-CG1 3.45Å
58	S	33.5	Very low	36.3	Very low	52 Å²	52	96.4 Å²	96.4	36%	0.364	50%	0.495	S	S	.	.			trans	-132.6	95.8	162.5	-167.3	0	0	0	0	110.9	I56	I56-S58 PolarHBondContact O-N 3.41Å; I56-S58 VanDerWaalsContact O-N 3.07Å
59	P	42.6	Very low	36.8	Very low	46 Å²	46	90.4 Å²	90.4	30%	0.299	48%	0.478	S	S	.	.			trans	-123.7	-2.6	176.4	39.8	-29	0	0	0	114.4	F213	P59-F213 HydrophobicContact CB-CE1 3.63Å; P59-F213 HydrophobicContact CB-CZ 3.58Å; P59-F213 HydrophobicContact CG-CE1 3.64Å; P59-F213 HydrophobicContact CG-CZ 3.47Å; P59-F213 VanDerWaalsContact CG-CZ 3.47Å; P59-F213 WeakPolarHBondContact O-CE1 3.4Å
60	L	43.1	Very low	37.5	Very low	11 Å²	11	86.9 Å²	86.9	6%	0.058	46%	0.46	C	S	.	.			trans	-92.9	135.8	178.6	-66.6	173.8	0	0	0	109.4	P212 F213 E216 Y252 S253 K256	L60-P212 HydrophobicContact CD1-CB 4.1Å; L60-P212 HydrophobicContact CD2-CB 3.84Å; L60-F213 HydrophobicContact CD2-CD1 3.41Å; L60-F213 VanDerWaalsContact CD2-CD1 3.41Å; L60-F213 HydrophobicContact CD2-CE1 3.47Å; L60-F213 VanDerWaalsContact CD2-CE1 3.47Å; L60-F213 HydrophobicContact CG-CD1 4.49Å; L60-F213 HydrophobicContact CG-CE1 4.09Å; L60-E216 WeakPolarHBondContact CD2-OE2 3.45Å; L60-Y252 HydrophobicContact CD1-CE1 4.44Å; L60-Y252 VanDerWaalsContact CD1-O 3.24Å; L60-Y252 WeakPolarHBondContact CD1-O 3.26Å; L60-S253 WeakPolarHBondContact CD2-O 3.42Å; L60-K256 HydrophobicContact CD1-CB 4.13Å
61	N	44	Very low	37.9	Very low	39 Å²	39	84.4 Å²	84.4	21%	0.209	45%	0.451	C	S	.	.			trans	-64.4	153.3	161.9	-52	-64.9	0	0	0	108.1	V69 N70 Q71 E216	N61-V69 HydrophobicContact CB-CG1 3.5Å; N61-N70 WeakPolarHBondContact CA-O 3.39Å; N61-Q71 WeakPolarHBondContact OD1-CA 3.42Å; N61-E216 WeakPolarHBondContact CB-OE1 3.29Å; N61-E216 PolarHBondContact ND2-OE1 3.17Å
62	H	44.8	Very low	38.5	Very low	27 Å²	27	77.3 Å²	77.3	13%	0.125	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	143.8	170.4	64.8	-77.2	0	0	0	108.7	N70 P257	H62-N70 WeakPolarHBondContact CE1-CB 3.38Å; H62-N70 PolarHBondContact N-O 3.04Å; H62-N70 VanDerWaalsContact N-O 3.1Å; H62-N70 PolarHBondContact ND1-O 3.39Å; H62-N70 WeakPolarHBondContact NE2-CB 3.37Å; H62-N70 PolarHBondContact O-N 3.13Å; H62-P257 HydrophobicContact CB-CG 4.2Å
63	I	37.8	Very low	38.6	Very low	32 Å²	32	79.4 Å²	79.4	16%	0.164	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.2	175.2	-53	-172.9	0	0	0	107.3	G67 N68 V69 V254 N255	I63-G67 VanDerWaalsContact CG2-C 3.5Å; I63-N68 WeakPolarHBondContact CA-O 3.32Å; I63-V69 HydrophobicContact CD1-CG2 4.5Å; I63-V69 HydrophobicContact CG1-CG2 4.29Å; I63-V254 HydrophobicContact CD1-CG1 3.68Å; I63-V254 HydrophobicContact CG1-CG1 4.39Å; I63-N255 PolarHBondContact O-ND2 3.13Å
64	D	46.5	Very low	38.8	Very low	34 Å²	34	80.6 Å²	80.6	18%	0.182	42%	0.424	C	S	.	.			trans	-72.8	174.7	173.2	64.1	28.1	0	0	0	111.8	Q66 G67 N68 N70	D64-Q66 PolarHBondContact O-N 3.01Å; D64-Q66 VanDerWaalsContact O-N 3.14Å; D64-Q66 WeakPolarHBondContact OD1-CA 3.38Å; D64-Q66 WeakPolarHBondContact OD1-CB 3.37Å; D64-Q66 PolarHBondContact OD1-N 3.19Å; D64-Q66 PolarHBondContact OD1-OE1 3.42Å; D64-G67 PolarHBondContact O-N 3.2Å; D64-G67 PolarHBondContact OD1-N 3.24Å; D64-N68 PolarHBondContact N-O 3.18Å; D64-N68 PolarHBondContact OD1-N 3.44Å; D64-N68 PolarHBondContact OD1-ND2 3.21Å; D64-N68 VanDerWaalsContact OD1-ND2 3.11Å; D64-N68 WeakPolarHBondContact OD2-CB 3.27Å; D64-N68 PolarHBondContact OD2-ND2 3.09Å; D64-N70 PolarHBondContact OD2-ND2 2.96Å
65	L	36.3	Very low	38.9	Very low	84 Å²	84	79.4 Å²	79.4	44%	0.44	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.1	-179.5	-58.8	-167.2	0	0	0	113.5	A299 L300	L65-A299 VanDerWaalsContact CD1-C 3.44Å; L65-A299 HydrophobicContact CD1-CB 3.49Å; L65-A299 VanDerWaalsContact CD1-CB 3.49Å; L65-A299 WeakPolarHBondContact CD1-O 3.35Å; L65-A299 HydrophobicContact CG-CB 4.13Å; L65-L300 HydrophobicContact CD1-CD2 4.35Å; L65-L300 HydrophobicContact CD2-CD2 3.6Å; L65-L300 HydrophobicContact CD2-CG 4.15Å
66	Q	41.9	Very low	38.9	Very low	149 Å²	149	76.4 Å²	76.4	70%	0.696	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-3	175	-62.2	76	20.9	0	0	111.9	D64	D64-Q66 PolarHBondContact O-N 3.01Å; D64-Q66 VanDerWaalsContact O-N 3.14Å; D64-Q66 WeakPolarHBondContact OD1-CA 3.38Å; D64-Q66 WeakPolarHBondContact OD1-CB 3.37Å; D64-Q66 PolarHBondContact OD1-N 3.19Å; D64-Q66 PolarHBondContact OD1-OE1 3.42Å
67	G	34.7	Very low	39.3	Very low	46 Å²	46	76.1 Å²	76.1	47%	0.474	41%	0.412	S	S	.	.			trans	88.1	7.6	178.9	0	0	0	0	0	114.5	I63 D64	I63-G67 VanDerWaalsContact CG2-C 3.5Å; D64-G67 PolarHBondContact O-N 3.2Å; D64-G67 PolarHBondContact OD1-N 3.24Å
68	N	42.3	Very low	39.2	Very low	87 Å²	87	80 Å²	80	47%	0.465	44%	0.437	S	S	.	.			trans	-82.6	133.7	179.9	-43.3	-68.5	0	0	0	110.9	I63 D64 N70	I63-N68 WeakPolarHBondContact CA-O 3.32Å; D64-N68 PolarHBondContact N-O 3.18Å; D64-N68 PolarHBondContact OD1-N 3.44Å; D64-N68 PolarHBondContact OD1-ND2 3.21Å; D64-N68 VanDerWaalsContact OD1-ND2 3.11Å; D64-N68 WeakPolarHBondContact OD2-CB 3.27Å; D64-N68 PolarHBondContact OD2-ND2 3.09Å; N68-N70 PolarHBondContact O-N 3.22Å
69	V	41.1	Very low	39.5	Very low	71 Å²	71	85 Å²	85	43%	0.43	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	104.2	174.8	-177.8	0	0	0	0	109.3	N61 I63	N61-V69 HydrophobicContact CB-CG1 3.5Å; I63-V69 HydrophobicContact CD1-CG2 4.5Å; I63-V69 HydrophobicContact CG1-CG2 4.29Å
70	N	45.5	Very low	39.1	Very low	60 Å²	60	89.1 Å²	89.1	32%	0.321	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	121.2	177.4	-72.9	-57.3	0	0	0	110.7	N61 H62 D64 N68	N61-N70 WeakPolarHBondContact CA-O 3.39Å; H62-N70 WeakPolarHBondContact CE1-CB 3.38Å; H62-N70 PolarHBondContact N-O 3.04Å; H62-N70 VanDerWaalsContact N-O 3.1Å; H62-N70 PolarHBondContact ND1-O 3.39Å; H62-N70 WeakPolarHBondContact NE2-CB 3.37Å; H62-N70 PolarHBondContact O-N 3.13Å; D64-N70 PolarHBondContact OD2-ND2 2.96Å; N68-N70 PolarHBondContact O-N 3.22Å
71	Q	40.5	Very low	38.6	Very low	128 Å²	128	90.5 Å²	90.5	60%	0.598	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-71.5	143.1	176.5	-63.2	-176.4	25.4	0	0	110.6	N61 K73	N61-Q71 WeakPolarHBondContact OD1-CA 3.42Å; Q71-K73 PolarHBondContact O-N 3.43Å; Q71-K73 VanDerWaalsContact O-N 3.16Å
72	P	43	Very low	38	Very low	48 Å²	48	89.4 Å²	89.4	31%	0.312	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-64.2	117.1	-179.4	24.9	-33.3	0	0	0	111.4
73	K	35.3	Very low	37.4	Very low	192 Å²	192	92 Å²	92	84%	0.835	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-77.5	126.8	165.2	-73.1	-180	-179.7	173	0	108.9	Q71 V75	Q71-K73 PolarHBondContact O-N 3.43Å; Q71-K73 VanDerWaalsContact O-N 3.16Å; K73-V75 PolarHBondContact O-N 3.44Å; K73-V75 VanDerWaalsContact O-N 3.15Å
74	I	34	Very low	37.3	Very low	138 Å²	138	97 Å²	97	71%	0.708	53%	0.526	S	S	*	.			trans	-72.6	105.7	171.8	-59.9	172.4	0	0	0	107.9	I56	I56-I74 HydrophobicContact CD1-CG2 3.91Å
75	V	33.3	Very low	37.1	Very low	104 Å²	104	98.9 Å²	98.9	63%	0.63	54%	0.536	S	S	*	.			trans	-100.3	114.5	170.4	-169.2	0	0	0	0	108.2	K73 N77	K73-V75 PolarHBondContact O-N 3.44Å; K73-V75 VanDerWaalsContact O-N 3.15Å; V75-N77 PolarHBondContact O-N 2.87Å
76	P	31.4	Very low	37.4	Very low	92 Å²	92	96.3 Å²	96.3	60%	0.597	52%	0.524	S	S	*	.			trans	-76	89	177.2	30.2	-33.1	0	0	0	110	N78	P76-N78 VanDerWaalsContact C-N 3.28Å; P76-N78 PolarHBondContact O-N 3.2Å
77	N	38.3	Very low	37.6	Very low	94 Å²	94	94.7 Å²	94.7	50%	0.503	52%	0.516	S	S	.	.			trans	-74.1	82.3	176.5	-162.1	-2.4	0	0	0	110.9	V75 K79	V75-N77 PolarHBondContact O-N 2.87Å; N77-K79 PolarHBondContact O-N 3.04Å
78	N	33.9	Very low	38.5	Very low	145 Å²	145	96.7 Å²	96.7	78%	0.775	52%	0.516	S	S	*	.			trans	-77.1	63.6	178.2	-76	-15.9	0	0	0	111.9	P76	P76-N78 VanDerWaalsContact C-N 3.28Å; P76-N78 PolarHBondContact O-N 3.2Å
79	K	38.4	Very low	39	Very low	158 Å²	158	93.6 Å²	93.6	69%	0.687	50%	0.499	S	S	*	.			trans	-159	136.3	164.1	-89.4	122.2	-178.8	-174	0	109.4	N77	N77-K79 PolarHBondContact O-N 3.04Å
80	F	34.9	Very low	39.7	Very low	132 Å²	132	95.8 Å²	95.8	58%	0.579	50%	0.499	S	S	*	.			trans	67.1	129.5	-165.9	-60.1	-89.6	0	0	0	111.4
81	C	33.6	Very low	40.5	Very low	41 Å²	41	95.3 Å²	95.3	28%	0.277	50%	0.497	S	S	.	.			cis	-141.3	161.9	19.7	-98.1	0	0	0	0	112.5	D85 V86 E287	C81-D85 HydrophobicContact CB-CB 3.82Å; C81-D85 WeakPolarHBondContact SG-CB 3.38Å; C81-V86 HydrophobicContact CB-CG2 3.4Å; C81-V86 VanDerWaalsContact CB-CG2 3.4Å; C81-E287 PolarHBondContact SG-OE1 3.09Å
82	A	31.4	Very low	41.8	Very low	16 Å²	16	91.6 Å²	91.6	13%	0.132	48%	0.48	C	S	.	.			trans	-73.2	154.4	157.9	0	0	0	0	0	109.4	I45 N84 D85 V86	I45-A82 HydrophobicContact CD1-CB 4.21Å; I45-A82 HydrophobicContact CG2-CB 4.19Å; A82-N84 PolarHBondContact O-N 2.92Å; A82-D85 PolarHBondContact N-OD2 3.43Å; A82-D85 WeakPolarHBondContact O-CB 3.35Å; A82-D85 PolarHBondContact O-N 2.96Å; A82-V86 PolarHBondContact O-N 2.88Å
83	A	32.3	Very low	43	Very low	82 Å²	82	91 Å²	91	68%	0.678	47%	0.473	S	S	*	.	H	α-helix	trans	-55.4	-31.3	-176.9	0	0	0	0	0	113.8	H87	A83-H87 PolarHBondContact O-N 3.08Å
84	N	34.2	Very low	44.8	Very low	137 Å²	137	82.6 Å²	82.6	73%	0.733	44%	0.437	S	S	*	.	H	α-helix	trans	-68.5	-34.3	175.7	-71.6	-2.6	0	0	0	113.2	A82 N88	A82-N84 PolarHBondContact O-N 2.92Å; N84-N88 WeakPolarHBondContact O-CB 3.41Å; N84-N88 PolarHBondContact O-N 2.95Å
85	D	42.9	Very low	46.9	Very low	73 Å²	73	80.7 Å²	80.7	39%	0.39	42%	0.423	S	S	.	.	H	α-helix	trans	-68.3	-46.9	179.3	-62.3	-45.3	0	0	0	110.3	C81 A82 H87 N88 I89	C81-D85 HydrophobicContact CB-CB 3.82Å; C81-D85 WeakPolarHBondContact SG-CB 3.38Å; A82-D85 PolarHBondContact N-OD2 3.43Å; A82-D85 WeakPolarHBondContact O-CB 3.35Å; A82-D85 PolarHBondContact O-N 2.96Å; D85-H87 VanDerWaalsContact C-N 3.31Å; D85-H87 PolarHBondContact O-N 3.16Å; D85-N88 WeakPolarHBondContact O-CB 3.38Å; D85-N88 PolarHBondContact O-N 2.93Å; D85-N88 VanDerWaalsContact O-N 3.11Å; D85-I89 WeakPolarHBondContact O-CB 3.31Å; D85-I89 VanDerWaalsContact O-CG1 3.23Å; D85-I89 WeakPolarHBondContact O-CG1 3.4Å; D85-I89 PolarHBondContact O-N 3.45Å
86	V	41.8	Very low	49.2	Very low	29 Å²	29	76 Å²	76	18%	0.176	40%	0.395	C	S	.	.	H	α-helix	trans	-61.7	-38.9	178.8	-167.7	0	0	0	0	111.5	C81 A82 R90	C81-V86 HydrophobicContact CB-CG2 3.4Å; C81-V86 VanDerWaalsContact CB-CG2 3.4Å; A82-V86 PolarHBondContact O-N 2.88Å; V86-R90 WeakPolarHBondContact O-CB 3.25Å; V86-R90 WeakPolarHBondContact O-CG 3.22Å; V86-R90 PolarHBondContact O-N 2.9Å
87	H	46.2	Very low	52	Low	116 Å²	116	71.6 Å²	71.6	54%	0.537	37%	0.366	S	S	.	.	H	α-helix	trans	-65.5	-41	175.6	-169.8	86.6	0	0	0	111.8	A83 D85 N91	A83-H87 PolarHBondContact O-N 3.08Å; D85-H87 VanDerWaalsContact C-N 3.31Å; D85-H87 PolarHBondContact O-N 3.16Å; H87-N91 PolarHBondContact CD2-ND2 3.39Å; H87-N91 PolarHBondContact NE2-ND2 3.39Å; H87-N91 PolarHBondContact O-N 2.84Å; H87-N91 PolarHBondContact O-ND2 2.96Å
88	N	54.3	Low	54.4	Low	87 Å²	87	70.7 Å²	70.7	47%	0.465	36%	0.356	S	S	.	.	H	α-helix	trans	-65	-48.1	176.3	-167.7	-9.9	0	0	0	111.3	N84 D85 R90 N91 Q92	N84-N88 WeakPolarHBondContact O-CB 3.41Å; N84-N88 PolarHBondContact O-N 2.95Å; D85-N88 WeakPolarHBondContact O-CB 3.38Å; D85-N88 PolarHBondContact O-N 2.93Å; D85-N88 VanDerWaalsContact O-N 3.11Å; N88-R90 PolarHBondContact O-N 3Å; N88-N91 PolarHBondContact O-N 3Å; N88-N91 VanDerWaalsContact O-N 3.09Å; N88-Q92 WeakPolarHBondContact O-CG 3.41Å; N88-Q92 PolarHBondContact O-N 3.08Å; N88-Q92 PolarHBondContact OD1-NE2 3.01Å
89	I	52.6	Low	57	Low	23 Å²	23	66.6 Å²	66.6	12%	0.118	33%	0.331	C	S	.	.	H	α-helix	trans	-55	-50.2	175.1	-69	168.7	0	0	0	110.4	D85 N91 Q92 I93 I283 F284	D85-I89 WeakPolarHBondContact O-CB 3.31Å; D85-I89 VanDerWaalsContact O-CG1 3.23Å; D85-I89 WeakPolarHBondContact O-CG1 3.4Å; D85-I89 PolarHBondContact O-N 3.45Å; I89-N91 VanDerWaalsContact C-N 3.33Å; I89-N91 PolarHBondContact O-N 3.09Å; I89-Q92 WeakPolarHBondContact O-CB 3.5Å; I89-Q92 PolarHBondContact O-N 2.82Å; I89-Q92 VanDerWaalsContact O-N 3.09Å; I89-I93 PolarHBondContact O-N 3.1Å; I89-I283 HydrophobicContact CD1-CG2 4.08Å; I89-I283 HydrophobicContact CG1-CG2 4.08Å; I89-I283 HydrophobicContact CG2-CG2 4.44Å; I89-F284 HydrophobicContact CG2-CD1 3.56Å; I89-F284 HydrophobicContact CG2-CE1 3.8Å; I89-F284 WeakPolarHBondContact O-CE1 3.39Å
90	R	56.5	Low	59.4	Low	116 Å²	116	59.3 Å²	59.3	44%	0.438	30%	0.301	S	S	.	.	H	α-helix	trans	-61	-37.1	176.1	-73.6	-171.3	-170.2	113.9	5	113	V86 N88 Q92 I93 K94	V86-R90 WeakPolarHBondContact O-CB 3.25Å; V86-R90 WeakPolarHBondContact O-CG 3.22Å; V86-R90 PolarHBondContact O-N 2.9Å; N88-R90 PolarHBondContact O-N 3Å; R90-Q92 VanDerWaalsContact C-N 3.34Å; R90-I93 WeakPolarHBondContact O-CB 3.32Å; R90-I93 PolarHBondContact O-N 3.04Å; R90-K94 VanDerWaalsContact O-CG 3.26Å; R90-K94 WeakPolarHBondContact O-CG 3.42Å; R90-K94 PolarHBondContact O-N 2.9Å
91	N	62.9	Low	62.2	Low	50 Å²	50	53 Å²	53	27%	0.267	27%	0.273	S	S	.	.	H	α-helix	trans	-72.5	-28.2	175.9	-71.2	-19.3	0	0	0	112.7	H87 N88 I89 K94 K95	H87-N91 PolarHBondContact CD2-ND2 3.39Å; H87-N91 PolarHBondContact NE2-ND2 3.39Å; H87-N91 PolarHBondContact O-N 2.84Å; H87-N91 PolarHBondContact O-ND2 2.96Å; N88-N91 PolarHBondContact O-N 3Å; N88-N91 VanDerWaalsContact O-N 3.09Å; I89-N91 VanDerWaalsContact C-N 3.33Å; I89-N91 PolarHBondContact O-N 3.09Å; N91-K94 PolarHBondContact O-N 2.89Å; N91-K94 PolarHBondContact OD1-NZ 3.3Å; N91-K94 VanDerWaalsContact OD1-NZ 3.14Å; N91-K95 PolarHBondContact O-N 3.07Å; N91-K95 VanDerWaalsContact O-N 3.17Å
92	Q	66.9	Low	65	Low	51 Å²	51	53 Å²	53	24%	0.238	27%	0.274	C	S	.	.	H	α-helix	trans	-67.3	-39.8	171	-69.4	176.2	40.7	0	0	112.2	N88 I89 R90 K94 K95 E96 F284	N88-Q92 WeakPolarHBondContact O-CG 3.41Å; N88-Q92 PolarHBondContact O-N 3.08Å; N88-Q92 PolarHBondContact OD1-NE2 3.01Å; I89-Q92 WeakPolarHBondContact O-CB 3.5Å; I89-Q92 PolarHBondContact O-N 2.82Å; I89-Q92 VanDerWaalsContact O-N 3.09Å; R90-Q92 VanDerWaalsContact C-N 3.34Å; Q92-K94 PolarHBondContact O-N 3.41Å; Q92-K95 PolarHBondContact O-N 2.96Å; Q92-E96 WeakPolarHBondContact O-CG 3.49Å; Q92-E96 PolarHBondContact O-N 3.17Å; Q92-F284 HydrophobicContact CB-CE1 4.16Å; Q92-F284 HydrophobicContact CB-CZ 4.02Å
93	I	68	Low	67.7	Low	35 Å²	35	56.6 Å²	56.6	18%	0.179	29%	0.294	C	S	.	.	H	α-helix	trans	-52.5	-46.7	172	-65.3	173.5	0	0	0	110.3	I89 R90 K95 E96 L97 L112 F116 F284	I89-I93 PolarHBondContact O-N 3.1Å; R90-I93 WeakPolarHBondContact O-CB 3.32Å; R90-I93 PolarHBondContact O-N 3.04Å; I93-K95 PolarHBondContact O-N 3.09Å; I93-E96 PolarHBondContact O-N 3.34Å; I93-L97 PolarHBondContact O-N 3.29Å; I93-L112 HydrophobicContact CG2-CD2 4.29Å; I93-F116 HydrophobicContact CG2-CE1 3.71Å; I93-F116 HydrophobicContact CG2-CZ 3.75Å; I93-F284 HydrophobicContact CB-CE1 4.46Å; I93-F284 HydrophobicContact CB-CE2 4.25Å; I93-F284 HydrophobicContact CB-CZ 4.11Å; I93-F284 HydrophobicContact CD1-CD1 3.99Å; I93-F284 HydrophobicContact CD1-CD2 4.48Å; I93-F284 HydrophobicContact CD1-CE1 4.28Å; I93-F284 HydrophobicContact CD1-CG 4.13Å; I93-F284 HydrophobicContact CG1-CD1 3.53Å; I93-F284 HydrophobicContact CG1-CD2 3.71Å; I93-F284 HydrophobicContact CG1-CE1 3.38Å; I93-F284 HydrophobicContact CG1-CE2 3.56Å; I93-F284 HydrophobicContact CG1-CG 3.72Å; I93-F284 HydrophobicContact CG1-CZ 3.39Å
94	K	73.7	Confident	70.6	Confident	16 Å²	16	55.5 Å²	55.5	7%	0.07	28%	0.282	C	S	.	.	H	α-helix	trans	-66.4	-37	-176.4	-58.9	170.5	-167.6	175.2	0	112.5	R90 N91 Q92 Q123 V124 V127	R90-K94 VanDerWaalsContact O-CG 3.26Å; R90-K94 WeakPolarHBondContact O-CG 3.42Å; R90-K94 PolarHBondContact O-N 2.9Å; N91-K94 PolarHBondContact O-N 2.89Å; N91-K94 PolarHBondContact OD1-NZ 3.3Å; N91-K94 VanDerWaalsContact OD1-NZ 3.14Å; Q92-K94 PolarHBondContact O-N 3.41Å; K94-Q123 WeakPolarHBondContact CE-O 3.47Å; K94-Q123 PolarHBondContact NZ-O 3.09Å; K94-V124 HydrophobicContact CB-CG1 4.34Å; K94-V124 HydrophobicContact CD-CG2 4.39Å; K94-V124 HydrophobicContact CG-CB 4.01Å; K94-V124 HydrophobicContact CG-CG1 4.08Å; K94-V124 HydrophobicContact CG-CG2 3.69Å; K94-V127 HydrophobicContact CB-CB 3.81Å; K94-V127 HydrophobicContact CB-CG1 3.59Å; K94-V127 HydrophobicContact CD-CB 3.62Å; K94-V127 HydrophobicContact CD-CG1 4.11Å; K94-V127 HydrophobicContact CD-CG2 3.47Å; K94-V127 VanDerWaalsContact CD-CG2 3.47Å; K94-V127 HydrophobicContact CG-CB 4.26Å; K94-V127 HydrophobicContact CG-CG1 4.47Å
95	K	77.9	Confident	73.3	Confident	97 Å²	97	50.2 Å²	50.2	42%	0.422	25%	0.253	S	S	.	.	H	α-helix	trans	-69.2	-37.8	173	-175.2	172.9	-177.1	168.3	0	112.2	N91 Q92 I93 Y98 K99 Y131	N91-K95 PolarHBondContact O-N 3.07Å; N91-K95 VanDerWaalsContact O-N 3.17Å; Q92-K95 PolarHBondContact O-N 2.96Å; I93-K95 PolarHBondContact O-N 3.09Å; K95-Y98 PolarHBondContact O-N 3.22Å; K95-K99 PolarHBondContact O-N 2.98Å; K95-K99 VanDerWaalsContact O-N 3.08Å; K95-Y131 HydrophobicContact CB-CE2 4.27Å; K95-Y131 HydrophobicContact CG-CE2 4.35Å
96	E	81.7	Confident	75.8	Confident	5 Å²	5	48.3 Å²	48.3	2%	0.023	24%	0.243	C	C	.	.	H	α-helix	trans	-67.8	-32.7	177.1	-71.6	-56.6	117.8	0	0	112.7	Q92 I93 K99 A100 L112 T277 R280	Q92-E96 WeakPolarHBondContact O-CG 3.49Å; Q92-E96 PolarHBondContact O-N 3.17Å; I93-E96 PolarHBondContact O-N 3.34Å; E96-K99 PolarHBondContact O-N 3.25Å; E96-K99 IonicContact OE2-NZ 3.78Å; E96-A100 VanDerWaalsContact O-CB 3.3Å; E96-A100 WeakPolarHBondContact O-CB 3.4Å; E96-A100 PolarHBondContact O-N 2.91Å; E96-L112 HydrophobicContact CB-CD1 4.05Å; E96-T277 VanDerWaalsContact OE2-CB 3.24Å; E96-T277 WeakPolarHBondContact OE2-CB 3.46Å; E96-T277 VanDerWaalsContact OE2-CG2 3.23Å; E96-T277 WeakPolarHBondContact OE2-CG2 3.24Å; E96-T277 PolarHBondContact OE2-OG1 2.85Å; E96-R280 HydrophobicContact CG-CB 4.29Å; E96-R280 VanDerWaalsContact CG-CD 3.49Å; E96-R280 WeakPolarHBondContact OE1-CD 3.3Å; E96-R280 IonicContact OE1-CZ 3.29Å; E96-R280 VanDerWaalsContact OE1-CZ 3.31Å; E96-R280 IonicContact OE1-NE 2.89Å; E96-R280 IonicContact OE1-NH1 2.78Å; E96-R280 PolarHBondContact OE1-NH1 2.77Å
97	L	89.1	Confident	78.1	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-46.2	173.2	-178.5	64.3	0	0	0	112.1	I93 K99 A100 I101 T109 L112 L113 F116 V124 I136	I93-L97 PolarHBondContact O-N 3.29Å; L97-K99 VanDerWaalsContact C-N 3.34Å; L97-K99 PolarHBondContact O-N 3.31Å; L97-A100 PolarHBondContact O-N 3.12Å; L97-I101 HydrophobicContact CD1-CD1 3.87Å; L97-I101 HydrophobicContact CD1-CG1 4.32Å; L97-I101 HydrophobicContact CG-CD1 3.9Å; L97-I101 WeakPolarHBondContact O-CG1 3.42Å; L97-I101 PolarHBondContact O-N 3.32Å; L97-I101 VanDerWaalsContact O-N 3.08Å; L97-T109 HydrophobicContact CD1-CG2 4.27Å; L97-L112 HydrophobicContact CB-CD1 4.04Å; L97-L112 HydrophobicContact CD1-CB 4.33Å; L97-L112 HydrophobicContact CD1-CD1 4.44Å; L97-L113 HydrophobicContact CD1-CD1 4.42Å; L97-L113 HydrophobicContact CD1-CD2 4.15Å; L97-L113 HydrophobicContact CD1-CG 3.96Å; L97-L113 HydrophobicContact CD2-CD2 4.01Å; L97-F116 HydrophobicContact CD2-CE2 4.35Å; L97-V124 HydrophobicContact CD2-CG1 3.59Å; L97-I136 HydrophobicContact CD2-CD1 4.09Å; L97-I136 HydrophobicContact CD2-CG2 4.4Å
98	Y	89.6	Confident	80.2	Confident	75 Å²	75	43.6 Å²	43.6	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-57.9	-47.6	174.3	169.5	-96.5	0	0	0	111.7	K95 I101 S102 Y128 Y131	K95-Y98 PolarHBondContact O-N 3.22Å; Y98-I101 PolarHBondContact O-N 2.74Å; Y98-S102 WeakPolarHBondContact O-CB 3.26Å; Y98-S102 PolarHBondContact O-N 2.73Å; Y98-S102 PolarHBondContact O-OG 3.43Å; Y98-Y128 HydrophobicContact CD2-CD2 4.47Å; Y98-Y128 AromaticContact CD2-CE2 3.97Å; Y98-Y128 HydrophobicContact CD2-CE2 3.97Å; Y98-Y128 HydrophobicContact CG-CE2 4.44Å; Y98-Y131 HydrophobicContact CD1-CG 4.14Å; Y98-Y131 VanDerWaalsContact CD2-CB 3.5Å; Y98-Y131 WeakPolarHBondContact CE2-O 3.42Å; Y98-Y131 HydrophobicContact CG-CD2 4.47Å; Y98-Y131 HydrophobicContact CG-CG 4.15Å; Y98-Y131 VanDerWaalsContact CZ-O 3.32Å; Y98-Y131 PolarHBondContact OH-O 2.88Å
99	K	87.6	Confident	82.1	Confident	59 Å²	59	39.4 Å²	39.4	26%	0.257	20%	0.197	S	C	.	.	H	α-helix	trans	-58.8	-50.6	178.3	-173.9	-175	171.6	-164.1	0	111.3	K95 E96 L97 I101 S102 T103 S274 T277	K95-K99 PolarHBondContact O-N 2.98Å; K95-K99 VanDerWaalsContact O-N 3.08Å; E96-K99 PolarHBondContact O-N 3.25Å; E96-K99 IonicContact OE2-NZ 3.78Å; L97-K99 VanDerWaalsContact C-N 3.34Å; L97-K99 PolarHBondContact O-N 3.31Å; K99-I101 PolarHBondContact O-N 3.27Å; K99-S102 WeakPolarHBondContact CA-OG 3.39Å; K99-S102 PolarHBondContact O-N 3.05Å; K99-S102 PolarHBondContact O-OG 3.14Å; K99-T103 PolarHBondContact O-N 3.14Å; K99-T103 PolarHBondContact O-OG1 2.82Å; K99-T103 VanDerWaalsContact O-OG1 3.12Å; K99-S274 PolarHBondContact NZ-OG 2.63Å; K99-T277 PolarHBondContact NZ-OG1 3.06Å
100	A	90.4	Very high	84.1	Confident	5 Å²	5	38.5 Å²	38.5	4%	0.041	19%	0.192	C	C	.	.	H	α-helix	trans	-58	-44.4	-179	0	0	0	0	0	112.6	E96 L97 T103 S104 N105 I108	E96-A100 VanDerWaalsContact O-CB 3.3Å; E96-A100 WeakPolarHBondContact O-CB 3.4Å; E96-A100 PolarHBondContact O-N 2.91Å; L97-A100 PolarHBondContact O-N 3.12Å; A100-T103 PolarHBondContact O-OG1 2.95Å; A100-S104 PolarHBondContact O-N 2.74Å; A100-N105 PolarHBondContact O-N 3.14Å; A100-I108 HydrophobicContact CB-CB 3.87Å; A100-I108 HydrophobicContact CB-CG2 3.73Å
101	I	93.5	Very high	85.8	Confident	1 Å²	1	33 Å²	33	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-47.1	175.7	-66	165	0	0	0	110.5	L97 Y98 K99 T103 S104 T109 Y128 I136 S139 I140 R143	L97-I101 HydrophobicContact CD1-CD1 3.87Å; L97-I101 HydrophobicContact CD1-CG1 4.32Å; L97-I101 HydrophobicContact CG-CD1 3.9Å; L97-I101 WeakPolarHBondContact O-CG1 3.42Å; L97-I101 PolarHBondContact O-N 3.32Å; L97-I101 VanDerWaalsContact O-N 3.08Å; Y98-I101 PolarHBondContact O-N 2.74Å; K99-I101 PolarHBondContact O-N 3.27Å; I101-T103 VanDerWaalsContact C-N 3.29Å; I101-T103 PolarHBondContact O-N 3.19Å; I101-S104 PolarHBondContact O-N 3.42Å; I101-T109 HydrophobicContact CD1-CG2 4.27Å; I101-T109 HydrophobicContact CG1-CG2 3.65Å; I101-Y128 HydrophobicContact CD1-CE2 3.94Å; I101-I136 HydrophobicContact CD1-CG2 4.13Å; I101-S139 WeakPolarHBondContact CG2-O 3.37Å; I101-I140 HydrophobicContact CD1-CD1 4.05Å; I101-I140 HydrophobicContact CD1-CG1 3.73Å; I101-I140 HydrophobicContact CG1-CG1 4.01Å; I101-R143 HydrophobicContact CG2-CG 4.04Å; I101-R143 WeakPolarHBondContact O-CD 3.46Å; I101-R143 WeakPolarHBondContact O-CG 3.37Å
102	S	90.7	Very high	87.1	Confident	41 Å²	41	31.2 Å²	31.2	29%	0.287	16%	0.162	S	C	.	.	H	α-helix	trans	-64.5	-29.4	-177.3	71.8	0	0	0	0	113.9	Y98 K99 S104 R143	Y98-S102 WeakPolarHBondContact O-CB 3.26Å; Y98-S102 PolarHBondContact O-N 2.73Å; Y98-S102 PolarHBondContact O-OG 3.43Å; K99-S102 WeakPolarHBondContact CA-OG 3.39Å; K99-S102 PolarHBondContact O-N 3.05Å; K99-S102 PolarHBondContact O-OG 3.14Å; S102-S104 VanDerWaalsContact C-N 3.34Å; S102-R143 PolarHBondContact O-NH1 3.46Å
103	T	90	Very high	88.4	Confident	90 Å²	90	28.8 Å²	28.8	55%	0.552	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	13.6	174.3	64.6	0	0	0	0	113	K99 A100 I101 N105	K99-T103 PolarHBondContact O-N 3.14Å; K99-T103 PolarHBondContact O-OG1 2.82Å; K99-T103 VanDerWaalsContact O-OG1 3.12Å; A100-T103 PolarHBondContact O-OG1 2.95Å; I101-T103 VanDerWaalsContact C-N 3.29Å; I101-T103 PolarHBondContact O-N 3.19Å; T103-N105 PolarHBondContact O-N 2.76Å; T103-N105 VanDerWaalsContact O-N 3.14Å
104	S	93.1	Very high	89.5	Confident	60 Å²	60	27.2 Å²	27.2	42%	0.42	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	34.9	-178.4	-58.6	0	0	0	0	114.2	A100 I101 S102 I106 R143 F144	A100-S104 PolarHBondContact O-N 2.74Å; I101-S104 PolarHBondContact O-N 3.42Å; S102-S104 VanDerWaalsContact C-N 3.34Å; S104-I106 PolarHBondContact O-N 3.3Å; S104-R143 VanDerWaalsContact OG-CD 3.28Å; S104-R143 WeakPolarHBondContact OG-CD 3.32Å; S104-F144 WeakPolarHBondContact O-CE1 3.32Å
105	N	90.9	Very high	90.3	Very high	25 Å²	25	27.7 Å²	27.7	13%	0.134	15%	0.146	C	C	.	.			trans	-91	95.1	176.4	-170.4	-54.5	0	0	0	110.3	A100 T103 Q107 I108 T109 L272 I273	A100-N105 PolarHBondContact O-N 3.14Å; T103-N105 PolarHBondContact O-N 2.76Å; T103-N105 VanDerWaalsContact O-N 3.14Å; N105-Q107 VanDerWaalsContact C-N 3.32Å; N105-Q107 PolarHBondContact O-N 3.49Å; N105-Q107 PolarHBondContact OD1-N 3.05Å; N105-Q107 VanDerWaalsContact OD1-N 3.16Å; N105-I108 WeakPolarHBondContact OD1-CG1 3.48Å; N105-I108 PolarHBondContact OD1-N 3.06Å; N105-T109 VanDerWaalsContact O-CB 3.31Å; N105-T109 WeakPolarHBondContact O-CB 3.44Å; N105-T109 PolarHBondContact O-N 3.41Å; N105-T109 PolarHBondContact O-OG1 2.72Å; N105-L272 PolarHBondContact ND2-O 3.26Å; N105-I273 WeakPolarHBondContact ND2-CG2 3.34Å
106	I	93.5	Very high	90.7	Very high	34 Å²	34	23.7 Å²	23.7	17%	0.174	13%	0.128	C	C	.	.	H	α-helix	trans	-66.3	-32.5	-179.9	-170.7	55.3	0	0	0	112.6	S104 T109 T110 F144 T148 L152 Q241 L245	S104-I106 PolarHBondContact O-N 3.3Å; I106-T109 PolarHBondContact O-N 3.26Å; I106-T110 VanDerWaalsContact O-CB 3.23Å; I106-T110 WeakPolarHBondContact O-CB 3.37Å; I106-T110 PolarHBondContact O-N 2.68Å; I106-T110 PolarHBondContact O-OG1 2.9Å; I106-F144 HydrophobicContact CB-CD1 3.86Å; I106-F144 HydrophobicContact CB-CE1 3.6Å; I106-F144 HydrophobicContact CB-CZ 4.17Å; I106-F144 HydrophobicContact CD1-CB 4.39Å; I106-F144 HydrophobicContact CD1-CD1 3.93Å; I106-F144 HydrophobicContact CD1-CD2 4.01Å; I106-F144 HydrophobicContact CD1-CE1 4.16Å; I106-F144 HydrophobicContact CD1-CE2 4.22Å; I106-F144 HydrophobicContact CD1-CG 3.84Å; I106-F144 HydrophobicContact CD1-CZ 4.29Å; I106-F144 HydrophobicContact CG1-CD1 4.25Å; I106-F144 HydrophobicContact CG1-CE1 4.38Å; I106-T148 HydrophobicContact CD1-CG2 3.76Å; I106-L152 HydrophobicContact CD1-CD1 4.14Å; I106-Q241 HydrophobicContact CG1-CG 4.2Å; I106-L245 HydrophobicContact CD1-CD2 4.08Å; I106-L245 HydrophobicContact CG1-CD2 4.06Å
107	Q	91.4	Very high	90.9	Very high	44 Å²	44	25.1 Å²	25.1	21%	0.206	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-46.4	-177.1	-165	-179.4	23.6	0	0	111.5	N105 S111 L263 D266	N105-Q107 VanDerWaalsContact C-N 3.32Å; N105-Q107 PolarHBondContact O-N 3.49Å; N105-Q107 PolarHBondContact OD1-N 3.05Å; N105-Q107 VanDerWaalsContact OD1-N 3.16Å; Q107-S111 WeakPolarHBondContact O-CB 3.41Å; Q107-S111 PolarHBondContact O-N 3.42Å; Q107-L263 HydrophobicContact CG-CD1 3.64Å; Q107-D266 PolarHBondContact NE2-OD2 3.26Å
108	I	90.4	Very high	90.7	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-75.3	-37.4	176	-57.2	-40.3	0	0	0	111.8	A100 N105 T110 S111 L112 L263 V267 I273 T277 L281	A100-I108 HydrophobicContact CB-CB 3.87Å; A100-I108 HydrophobicContact CB-CG2 3.73Å; N105-I108 WeakPolarHBondContact OD1-CG1 3.48Å; N105-I108 PolarHBondContact OD1-N 3.06Å; I108-T110 PolarHBondContact O-N 3.01Å; I108-S111 WeakPolarHBondContact CA-OG 3.41Å; I108-S111 PolarHBondContact O-N 3.07Å; I108-S111 PolarHBondContact O-OG 3.35Å; I108-L112 HydrophobicContact CG2-CD1 3.84Å; I108-L112 HydrophobicContact CG2-CG 4.08Å; I108-L112 WeakPolarHBondContact O-CB 3.43Å; I108-L112 VanDerWaalsContact O-CG 3.28Å; I108-L112 WeakPolarHBondContact O-CG 3.5Å; I108-L112 PolarHBondContact O-N 2.89Å; I108-L263 HydrophobicContact CD1-CD1 3.91Å; I108-V267 HydrophobicContact CD1-CG2 4.42Å; I108-I273 HydrophobicContact CD1-CD1 4.41Å; I108-I273 HydrophobicContact CD1-CG2 3.94Å; I108-I273 HydrophobicContact CG1-CG2 3.49Å; I108-I273 VanDerWaalsContact CG1-CG2 3.49Å; I108-T277 HydrophobicContact CG1-CG2 4.28Å; I108-T277 HydrophobicContact CG2-CG2 4.13Å; I108-L281 HydrophobicContact CD1-CD1 3.71Å
109	T	94.2	Very high	90.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.4	-44.3	173.6	-59.9	0	0	0	0	110.1	L97 I101 N105 I106 L113 I140 F144	L97-T109 HydrophobicContact CD1-CG2 4.27Å; I101-T109 HydrophobicContact CD1-CG2 4.27Å; I101-T109 HydrophobicContact CG1-CG2 3.65Å; N105-T109 VanDerWaalsContact O-CB 3.31Å; N105-T109 WeakPolarHBondContact O-CB 3.44Å; N105-T109 PolarHBondContact O-N 3.41Å; N105-T109 PolarHBondContact O-OG1 2.72Å; I106-T109 PolarHBondContact O-N 3.26Å; T109-L113 HydrophobicContact CG2-CD1 3.75Å; T109-L113 WeakPolarHBondContact O-CB 3.37Å; T109-L113 WeakPolarHBondContact O-CD1 3.39Å; T109-L113 WeakPolarHBondContact O-CG 3.42Å; T109-L113 PolarHBondContact O-N 3.14Å; T109-L113 VanDerWaalsContact O-N 3.12Å; T109-I140 HydrophobicContact CG2-CD1 4.28Å; T109-I140 HydrophobicContact CG2-CG1 4.28Å; T109-F144 HydrophobicContact CG2-CE2 4.1Å
110	T	95	Very high	90.1	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-66.6	-51.6	176.3	-55	0	0	0	0	111.5	I106 I108 L112 L113 I114 L152 L245	I106-T110 VanDerWaalsContact O-CB 3.23Å; I106-T110 WeakPolarHBondContact O-CB 3.37Å; I106-T110 PolarHBondContact O-N 2.68Å; I106-T110 PolarHBondContact O-OG1 2.9Å; I108-T110 PolarHBondContact O-N 3.01Å; T110-L112 PolarHBondContact O-N 2.72Å; T110-L113 PolarHBondContact O-N 3.07Å; T110-L113 VanDerWaalsContact O-N 3.13Å; T110-I114 HydrophobicContact CG2-CD1 4.37Å; T110-I114 HydrophobicContact CG2-CG2 3.87Å; T110-I114 WeakPolarHBondContact O-CG1 3.38Å; T110-I114 WeakPolarHBondContact O-CG2 3.26Å; T110-I114 PolarHBondContact O-N 2.92Å; T110-L152 HydrophobicContact CG2-CD2 4.26Å; T110-L245 HydrophobicContact CG2-CD2 3.86Å; T110-L245 WeakPolarHBondContact OG1-CD2 3.43Å
111	S	91.5	Very high	90	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.014	16%	0.155	C	C	.	.	H	α-helix	trans	-59.9	-34.2	-175.2	74	0	0	0	0	113.5	Q107 I108 Y259	Q107-S111 WeakPolarHBondContact O-CB 3.41Å; Q107-S111 PolarHBondContact O-N 3.42Å; I108-S111 WeakPolarHBondContact CA-OG 3.41Å; I108-S111 PolarHBondContact O-N 3.07Å; I108-S111 PolarHBondContact O-OG 3.35Å; S111-Y259 VanDerWaalsContact CA-OH 3.23Å; S111-Y259 WeakPolarHBondContact CA-OH 3.3Å; S111-Y259 WeakPolarHBondContact CB-OH 3.43Å
112	L	90.2	Very high	89.7	Confident	11 Å²	11	29.4 Å²	29.4	6%	0.058	17%	0.169	C	C	.	.	H	α-helix	trans	-73.6	-48.5	173.9	-62.4	177.8	0	0	0	111.7	I93 E96 L97 I108 T110 I114 D115 F116 L281	I93-L112 HydrophobicContact CG2-CD2 4.29Å; E96-L112 HydrophobicContact CB-CD1 4.05Å; L97-L112 HydrophobicContact CB-CD1 4.04Å; L97-L112 HydrophobicContact CD1-CB 4.33Å; L97-L112 HydrophobicContact CD1-CD1 4.44Å; I108-L112 HydrophobicContact CG2-CD1 3.84Å; I108-L112 HydrophobicContact CG2-CG 4.08Å; I108-L112 WeakPolarHBondContact O-CB 3.43Å; I108-L112 VanDerWaalsContact O-CG 3.28Å; I108-L112 WeakPolarHBondContact O-CG 3.5Å; I108-L112 PolarHBondContact O-N 2.89Å; T110-L112 PolarHBondContact O-N 2.72Å; L112-I114 PolarHBondContact O-N 3.43Å; L112-D115 PolarHBondContact O-N 3.36Å; L112-F116 VanDerWaalsContact O-CD2 3.3Å; L112-F116 WeakPolarHBondContact O-CD2 3.16Å; L112-F116 WeakPolarHBondContact O-CE2 3.23Å; L112-L281 HydrophobicContact CD2-CD2 4.07Å
113	L	93.7	Very high	89.2	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-65.7	-37.4	-177.2	-70.9	170.4	0	0	0	113.1	L97 T109 T110 D115 F116 F121 I140 L152 V156	L97-L113 HydrophobicContact CD1-CD1 4.42Å; L97-L113 HydrophobicContact CD1-CD2 4.15Å; L97-L113 HydrophobicContact CD1-CG 3.96Å; L97-L113 HydrophobicContact CD2-CD2 4.01Å; T109-L113 HydrophobicContact CG2-CD1 3.75Å; T109-L113 WeakPolarHBondContact O-CB 3.37Å; T109-L113 WeakPolarHBondContact O-CD1 3.39Å; T109-L113 WeakPolarHBondContact O-CG 3.42Å; T109-L113 PolarHBondContact O-N 3.14Å; T109-L113 VanDerWaalsContact O-N 3.12Å; T110-L113 PolarHBondContact O-N 3.07Å; T110-L113 VanDerWaalsContact O-N 3.13Å; L113-D115 VanDerWaalsContact C-N 3.3Å; L113-D115 PolarHBondContact O-N 3.14Å; L113-F116 HydrophobicContact CD2-CD2 4.27Å; L113-F116 HydrophobicContact CD2-CE2 4.16Å; L113-F121 HydrophobicContact CD2-CD2 4.1Å; L113-F121 HydrophobicContact CD2-CE2 3.74Å; L113-I140 HydrophobicContact CD1-CD1 3.67Å; L113-L152 HydrophobicContact CD1-CB 4.26Å; L113-L152 HydrophobicContact CD1-CD1 4.04Å; L113-L152 HydrophobicContact CD1-CD2 4.44Å; L113-L152 HydrophobicContact CD1-CG 4.49Å; L113-V156 HydrophobicContact CB-CG2 4.15Å; L113-V156 HydrophobicContact CD2-CG2 4.17Å
114	I	92.5	Very high	89	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-9.9	179	74.8	-179.6	0	0	0	113.7	T110 L112 V155 R159 Y252 Y259	T110-I114 HydrophobicContact CG2-CD1 4.37Å; T110-I114 HydrophobicContact CG2-CG2 3.87Å; T110-I114 WeakPolarHBondContact O-CG1 3.38Å; T110-I114 WeakPolarHBondContact O-CG2 3.26Å; T110-I114 PolarHBondContact O-N 2.92Å; L112-I114 PolarHBondContact O-N 3.43Å; I114-V155 HydrophobicContact CG2-CG1 4.14Å; I114-R159 PolarHBondContact O-NE 3.42Å; I114-R159 PolarHBondContact O-NH1 3.26Å; I114-R159 PolarHBondContact O-NH2 2.9Å; I114-R159 VanDerWaalsContact O-NH2 3.11Å; I114-Y252 HydrophobicContact CD1-CD2 3.65Å; I114-Y252 HydrophobicContact CD1-CG 3.72Å; I114-Y252 HydrophobicContact CG1-CD2 3.72Å; I114-Y252 HydrophobicContact CG1-CE2 4.12Å; I114-Y252 HydrophobicContact CG1-CG 4.08Å; I114-Y252 VanDerWaalsContact O-CZ 3.24Å; I114-Y252 PolarHBondContact O-OH 3.03Å; I114-Y259 HydrophobicContact CD1-CD1 4.48Å; I114-Y259 HydrophobicContact CD1-CE1 3.79Å; I114-Y259 HydrophobicContact CD1-CE2 4.21Å
115	D	88.5	Confident	88.6	Confident	26 Å²	26	28 Å²	28	14%	0.139	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-4.3	176.3	-154.2	39	0	0	0	113.7	R57 L112 L113 W117 Y252 K256 F260 R285	R57-D115 PolarHBondContact NH1-O 2.84Å; L112-D115 PolarHBondContact O-N 3.36Å; L113-D115 VanDerWaalsContact C-N 3.3Å; L113-D115 PolarHBondContact O-N 3.14Å; D115-W117 VanDerWaalsContact O-CD1 3.25Å; D115-Y252 HydrophobicContact CB-CE2 3.97Å; D115-Y252 WeakPolarHBondContact OD1-CE2 3.14Å; D115-Y252 VanDerWaalsContact OD1-CZ 3.26Å; D115-Y252 PolarHBondContact OD1-OH 3.05Å; D115-K256 IonicContact OD1-NZ 3.76Å; D115-K256 PolarHBondContact OD1-NZ 2.86Å; D115-F260 HydrophobicContact CB-CZ 4.44Å; D115-R285 IonicContact OD2-CZ 3.06Å; D115-R285 IonicContact OD2-NH1 2.72Å; D115-R285 PolarHBondContact OD2-NH1 3.07Å
116	F	86.8	Confident	88.2	Confident	13 Å²	13	31.5 Å²	31.5	6%	0.057	16%	0.163	C	C	.	.			trans	-73.8	142.8	171.4	-63.2	-48.6	0	0	0	112.5	I93 L97 L112 L113 E120 F121 V124 R159	I93-F116 HydrophobicContact CG2-CE1 3.71Å; I93-F116 HydrophobicContact CG2-CZ 3.75Å; L97-F116 HydrophobicContact CD2-CE2 4.35Å; L112-F116 VanDerWaalsContact O-CD2 3.3Å; L112-F116 WeakPolarHBondContact O-CD2 3.16Å; L112-F116 WeakPolarHBondContact O-CE2 3.23Å; L113-F116 HydrophobicContact CD2-CD2 4.27Å; L113-F116 HydrophobicContact CD2-CE2 4.16Å; F116-E120 HydrophobicContact CB-CB 4.48Å; F116-E120 HydrophobicContact CD1-CB 4.09Å; F116-F121 HydrophobicContact CB-CB 4.41Å; F116-F121 HydrophobicContact CD2-CD2 4.12Å; F116-V124 HydrophobicContact CD1-CG2 4.13Å; F116-V124 HydrophobicContact CE1-CG2 3.45Å; F116-V124 VanDerWaalsContact CE1-CG2 3.45Å; F116-V124 HydrophobicContact CE2-CG1 4.33Å; F116-V124 HydrophobicContact CE2-CG2 4.02Å; F116-V124 HydrophobicContact CZ-CB 4.3Å; F116-V124 HydrophobicContact CZ-CG1 4.15Å; F116-V124 HydrophobicContact CZ-CG2 3.4Å; F116-R159 WeakPolarHBondContact O-CB 3.33Å; F116-R159 WeakPolarHBondContact O-CD 3.48Å
117	W	85.3	Confident	87.6	Confident	35 Å²	35	31 Å²	31	13%	0.133	16%	0.161	C	C	.	.			trans	-142.1	157.4	169.9	-53.3	67.7	0	0	0	111.7	R57 D115 D119 E120 R159 I163 P212 F213 Y252	R57-W117 VanDerWaalsContact CZ-CD1 3.43Å; R57-W117 PolarHBondContact NH2-O 2.92Å; D115-W117 VanDerWaalsContact O-CD1 3.25Å; W117-D119 PolarHBondContact O-N 3.38Å; W117-E120 PolarHBondContact N-OE2 3.16Å; W117-E120 PolarHBondContact O-N 3.18Å; W117-R159 HydrophobicContact CD2-CB 4.38Å; W117-R159 HydrophobicContact CD2-CG 4.45Å; W117-R159 HydrophobicContact CE3-CB 4.16Å; W117-R159 HydrophobicContact CE3-CG 4.24Å; W117-R159 HydrophobicContact CZ3-CG 4.49Å; W117-I163 HydrophobicContact CH2-CD1 4.34Å; W117-I163 HydrophobicContact CZ3-CD1 3.65Å; W117-P212 HydrophobicContact CH2-CB 4.18Å; W117-P212 HydrophobicContact CH2-CG 3.62Å; W117-P212 HydrophobicContact CZ2-CB 4.42Å; W117-P212 HydrophobicContact CZ2-CG 3.75Å; W117-F213 HydrophobicContact CH2-CE2 4.19Å; W117-F213 HydrophobicContact CH2-CZ 4.26Å; W117-Y252 PolarHBondContact NE1-OH 2.92Å
118	G	84.9	Confident	87.3	Confident	29 Å²	29	29.1 Å²	29.1	30%	0.299	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	-133.8	178.4	0	0	0	0	0	111.9	R159	G118-R159 PolarHBondContact N-O 3.43Å
119	D	83.2	Confident	87.1	Confident	99 Å²	99	35 Å²	35	53%	0.529	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-6.1	-177.5	70.7	-52.6	0	0	0	114.2	W117 F121 D122 Q123	W117-D119 PolarHBondContact O-N 3.38Å; D119-F121 VanDerWaalsContact C-N 3.26Å; D119-F121 PolarHBondContact O-N 2.71Å; D119-D122 WeakPolarHBondContact O-CA 3.45Å; D119-D122 PolarHBondContact O-N 2.74Å; D119-Q123 PolarHBondContact O-N 2.89Å; D119-Q123 PolarHBondContact OD2-NE2 3.29Å
120	E	82.8	Confident	86.7	Confident	42 Å²	42	41.2 Å²	41.2	20%	0.196	21%	0.21	C	C	.	.	H	α-helix	trans	-56	-39.6	-177.1	-75.8	-177.3	161.3	0	0	113.4	R57 F116 W117 D122 Q123 V124	R57-E120 IonicContact CZ-OE1 3.14Å; R57-E120 IonicContact CZ-OE2 3.7Å; R57-E120 VanDerWaalsContact NH1-CD 3.34Å; R57-E120 IonicContact NH1-OE1 2.68Å; R57-E120 PolarHBondContact NH1-OE1 2.52Å; R57-E120 IonicContact NH1-OE2 2.8Å; R57-E120 PolarHBondContact NH1-OE2 2.67Å; R57-E120 IonicContact NH2-OE1 2.75Å; R57-E120 PolarHBondContact NH2-OE1 3.4Å; R57-E120 IonicContact NH2-OE2 3.98Å; R57-E120 PolarHBondContact NH2-OE2 3.01Å; F116-E120 HydrophobicContact CB-CB 4.48Å; F116-E120 HydrophobicContact CD1-CB 4.09Å; W117-E120 PolarHBondContact N-OE2 3.16Å; W117-E120 PolarHBondContact O-N 3.18Å; E120-D122 VanDerWaalsContact C-N 3.25Å; E120-D122 PolarHBondContact O-N 3.22Å; E120-Q123 CarbonylContact O-C 3.55Å; E120-Q123 WeakPolarHBondContact O-CA 3.35Å; E120-Q123 WeakPolarHBondContact O-CB 3.44Å; E120-Q123 PolarHBondContact O-N 3.19Å; E120-Q123 VanDerWaalsContact O-N 3.15Å; E120-V124 WeakPolarHBondContact O-CG2 3.42Å; E120-V124 PolarHBondContact O-N 3Å
121	F	87.3	Confident	86.3	Confident	3 Å²	3	45.2 Å²	45.2	1%	0.013	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-36.9	176.6	178.1	-96.2	0	0	0	111.6	L113 F116 D119 V124 K125 I136 W137 V156	L113-F121 HydrophobicContact CD2-CD2 4.1Å; L113-F121 HydrophobicContact CD2-CE2 3.74Å; F116-F121 HydrophobicContact CB-CB 4.41Å; F116-F121 HydrophobicContact CD2-CD2 4.12Å; D119-F121 VanDerWaalsContact C-N 3.26Å; D119-F121 PolarHBondContact O-N 2.71Å; F121-V124 WeakPolarHBondContact O-CB 3.22Å; F121-V124 PolarHBondContact O-N 3.12Å; F121-K125 HydrophobicContact CE1-CD 4.35Å; F121-K125 WeakPolarHBondContact O-CB 3.31Å; F121-K125 PolarHBondContact O-N 3.11Å; F121-I136 HydrophobicContact CE2-CD1 4Å; F121-I136 HydrophobicContact CE2-CG2 4.39Å; F121-I136 HydrophobicContact CZ-CD1 3.97Å; F121-I136 HydrophobicContact CZ-CG2 4.4Å; F121-W137 AromaticContact CE1-CZ2 3.69Å; F121-W137 HydrophobicContact CE1-CZ2 3.69Å; F121-W137 AromaticContact CE2-CH2 3.91Å; F121-W137 HydrophobicContact CE2-CH2 3.91Å; F121-W137 AromaticContact CE2-CZ2 3.76Å; F121-W137 HydrophobicContact CE2-CZ2 3.76Å; F121-W137 AromaticContact CZ-CE2 3.62Å; F121-W137 AromaticContact CZ-CH2 3.79Å; F121-W137 HydrophobicContact CZ-CH2 3.79Å; F121-W137 AromaticContact CZ-CZ2 3.16Å; F121-W137 HydrophobicContact CZ-CZ2 3.16Å; F121-V156 HydrophobicContact CB-CG1 3.87Å; F121-V156 HydrophobicContact CD1-CG1 3.77Å; F121-V156 HydrophobicContact CD2-CG1 3.63Å; F121-V156 HydrophobicContact CD2-CG2 4.32Å; F121-V156 HydrophobicContact CE1-CG1 4.23Å; F121-V156 HydrophobicContact CE2-CG1 4.11Å; F121-V156 HydrophobicContact CG-CG1 3.43Å; F121-V156 VanDerWaalsContact CG-CG1 3.43Å; F121-V156 HydrophobicContact CZ-CG1 4.39Å
122	D	86.8	Confident	86.2	Confident	57 Å²	57	46.1 Å²	46.1	31%	0.305	23%	0.232	S	C	.	.	H	α-helix	trans	-73.6	-32	177.3	-62.4	-47.8	0	0	0	111.1	D119 E120 V124 K125 N126 K160	D119-D122 WeakPolarHBondContact O-CA 3.45Å; D119-D122 PolarHBondContact O-N 2.74Å; E120-D122 VanDerWaalsContact C-N 3.25Å; E120-D122 PolarHBondContact O-N 3.22Å; D122-V124 VanDerWaalsContact C-N 3.3Å; D122-V124 PolarHBondContact O-N 2.96Å; D122-K125 PolarHBondContact O-N 2.91Å; D122-N126 PolarHBondContact O-N 3.4Å; D122-N126 PolarHBondContact O-ND2 3.13Å; D122-K160 IonicContact OD1-NZ 2.63Å; D122-K160 PolarHBondContact OD1-NZ 3.27Å; D122-K160 WeakPolarHBondContact OD2-CE 3.45Å; D122-K160 IonicContact OD2-NZ 3.45Å; D122-K160 PolarHBondContact OD2-NZ 3.01Å
123	Q	82.1	Confident	86.2	Confident	71 Å²	71	54 Å²	54	33%	0.332	27%	0.274	S	S	.	.	H	α-helix	trans	-64.7	-31.3	167.3	-57.7	-179.2	24.9	0	0	113	K94 D119 E120	K94-Q123 WeakPolarHBondContact CE-O 3.47Å; K94-Q123 PolarHBondContact NZ-O 3.09Å; D119-Q123 PolarHBondContact O-N 2.89Å; D119-Q123 PolarHBondContact OD2-NE2 3.29Å; E120-Q123 CarbonylContact O-C 3.55Å; E120-Q123 WeakPolarHBondContact O-CA 3.35Å; E120-Q123 WeakPolarHBondContact O-CB 3.44Å; E120-Q123 PolarHBondContact O-N 3.19Å; E120-Q123 VanDerWaalsContact O-N 3.15Å
124	V	84	Confident	86.1	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.024	29%	0.287	C	S	.	.	H	α-helix	trans	-74.6	-46.6	175.7	174.7	0	0	0	0	110.9	K94 L97 F116 E120 F121 D122 N126 V127 Y128 I136	K94-V124 HydrophobicContact CB-CG1 4.34Å; K94-V124 HydrophobicContact CD-CG2 4.39Å; K94-V124 HydrophobicContact CG-CB 4.01Å; K94-V124 HydrophobicContact CG-CG1 4.08Å; K94-V124 HydrophobicContact CG-CG2 3.69Å; L97-V124 HydrophobicContact CD2-CG1 3.59Å; F116-V124 HydrophobicContact CD1-CG2 4.13Å; F116-V124 HydrophobicContact CE1-CG2 3.45Å; F116-V124 VanDerWaalsContact CE1-CG2 3.45Å; F116-V124 HydrophobicContact CE2-CG1 4.33Å; F116-V124 HydrophobicContact CE2-CG2 4.02Å; F116-V124 HydrophobicContact CZ-CB 4.3Å; F116-V124 HydrophobicContact CZ-CG1 4.15Å; F116-V124 HydrophobicContact CZ-CG2 3.4Å; E120-V124 WeakPolarHBondContact O-CG2 3.42Å; E120-V124 PolarHBondContact O-N 3Å; F121-V124 WeakPolarHBondContact O-CB 3.22Å; F121-V124 PolarHBondContact O-N 3.12Å; D122-V124 VanDerWaalsContact C-N 3.3Å; D122-V124 PolarHBondContact O-N 2.96Å; V124-N126 PolarHBondContact O-N 2.78Å; V124-V127 PolarHBondContact O-N 3.48Å; V124-Y128 PolarHBondContact O-N 3.19Å; V124-I136 HydrophobicContact CG1-CD1 4.32Å
125	K	86.4	Confident	86.1	Confident	88 Å²	88	59.6 Å²	59.6	38%	0.383	31%	0.307	S	S	.	.	H	α-helix	trans	-53.5	-33.8	175.4	-175.6	178.7	179	-179.9	0	113	F121 D122 K129 I136	F121-K125 HydrophobicContact CE1-CD 4.35Å; F121-K125 WeakPolarHBondContact O-CB 3.31Å; F121-K125 PolarHBondContact O-N 3.11Å; D122-K125 PolarHBondContact O-N 2.91Å; K125-K129 WeakPolarHBondContact O-CG 3.49Å; K125-I136 HydrophobicContact CB-CD1 4.16Å
126	N	82.6	Confident	86.5	Confident	97 Å²	97	58.5 Å²	58.5	52%	0.519	30%	0.301	S	S	.	.	H	α-helix	trans	-73.1	-32.8	176.2	-74	-25.9	0	0	0	113.9	D122 V124 K129	D122-N126 PolarHBondContact O-N 3.4Å; D122-N126 PolarHBondContact O-ND2 3.13Å; V124-N126 PolarHBondContact O-N 2.78Å; N126-K129 PolarHBondContact OD1-NZ 2.84Å
127	V	80.2	Confident	86.9	Confident	23 Å²	23	59.1 Å²	59.1	14%	0.139	30%	0.303	C	S	.	.	H	α-helix	trans	-83.4	-30.1	176.4	171.6	0	0	0	0	112	K94 V124 K129 L130 Y131	K94-V127 HydrophobicContact CB-CB 3.81Å; K94-V127 HydrophobicContact CB-CG1 3.59Å; K94-V127 HydrophobicContact CD-CB 3.62Å; K94-V127 HydrophobicContact CD-CG1 4.11Å; K94-V127 HydrophobicContact CD-CG2 3.47Å; K94-V127 VanDerWaalsContact CD-CG2 3.47Å; K94-V127 HydrophobicContact CG-CB 4.26Å; K94-V127 HydrophobicContact CG-CG1 4.47Å; V124-V127 PolarHBondContact O-N 3.48Å; V127-K129 PolarHBondContact O-N 3.48Å; V127-L130 HydrophobicContact CG1-CD1 4.36Å; V127-L130 VanDerWaalsContact O-CB 3.28Å; V127-L130 WeakPolarHBondContact O-CB 3.49Å; V127-L130 WeakPolarHBondContact O-CG 3.19Å; V127-L130 PolarHBondContact O-N 2.93Å; V127-Y131 HydrophobicContact CG1-CE2 3.92Å; V127-Y131 WeakPolarHBondContact O-CD2 3.47Å
128	Y	85.4	Confident	87.4	Confident	5 Å²	5	61.7 Å²	61.7	2%	0.02	32%	0.315	C	S	.	.	H	α-helix	trans	-57	-37.1	175.1	-169.1	-90.5	0	0	0	112.6	Y98 I101 V124 L130 Y131 S132 I136 S139	Y98-Y128 HydrophobicContact CD2-CD2 4.47Å; Y98-Y128 AromaticContact CD2-CE2 3.97Å; Y98-Y128 HydrophobicContact CD2-CE2 3.97Å; Y98-Y128 HydrophobicContact CG-CE2 4.44Å; I101-Y128 HydrophobicContact CD1-CE2 3.94Å; V124-Y128 PolarHBondContact O-N 3.19Å; Y128-L130 PolarHBondContact O-N 3.42Å; Y128-L130 VanDerWaalsContact O-N 3.09Å; Y128-Y131 PolarHBondContact O-N 3.24Å; Y128-S132 VanDerWaalsContact CE1-CB 3.47Å; Y128-S132 PolarHBondContact O-N 2.96Å; Y128-I136 HydrophobicContact CD1-CG1 3.56Å; Y128-I136 HydrophobicContact CD2-CD1 4.2Å; Y128-I136 HydrophobicContact CD2-CG1 3.54Å; Y128-I136 HydrophobicContact CE1-CG1 3.94Å; Y128-I136 HydrophobicContact CE2-CG1 3.9Å; Y128-I136 HydrophobicContact CG-CD1 4.01Å; Y128-I136 HydrophobicContact CG-CG1 3.35Å; Y128-S139 WeakPolarHBondContact OH-CB 3.43Å; Y128-S139 PolarHBondContact OH-OG 3.3Å
129	K	86	Confident	88	Confident	124 Å²	124	60.7 Å²	60.7	54%	0.539	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-16	174.5	-67.7	168.4	-175.8	169.5	0	114.6	K125 N126 V127 Y131 S132	K125-K129 WeakPolarHBondContact O-CG 3.49Å; N126-K129 PolarHBondContact OD1-NZ 2.84Å; V127-K129 PolarHBondContact O-N 3.48Å; K129-Y131 VanDerWaalsContact C-N 3.3Å; K129-S132 WeakPolarHBondContact CA-O 3.24Å
130	L	85.6	Confident	88.7	Confident	131 Å²	131	56 Å²	56	69%	0.686	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-15.1	174.7	-54.7	179	0	0	0	112.5	V127 Y128	V127-L130 HydrophobicContact CG1-CD1 4.36Å; V127-L130 VanDerWaalsContact O-CB 3.28Å; V127-L130 WeakPolarHBondContact O-CB 3.49Å; V127-L130 WeakPolarHBondContact O-CG 3.19Å; V127-L130 PolarHBondContact O-N 2.93Å; Y128-L130 PolarHBondContact O-N 3.42Å; Y128-L130 VanDerWaalsContact O-N 3.09Å
131	Y	86.9	Confident	89.4	Confident	87 Å²	87	58 Å²	58	34%	0.341	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-19.4	-175.6	-56.2	-69.5	0	0	0	113.5	K95 Y98 V127 Y128 K129	K95-Y131 HydrophobicContact CB-CE2 4.27Å; K95-Y131 HydrophobicContact CG-CE2 4.35Å; Y98-Y131 HydrophobicContact CD1-CG 4.14Å; Y98-Y131 VanDerWaalsContact CD2-CB 3.5Å; Y98-Y131 WeakPolarHBondContact CE2-O 3.42Å; Y98-Y131 HydrophobicContact CG-CD2 4.47Å; Y98-Y131 HydrophobicContact CG-CG 4.15Å; Y98-Y131 VanDerWaalsContact CZ-O 3.32Å; Y98-Y131 PolarHBondContact OH-O 2.88Å; V127-Y131 HydrophobicContact CG1-CE2 3.92Å; V127-Y131 WeakPolarHBondContact O-CD2 3.47Å; Y128-Y131 PolarHBondContact O-N 3.24Å; K129-Y131 VanDerWaalsContact C-N 3.3Å
132	S	88.3	Confident	89.9	Confident	22 Å²	22	63.6 Å²	63.6	15%	0.154	31%	0.314	C	S	.	.			trans	-138.8	141.4	176	-169	0	0	0	0	111.4	Y128 K129 E134	Y128-S132 VanDerWaalsContact CE1-CB 3.47Å; Y128-S132 PolarHBondContact O-N 2.96Å; K129-S132 WeakPolarHBondContact CA-O 3.24Å; S132-E134 PolarHBondContact O-N 3.19Å; S132-E134 WeakPolarHBondContact OG-CB 3.41Å; S132-E134 PolarHBondContact OG-N 3.37Å; S132-E134 VanDerWaalsContact OG-N 3.1Å
133	N	90.7	Very high	90.4	Very high	175 Å²	175	66.6 Å²	66.6	94%	0.936	32%	0.321	S	S	*	.	S	Bend	trans	-75.7	-10.8	167.7	-68.7	-27.6	0	0	0	112.3
134	E	91.4	Very high	91.1	Very high	58 Å²	58	64.2 Å²	64.2	27%	0.271	31%	0.31	S	S	.	.	S	Bend	trans	-92.6	162	-178.2	-50.9	-165	135.7	0	0	112.4	S132 K138 S139	S132-E134 PolarHBondContact O-N 3.19Å; S132-E134 WeakPolarHBondContact OG-CB 3.41Å; S132-E134 PolarHBondContact OG-N 3.37Å; S132-E134 VanDerWaalsContact OG-N 3.1Å; E134-K138 HydrophobicContact CB-CB 4.46Å; E134-K138 HydrophobicContact CB-CD 4.42Å; E134-K138 HydrophobicContact CG-CD 4.47Å; E134-K138 IonicContact OE1-NZ 2.58Å; E134-K138 PolarHBondContact OE1-NZ 3.15Å; E134-S139 WeakPolarHBondContact CB-OG 3.44Å; E134-S139 PolarHBondContact OE2-OG 3.5Å
135	S	93.8	Very high	91.7	Very high	62 Å²	62	65.3 Å²	65.3	43%	0.434	32%	0.322	S	S	.	.			trans	-71.8	148.9	165.9	68.6	0	0	0	0	110.3	W137 K138 S139	S135-W137 PolarHBondContact O-N 2.99Å; S135-W137 VanDerWaalsContact O-N 3.16Å; S135-K138 PolarHBondContact O-N 3.18Å; S135-K138 VanDerWaalsContact O-N 3.11Å; S135-K138 WeakPolarHBondContact OG-CB 3.29Å; S135-K138 PolarHBondContact OG-N 3.18Å; S135-S139 PolarHBondContact O-N 2.9Å; S135-S139 VanDerWaalsContact O-N 3.08Å; S135-S139 PolarHBondContact O-OG 3.02Å
136	I	95	Very high	92.2	Very high	4 Å²	4	65.1 Å²	65.1	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-46.1	-45.7	170.8	-69.3	170.2	0	0	0	110.4	L97 I101 F121 V124 K125 Y128 S139 I140	L97-I136 HydrophobicContact CD2-CD1 4.09Å; L97-I136 HydrophobicContact CD2-CG2 4.4Å; I101-I136 HydrophobicContact CD1-CG2 4.13Å; F121-I136 HydrophobicContact CE2-CD1 4Å; F121-I136 HydrophobicContact CE2-CG2 4.39Å; F121-I136 HydrophobicContact CZ-CD1 3.97Å; F121-I136 HydrophobicContact CZ-CG2 4.4Å; V124-I136 HydrophobicContact CG1-CD1 4.32Å; K125-I136 HydrophobicContact CB-CD1 4.16Å; Y128-I136 HydrophobicContact CD1-CG1 3.56Å; Y128-I136 HydrophobicContact CD2-CD1 4.2Å; Y128-I136 HydrophobicContact CD2-CG1 3.54Å; Y128-I136 HydrophobicContact CE1-CG1 3.94Å; Y128-I136 HydrophobicContact CE2-CG1 3.9Å; Y128-I136 HydrophobicContact CG-CD1 4.01Å; Y128-I136 HydrophobicContact CG-CG1 3.35Å; I136-S139 PolarHBondContact O-N 3.43Å; I136-I140 HydrophobicContact CG2-CD1 3.63Å; I136-I140 HydrophobicContact CG2-CG1 4.42Å; I136-I140 VanDerWaalsContact O-CG1 3.27Å; I136-I140 WeakPolarHBondContact O-CG1 3.22Å; I136-I140 PolarHBondContact O-N 3.25Å
137	W	96.7	Very high	92.9	Very high	26 Å²	26	63.5 Å²	63.5	10%	0.098	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-49.4	-179.7	-59.4	136.7	0	0	0	112.8	F121 S135 S139 I140 E141 E149 L152 Q153 V156	F121-W137 AromaticContact CE1-CZ2 3.69Å; F121-W137 HydrophobicContact CE1-CZ2 3.69Å; F121-W137 AromaticContact CE2-CH2 3.91Å; F121-W137 HydrophobicContact CE2-CH2 3.91Å; F121-W137 AromaticContact CE2-CZ2 3.76Å; F121-W137 HydrophobicContact CE2-CZ2 3.76Å; F121-W137 AromaticContact CZ-CE2 3.62Å; F121-W137 AromaticContact CZ-CH2 3.79Å; F121-W137 HydrophobicContact CZ-CH2 3.79Å; F121-W137 AromaticContact CZ-CZ2 3.16Å; F121-W137 HydrophobicContact CZ-CZ2 3.16Å; S135-W137 PolarHBondContact O-N 2.99Å; S135-W137 VanDerWaalsContact O-N 3.16Å; W137-S139 VanDerWaalsContact C-N 3.32Å; W137-S139 PolarHBondContact O-N 3.1Å; W137-I140 HydrophobicContact CE3-CD1 3.83Å; W137-I140 HydrophobicContact CZ3-CD1 3.84Å; W137-I140 PolarHBondContact O-N 3.48Å; W137-E141 PolarHBondContact O-N 3.2Å; W137-E149 HydrophobicContact CB-CG 4.1Å; W137-E149 WeakPolarHBondContact CB-OE1 3.44Å; W137-E149 HydrophobicContact CE3-CG 4.32Å; W137-E149 WeakPolarHBondContact O-CG 3.49Å; W137-L152 HydrophobicContact CZ3-CB 4.26Å; W137-Q153 HydrophobicContact CD2-CB 4.12Å; W137-Q153 HydrophobicContact CD2-CG 4.15Å; W137-Q153 HydrophobicContact CE3-CB 3.99Å; W137-Q153 VanDerWaalsContact CH2-CA 3.45Å; W137-Q153 HydrophobicContact CH2-CB 4.01Å; W137-Q153 HydrophobicContact CH2-CG 4.33Å; W137-Q153 HydrophobicContact CZ2-CB 4.06Å; W137-Q153 HydrophobicContact CZ2-CG 3.87Å; W137-Q153 HydrophobicContact CZ3-CB 3.95Å; W137-V156 HydrophobicContact CH2-CB 3.96Å; W137-V156 HydrophobicContact CH2-CG1 4.29Å; W137-V156 HydrophobicContact CH2-CG2 3.93Å; W137-V156 HydrophobicContact CZ2-CB 4.26Å; W137-V156 HydrophobicContact CZ2-CG1 4.18Å
138	K	96.4	Very high	93.8	Very high	88 Å²	88	62.7 Å²	62.7	38%	0.383	31%	0.311	S	S	.	.	H	α-helix	trans	-58	-44.9	176.6	-176	175.4	-173.6	-72.8	0	111.6	E134 S135 I140 E141 E142	E134-K138 HydrophobicContact CB-CB 4.46Å; E134-K138 HydrophobicContact CB-CD 4.42Å; E134-K138 HydrophobicContact CG-CD 4.47Å; E134-K138 IonicContact OE1-NZ 2.58Å; E134-K138 PolarHBondContact OE1-NZ 3.15Å; S135-K138 PolarHBondContact O-N 3.18Å; S135-K138 VanDerWaalsContact O-N 3.11Å; S135-K138 WeakPolarHBondContact OG-CB 3.29Å; S135-K138 PolarHBondContact OG-N 3.18Å; K138-I140 VanDerWaalsContact C-N 3.29Å; K138-I140 PolarHBondContact O-N 2.89Å; K138-E141 PolarHBondContact O-N 3.32Å; K138-E142 IonicContact NZ-OE1 2.62Å; K138-E142 PolarHBondContact NZ-OE1 2.92Å; K138-E142 WeakPolarHBondContact O-CG 3.39Å; K138-E142 PolarHBondContact O-N 2.82Å
139	S	96.7	Very high	94.3	Very high	9 Å²	9	62.8 Å²	62.8	6%	0.063	31%	0.312	C	S	.	.	H	α-helix	trans	-69.5	-23.9	178	-53.6	0	0	0	0	113.2	I101 Y128 E134 S135 I136 W137 R143	I101-S139 WeakPolarHBondContact CG2-O 3.37Å; Y128-S139 WeakPolarHBondContact OH-CB 3.43Å; Y128-S139 PolarHBondContact OH-OG 3.3Å; E134-S139 WeakPolarHBondContact CB-OG 3.44Å; E134-S139 PolarHBondContact OE2-OG 3.5Å; S135-S139 PolarHBondContact O-N 2.9Å; S135-S139 VanDerWaalsContact O-N 3.08Å; S135-S139 PolarHBondContact O-OG 3.02Å; I136-S139 PolarHBondContact O-N 3.43Å; W137-S139 VanDerWaalsContact C-N 3.32Å; W137-S139 PolarHBondContact O-N 3.1Å; S139-R143 VanDerWaalsContact O-CB 3.27Å; S139-R143 WeakPolarHBondContact O-CB 3.38Å; S139-R143 WeakPolarHBondContact O-CG 3.4Å; S139-R143 PolarHBondContact O-N 3.15Å
140	I	97.6	Very high	94.9	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-74.2	-44.7	169.9	-71.3	168.1	0	0	0	110.6	I101 T109 L113 I136 W137 K138 E142 R143 F144 E149 L152	I101-I140 HydrophobicContact CD1-CD1 4.05Å; I101-I140 HydrophobicContact CD1-CG1 3.73Å; I101-I140 HydrophobicContact CG1-CG1 4.01Å; T109-I140 HydrophobicContact CG2-CD1 4.28Å; T109-I140 HydrophobicContact CG2-CG1 4.28Å; L113-I140 HydrophobicContact CD1-CD1 3.67Å; I136-I140 HydrophobicContact CG2-CD1 3.63Å; I136-I140 HydrophobicContact CG2-CG1 4.42Å; I136-I140 VanDerWaalsContact O-CG1 3.27Å; I136-I140 WeakPolarHBondContact O-CG1 3.22Å; I136-I140 PolarHBondContact O-N 3.25Å; W137-I140 HydrophobicContact CE3-CD1 3.83Å; W137-I140 HydrophobicContact CZ3-CD1 3.84Å; W137-I140 PolarHBondContact O-N 3.48Å; K138-I140 VanDerWaalsContact C-N 3.29Å; K138-I140 PolarHBondContact O-N 2.89Å; I140-E142 VanDerWaalsContact C-N 3.35Å; I140-E142 PolarHBondContact O-N 2.97Å; I140-R143 PolarHBondContact O-N 2.71Å; I140-F144 HydrophobicContact CB-CD2 4.42Å; I140-F144 HydrophobicContact CG2-CD2 4.02Å; I140-F144 WeakPolarHBondContact O-CB 3.49Å; I140-F144 PolarHBondContact O-N 3.38Å; I140-E149 HydrophobicContact CB-CB 4.49Å; I140-E149 HydrophobicContact CB-CG 4.37Å; I140-E149 HydrophobicContact CG2-CB 3.87Å; I140-E149 HydrophobicContact CG2-CG 4.21Å; I140-L152 HydrophobicContact CG2-CD1 4.16Å
141	E	98	Very high	95.5	Very high	85 Å²	85	54 Å²	54	40%	0.397	27%	0.271	S	S	.	.	H	α-helix	trans	-57.8	-45.7	176	179.1	175.1	-169.7	0	0	111.4	W137 K138 R143 G145 K146 E149	W137-E141 PolarHBondContact O-N 3.2Å; K138-E141 PolarHBondContact O-N 3.32Å; E141-R143 VanDerWaalsContact C-N 3.3Å; E141-R143 PolarHBondContact O-N 2.9Å; E141-G145 WeakPolarHBondContact O-CA 3.22Å; E141-G145 PolarHBondContact O-N 3.46Å; E141-K146 HydrophobicContact CG-CB 4.24Å; E141-K146 HydrophobicContact CG-CD 4.39Å; E141-E149 HydrophobicContact CB-CB 4.03Å; E141-E149 HydrophobicContact CB-CG 4.09Å
142	E	97	Very high	96	Very high	119 Å²	119	49.9 Å²	49.9	56%	0.556	26%	0.255	S	S	*	.	H	α-helix	trans	-68.5	-25.9	178.7	-71.9	-172.8	178.6	0	0	114.1	K138 I140	K138-E142 IonicContact NZ-OE1 2.62Å; K138-E142 PolarHBondContact NZ-OE1 2.92Å; K138-E142 WeakPolarHBondContact O-CG 3.39Å; K138-E142 PolarHBondContact O-N 2.82Å; I140-E142 VanDerWaalsContact C-N 3.35Å; I140-E142 PolarHBondContact O-N 2.97Å
143	R	96.8	Very high	96.5	Very high	121 Å²	121	51.9 Å²	51.9	46%	0.457	26%	0.262	S	S	.	.	H	α-helix	trans	-95.6	-30	-175.9	-66.8	-75.5	167	163.4	0.8	113.6	I101 S102 S104 S139 I140 E141	I101-R143 HydrophobicContact CG2-CG 4.04Å; I101-R143 WeakPolarHBondContact O-CD 3.46Å; I101-R143 WeakPolarHBondContact O-CG 3.37Å; S102-R143 PolarHBondContact O-NH1 3.46Å; S104-R143 VanDerWaalsContact OG-CD 3.28Å; S104-R143 WeakPolarHBondContact OG-CD 3.32Å; S139-R143 VanDerWaalsContact O-CB 3.27Å; S139-R143 WeakPolarHBondContact O-CB 3.38Å; S139-R143 WeakPolarHBondContact O-CG 3.4Å; S139-R143 PolarHBondContact O-N 3.15Å; I140-R143 PolarHBondContact O-N 2.71Å; E141-R143 VanDerWaalsContact C-N 3.3Å; E141-R143 PolarHBondContact O-N 2.9Å
144	F	97.3	Very high	96.8	Very high	20 Å²	20	45 Å²	45	9%	0.088	23%	0.227	C	C	.	.	H	α-helix	trans	-133.2	-4.9	-169.8	-51	-65.7	0	0	0	113.8	S104 I106 T109 I140 T148 Q241	S104-F144 WeakPolarHBondContact O-CE1 3.32Å; I106-F144 HydrophobicContact CB-CD1 3.86Å; I106-F144 HydrophobicContact CB-CE1 3.6Å; I106-F144 HydrophobicContact CB-CZ 4.17Å; I106-F144 HydrophobicContact CD1-CB 4.39Å; I106-F144 HydrophobicContact CD1-CD1 3.93Å; I106-F144 HydrophobicContact CD1-CD2 4.01Å; I106-F144 HydrophobicContact CD1-CE1 4.16Å; I106-F144 HydrophobicContact CD1-CE2 4.22Å; I106-F144 HydrophobicContact CD1-CG 3.84Å; I106-F144 HydrophobicContact CD1-CZ 4.29Å; I106-F144 HydrophobicContact CG1-CD1 4.25Å; I106-F144 HydrophobicContact CG1-CE1 4.38Å; T109-F144 HydrophobicContact CG2-CE2 4.1Å; I140-F144 HydrophobicContact CB-CD2 4.42Å; I140-F144 HydrophobicContact CG2-CD2 4.02Å; I140-F144 WeakPolarHBondContact O-CB 3.49Å; I140-F144 PolarHBondContact O-N 3.38Å; F144-T148 HydrophobicContact CB-CG2 3.58Å; F144-T148 HydrophobicContact CG-CG2 4.36Å; F144-Q241 PolarHBondContact O-OE1 3.19Å; F144-Q241 VanDerWaalsContact O-OE1 3.1Å
145	G	97.3	Very high	97.1	Very high	28 Å²	28	42.4 Å²	42.4	29%	0.289	22%	0.216	S	C	.	.			trans	86.4	155.2	179.4	0	0	0	0	0	114	E141 T148 E149	E141-G145 WeakPolarHBondContact O-CA 3.22Å; E141-G145 PolarHBondContact O-N 3.46Å; G145-T148 PolarHBondContact O-N 3.09Å; G145-T148 VanDerWaalsContact O-N 3.14Å; G145-E149 PolarHBondContact O-N 3.44Å
146	K	97.4	Very high	97.2	Very high	84 Å²	84	39.6 Å²	39.6	37%	0.365	20%	0.196	S	C	.	.	H	α-helix	trans	-53.2	-43.6	-176.1	-175.9	52.2	171.3	157.2	0	115	E141 T148 E149 D150	E141-K146 HydrophobicContact CG-CB 4.24Å; E141-K146 HydrophobicContact CG-CD 4.39Å; K146-T148 VanDerWaalsContact C-N 3.25Å; K146-T148 PolarHBondContact O-N 2.95Å; K146-E149 WeakPolarHBondContact CD-OE2 3.37Å; K146-E149 IonicContact NZ-OE2 2.63Å; K146-E149 PolarHBondContact NZ-OE2 3.14Å; K146-E149 PolarHBondContact O-N 2.69Å; K146-E149 VanDerWaalsContact O-N 3.17Å; K146-D150 VanDerWaalsContact CE-OD1 3.23Å; K146-D150 WeakPolarHBondContact CE-OD1 3.48Å; K146-D150 WeakPolarHBondContact CE-OD2 3.36Å; K146-D150 IonicContact NZ-OD1 2.61Å; K146-D150 PolarHBondContact NZ-OD1 3.35Å; K146-D150 IonicContact NZ-OD2 2.69Å; K146-D150 PolarHBondContact O-N 2.84Å
147	P	96.9	Very high	97.2	Very high	63 Å²	63	43.2 Å²	43.2	41%	0.409	21%	0.213	S	C	.	.	H	α-helix	trans	-61	-32.1	179.1	-24.6	35.4	0	0	0	114.1	F151 M242	P147-F151 WeakPolarHBondContact O-CB 3.46Å; P147-F151 PolarHBondContact O-N 2.86Å; P147-F151 VanDerWaalsContact O-N 3.16Å; P147-M242 HydrophobicContact CB-CE 4.32Å; P147-M242 WeakPolarHBondContact O-CE 3.22Å
148	T	97.8	Very high	97.1	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-77.1	-37.2	177.8	-69.7	0	0	0	0	111.7	I106 F144 G145 K146 L152 Q241 L245	I106-T148 HydrophobicContact CD1-CG2 3.76Å; F144-T148 HydrophobicContact CB-CG2 3.58Å; F144-T148 HydrophobicContact CG-CG2 4.36Å; G145-T148 PolarHBondContact O-N 3.09Å; G145-T148 VanDerWaalsContact O-N 3.14Å; K146-T148 VanDerWaalsContact C-N 3.25Å; K146-T148 PolarHBondContact O-N 2.95Å; T148-L152 HydrophobicContact CG2-CD1 3.83Å; T148-L152 HydrophobicContact CG2-CG 4.46Å; T148-L152 WeakPolarHBondContact O-CB 3.36Å; T148-L152 WeakPolarHBondContact O-CG 3.26Å; T148-L152 PolarHBondContact O-N 2.94Å; T148-Q241 PolarHBondContact OG1-OE1 2.95Å; T148-L245 HydrophobicContact CG2-CD1 3.68Å
149	E	97.9	Very high	96.8	Very high	7 Å²	7	39.4 Å²	39.4	3%	0.033	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-51.8	171.9	-173.3	-86.8	142.7	0	0	111.5	W137 I140 E141 G145 K146 F151 L152 Q153	W137-E149 HydrophobicContact CB-CG 4.1Å; W137-E149 WeakPolarHBondContact CB-OE1 3.44Å; W137-E149 HydrophobicContact CE3-CG 4.32Å; W137-E149 WeakPolarHBondContact O-CG 3.49Å; I140-E149 HydrophobicContact CB-CB 4.49Å; I140-E149 HydrophobicContact CB-CG 4.37Å; I140-E149 HydrophobicContact CG2-CB 3.87Å; I140-E149 HydrophobicContact CG2-CG 4.21Å; E141-E149 HydrophobicContact CB-CB 4.03Å; E141-E149 HydrophobicContact CB-CG 4.09Å; G145-E149 PolarHBondContact O-N 3.44Å; K146-E149 WeakPolarHBondContact CD-OE2 3.37Å; K146-E149 IonicContact NZ-OE2 2.63Å; K146-E149 PolarHBondContact NZ-OE2 3.14Å; K146-E149 PolarHBondContact O-N 2.69Å; K146-E149 VanDerWaalsContact O-N 3.17Å; E149-F151 VanDerWaalsContact C-N 3.27Å; E149-F151 PolarHBondContact O-N 2.62Å; E149-L152 PolarHBondContact O-N 3.38Å; E149-Q153 VanDerWaalsContact O-CB 3.26Å; E149-Q153 WeakPolarHBondContact O-CB 3.35Å; E149-Q153 PolarHBondContact O-N 3.26Å
150	D	97.9	Very high	96.4	Very high	65 Å²	65	41.4 Å²	41.4	35%	0.348	21%	0.207	S	C	.	.	H	α-helix	trans	-54.4	-43	176.6	-75.8	-39.5	0	0	0	111.8	K146 C154	K146-D150 VanDerWaalsContact CE-OD1 3.23Å; K146-D150 WeakPolarHBondContact CE-OD1 3.48Å; K146-D150 WeakPolarHBondContact CE-OD2 3.36Å; K146-D150 IonicContact NZ-OD1 2.61Å; K146-D150 PolarHBondContact NZ-OD1 3.35Å; K146-D150 IonicContact NZ-OD2 2.69Å; K146-D150 PolarHBondContact O-N 2.84Å; D150-C154 VanDerWaalsContact O-CB 3.23Å; D150-C154 WeakPolarHBondContact O-CB 3.47Å; D150-C154 PolarHBondContact O-N 3.21Å
151	F	98.3	Very high	95.9	Very high	5 Å²	5	46.2 Å²	46.2	2%	0.022	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-51.2	178.7	177.5	-101.4	0	0	0	112.6	P147 E149 Q153 C154 V155 C208 M242 L245 L246 L249	P147-F151 WeakPolarHBondContact O-CB 3.46Å; P147-F151 PolarHBondContact O-N 2.86Å; P147-F151 VanDerWaalsContact O-N 3.16Å; E149-F151 VanDerWaalsContact C-N 3.27Å; E149-F151 PolarHBondContact O-N 2.62Å; F151-Q153 VanDerWaalsContact C-N 3.34Å; F151-Q153 PolarHBondContact O-N 2.96Å; F151-C154 WeakPolarHBondContact O-CB 3.48Å; F151-C154 PolarHBondContact O-N 3Å; F151-V155 HydrophobicContact CD1-CG2 4.48Å; F151-V155 HydrophobicContact CE1-CG2 4.08Å; F151-V155 HydrophobicContact CE2-CG2 4.31Å; F151-V155 HydrophobicContact CZ-CG2 4.02Å; F151-V155 WeakPolarHBondContact O-CG2 3.37Å; F151-V155 PolarHBondContact O-N 3.05Å; F151-C208 HydrophobicContact CD2-CB 3.7Å; F151-C208 HydrophobicContact CE2-CB 3.79Å; F151-M242 HydrophobicContact CB-CE 3.95Å; F151-M242 HydrophobicContact CB-SD 4.31Å; F151-M242 HydrophobicContact CD1-SD 4.37Å; F151-M242 HydrophobicContact CD2-SD 4.21Å; F151-M242 HydrophobicContact CG-CE 4.32Å; F151-M242 HydrophobicContact CG-SD 4.03Å; F151-L245 HydrophobicContact CD1-CB 4.08Å; F151-L245 HydrophobicContact CD1-CD1 4.16Å; F151-L245 HydrophobicContact CE1-CB 3.76Å; F151-L246 HydrophobicContact CE2-CD2 3.6Å; F151-L246 HydrophobicContact CZ-CD2 3.83Å; F151-L249 HydrophobicContact CE2-CD2 4.13Å; F151-L249 HydrophobicContact CZ-CB 4.21Å; F151-L249 HydrophobicContact CZ-CD2 3.65Å
152	L	97.9	Very high	95.3	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-66.5	-36.2	-178.7	-71.8	171.6	0	0	0	111.7	I106 T110 L113 W137 I140 T148 E149 V155 V156 L245	I106-L152 HydrophobicContact CD1-CD1 4.14Å; T110-L152 HydrophobicContact CG2-CD2 4.26Å; L113-L152 HydrophobicContact CD1-CB 4.26Å; L113-L152 HydrophobicContact CD1-CD1 4.04Å; L113-L152 HydrophobicContact CD1-CD2 4.44Å; L113-L152 HydrophobicContact CD1-CG 4.49Å; W137-L152 HydrophobicContact CZ3-CB 4.26Å; I140-L152 HydrophobicContact CG2-CD1 4.16Å; T148-L152 HydrophobicContact CG2-CD1 3.83Å; T148-L152 HydrophobicContact CG2-CG 4.46Å; T148-L152 WeakPolarHBondContact O-CB 3.36Å; T148-L152 WeakPolarHBondContact O-CG 3.26Å; T148-L152 PolarHBondContact O-N 2.94Å; E149-L152 PolarHBondContact O-N 3.38Å; L152-V155 PolarHBondContact O-N 3.11Å; L152-V156 WeakPolarHBondContact O-CG2 3.43Å; L152-V156 PolarHBondContact O-N 3.22Å; L152-L245 HydrophobicContact CD2-CD2 4.17Å
153	Q	97.4	Very high	94.6	Very high	65 Å²	65	46.5 Å²	46.5	30%	0.304	24%	0.235	S	C	.	.	H	α-helix	trans	-61.8	-48.7	172.1	-172.9	-179.7	46.4	0	0	111	W137 E149 F151 V155 V156 E157	W137-Q153 HydrophobicContact CD2-CB 4.12Å; W137-Q153 HydrophobicContact CD2-CG 4.15Å; W137-Q153 HydrophobicContact CE3-CB 3.99Å; W137-Q153 VanDerWaalsContact CH2-CA 3.45Å; W137-Q153 HydrophobicContact CH2-CB 4.01Å; W137-Q153 HydrophobicContact CH2-CG 4.33Å; W137-Q153 HydrophobicContact CZ2-CB 4.06Å; W137-Q153 HydrophobicContact CZ2-CG 3.87Å; W137-Q153 HydrophobicContact CZ3-CB 3.95Å; E149-Q153 VanDerWaalsContact O-CB 3.26Å; E149-Q153 WeakPolarHBondContact O-CB 3.35Å; E149-Q153 PolarHBondContact O-N 3.26Å; F151-Q153 VanDerWaalsContact C-N 3.34Å; F151-Q153 PolarHBondContact O-N 2.96Å; Q153-V155 VanDerWaalsContact C-N 3.33Å; Q153-V155 PolarHBondContact O-N 3.39Å; Q153-V156 PolarHBondContact O-N 2.92Å; Q153-E157 HydrophobicContact CG-CG 4.29Å; Q153-E157 WeakPolarHBondContact O-CG 3.48Å; Q153-E157 PolarHBondContact O-N 3.34Å
154	C	97.8	Very high	94	Very high	30 Å²	30	48.6 Å²	48.6	20%	0.203	25%	0.248	C	C	.	.	H	α-helix	trans	-57.6	-43	176.9	179	0	0	0	0	112.4	D150 F151 T158 C208	D150-C154 VanDerWaalsContact O-CB 3.23Å; D150-C154 WeakPolarHBondContact O-CB 3.47Å; D150-C154 PolarHBondContact O-N 3.21Å; F151-C154 WeakPolarHBondContact O-CB 3.48Å; F151-C154 PolarHBondContact O-N 3Å; C154-T158 WeakPolarHBondContact O-CB 3.4Å; C154-T158 PolarHBondContact O-N 2.86Å; C154-T158 PolarHBondContact O-OG1 2.68Å; C154-C208 CarbonylContact C-O 3.51Å; C154-C208 HydrophobicContact CB-CB 3.52Å; C154-C208 WeakPolarHBondContact CB-SG 3.46Å; C154-C208 WeakPolarHBondContact SG-CB 3.02Å; C154-C208 PolarHBondContact SG-O 3.25Å; C154-C208 VanDerWaalsContact SG-O 3.36Å; C154-C208 CovalentContact SG-SG 2.04Å; C154-C208 PolarHBondContact SG-SG 3.36Å
155	V	97.3	Very high	93.3	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.024	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-43.6	176.4	173.1	0	0	0	0	112	I114 F151 L152 Q153 R159 C208 L249	I114-V155 HydrophobicContact CG2-CG1 4.14Å; F151-V155 HydrophobicContact CD1-CG2 4.48Å; F151-V155 HydrophobicContact CE1-CG2 4.08Å; F151-V155 HydrophobicContact CE2-CG2 4.31Å; F151-V155 HydrophobicContact CZ-CG2 4.02Å; F151-V155 WeakPolarHBondContact O-CG2 3.37Å; F151-V155 PolarHBondContact O-N 3.05Å; L152-V155 PolarHBondContact O-N 3.11Å; Q153-V155 VanDerWaalsContact C-N 3.33Å; Q153-V155 PolarHBondContact O-N 3.39Å; V155-R159 WeakPolarHBondContact O-CD 3.47Å; V155-R159 WeakPolarHBondContact O-CG 3.38Å; V155-R159 PolarHBondContact O-N 3.21Å; V155-C208 HydrophobicContact CG2-CB 3.9Å; V155-L249 HydrophobicContact CG1-CD1 3.93Å; V155-L249 HydrophobicContact CG2-CD1 4.16Å; V155-L249 HydrophobicContact CG2-CD2 3.88Å
156	V	95.5	Very high	92.3	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.018	27%	0.265	C	S	.	.	H	α-helix	trans	-66.4	-46.8	179.3	164.5	0	0	0	0	111.5	L113 F121 W137 L152 Q153 T158 R159 K160	L113-V156 HydrophobicContact CB-CG2 4.15Å; L113-V156 HydrophobicContact CD2-CG2 4.17Å; F121-V156 HydrophobicContact CB-CG1 3.87Å; F121-V156 HydrophobicContact CD1-CG1 3.77Å; F121-V156 HydrophobicContact CD2-CG1 3.63Å; F121-V156 HydrophobicContact CD2-CG2 4.32Å; F121-V156 HydrophobicContact CE1-CG1 4.23Å; F121-V156 HydrophobicContact CE2-CG1 4.11Å; F121-V156 HydrophobicContact CG-CG1 3.43Å; F121-V156 VanDerWaalsContact CG-CG1 3.43Å; F121-V156 HydrophobicContact CZ-CG1 4.39Å; W137-V156 HydrophobicContact CH2-CB 3.96Å; W137-V156 HydrophobicContact CH2-CG1 4.29Å; W137-V156 HydrophobicContact CH2-CG2 3.93Å; W137-V156 HydrophobicContact CZ2-CB 4.26Å; W137-V156 HydrophobicContact CZ2-CG1 4.18Å; L152-V156 WeakPolarHBondContact O-CG2 3.43Å; L152-V156 PolarHBondContact O-N 3.22Å; Q153-V156 PolarHBondContact O-N 2.92Å; V156-T158 VanDerWaalsContact C-N 3.32Å; V156-T158 PolarHBondContact O-N 3.48Å; V156-R159 PolarHBondContact O-N 3.01Å; V156-K160 PolarHBondContact O-N 2.88Å
157	E	95.1	Very high	91.4	Very high	80 Å²	80	55.3 Å²	55.3	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-64.7	-36.7	180	-65.4	-61.6	139.4	0	0	111.5	Q153 R159 K160	Q153-E157 HydrophobicContact CG-CG 4.29Å; Q153-E157 WeakPolarHBondContact O-CG 3.48Å; Q153-E157 PolarHBondContact O-N 3.34Å; E157-R159 PolarHBondContact O-N 3.03Å; E157-K160 PolarHBondContact O-N 3.04Å; E157-K160 WeakPolarHBondContact OE1-CE 3.43Å; E157-K160 IonicContact OE1-NZ 2.71Å; E157-K160 PolarHBondContact OE1-NZ 2.92Å; E157-K160 WeakPolarHBondContact OE2-CD 3.37Å; E157-K160 IonicContact OE2-NZ 2.74Å; E157-K160 PolarHBondContact OE2-NZ 3.49Å
158	T	94.2	Very high	90.4	Very high	30 Å²	30	57 Å²	57	18%	0.184	29%	0.287	C	S	.	.	H	α-helix	trans	-58.3	-32.4	171	-64.4	0	0	0	0	112.8	C154 V156 C208 N211	C154-T158 WeakPolarHBondContact O-CB 3.4Å; C154-T158 PolarHBondContact O-N 2.86Å; C154-T158 PolarHBondContact O-OG1 2.68Å; V156-T158 VanDerWaalsContact C-N 3.32Å; V156-T158 PolarHBondContact O-N 3.48Å; T158-C208 PolarHBondContact OG1-O 3.21Å; T158-N211 HydrophobicContact CG2-CB 4.17Å
159	R	90.4	Very high	89.1	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.015	33%	0.327	C	S	.	.	H	α-helix	trans	-87.2	-9.4	-179.3	-69.3	165.2	178.8	-99.1	12.6	114.7	I114 F116 W117 G118 V155 V156 E157 V161 Y252	I114-R159 PolarHBondContact O-NE 3.42Å; I114-R159 PolarHBondContact O-NH1 3.26Å; I114-R159 PolarHBondContact O-NH2 2.9Å; I114-R159 VanDerWaalsContact O-NH2 3.11Å; F116-R159 WeakPolarHBondContact O-CB 3.33Å; F116-R159 WeakPolarHBondContact O-CD 3.48Å; W117-R159 HydrophobicContact CD2-CB 4.38Å; W117-R159 HydrophobicContact CD2-CG 4.45Å; W117-R159 HydrophobicContact CE3-CB 4.16Å; W117-R159 HydrophobicContact CE3-CG 4.24Å; W117-R159 HydrophobicContact CZ3-CG 4.49Å; G118-R159 PolarHBondContact N-O 3.43Å; V155-R159 WeakPolarHBondContact O-CD 3.47Å; V155-R159 WeakPolarHBondContact O-CG 3.38Å; V155-R159 PolarHBondContact O-N 3.21Å; V156-R159 PolarHBondContact O-N 3.01Å; E157-R159 PolarHBondContact O-N 3.03Å; R159-V161 VanDerWaalsContact C-N 3.3Å; R159-Y252 PolarHBondContact NH1-OH 3.3Å
160	K	89.9	Confident	87.7	Confident	51 Å²	51	72.9 Å²	72.9	22%	0.222	37%	0.366	C	S	.	.	H	α-helix	trans	-72	-26.5	169.8	-66.8	-172	173.8	171.4	0	112.4	D122 V156 E157 K162	D122-K160 IonicContact OD1-NZ 2.63Å; D122-K160 PolarHBondContact OD1-NZ 3.27Å; D122-K160 WeakPolarHBondContact OD2-CE 3.45Å; D122-K160 IonicContact OD2-NZ 3.45Å; D122-K160 PolarHBondContact OD2-NZ 3.01Å; V156-K160 PolarHBondContact O-N 2.88Å; E157-K160 PolarHBondContact O-N 3.04Å; E157-K160 WeakPolarHBondContact OE1-CE 3.43Å; E157-K160 IonicContact OE1-NZ 2.71Å; E157-K160 PolarHBondContact OE1-NZ 2.92Å; E157-K160 WeakPolarHBondContact OE2-CD 3.37Å; E157-K160 IonicContact OE2-NZ 2.74Å; E157-K160 PolarHBondContact OE2-NZ 3.49Å; K160-K162 PolarHBondContact O-N 3.38Å
161	V	87.3	Confident	86.4	Confident	100 Å²	100	71.3 Å²	71.3	61%	0.606	36%	0.358	S	S	*	.	S	Bend	trans	-69	116.5	-179.2	-176.5	0	0	0	0	110	R159 I163	R159-V161 VanDerWaalsContact C-N 3.3Å; V161-I163 PolarHBondContact O-N 3.49Å
162	K	83.5	Confident	84.4	Confident	179 Å²	179	78.6 Å²	78.6	78%	0.778	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-62.9	121.9	176.3	-175.8	175.5	-179.2	177.5	0	110.4	K160	K160-K162 PolarHBondContact O-N 3.38Å
163	I	83.8	Confident	83	Confident	32 Å²	32	79.7 Å²	79.7	16%	0.164	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-81.3	132.9	178.9	-64.7	176.1	0	0	0	109.1	W117 V161 P175 N211 F213	W117-I163 HydrophobicContact CH2-CD1 4.34Å; W117-I163 HydrophobicContact CZ3-CD1 3.65Å; V161-I163 PolarHBondContact O-N 3.49Å; I163-P175 HydrophobicContact CG2-CB 3.79Å; I163-N211 HydrophobicContact CD1-CB 3.92Å; I163-F213 HydrophobicContact CD1-CD2 3.65Å; I163-F213 HydrophobicContact CD1-CE2 3.5Å; I163-F213 HydrophobicContact CG2-CD2 4.19Å; I163-F213 HydrophobicContact CG2-CE2 4.11Å
164	K	84.2	Confident	81.9	Confident	165 Å²	165	80.6 Å²	80.6	72%	0.717	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-70.7	145.6	176.1	-63.3	-177	179.1	-177.9	0	109	I176	K164-I176 HydrophobicContact CB-CB 4.24Å; K164-I176 HydrophobicContact CB-CD1 4.05Å; K164-I176 HydrophobicContact CB-CG1 4.46Å; K164-I176 PolarHBondContact O-N 2.84Å
165	Q	82.8	Confident	81.2	Confident	98 Å²	98	80.3 Å²	80.3	46%	0.458	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	-113.2	149.5	177.9	-68.8	175.1	-64.6	0	0	110.3	G173 K174 I176	Q165-G173 WeakPolarHBondContact CG-O 3.41Å; Q165-G173 PolarHBondContact NE2-O 2.81Å; Q165-K174 CarbonylContact C-O 3.52Å; Q165-K174 VanDerWaalsContact CA-O 3.24Å; Q165-K174 WeakPolarHBondContact CA-O 3.37Å; Q165-I176 WeakPolarHBondContact O-CD1 3.37Å
166	E	75.7	Confident	80.6	Confident	59 Å²	59	84.2 Å²	84.2	28%	0.276	42%	0.422	S	S	.	.			trans	-65.5	142.3	172.5	-68.3	-173	-118.9	0	0	110.8	T171 G173 K174 I176	E166-T171 WeakPolarHBondContact OE2-CB 3.12Å; E166-T171 PolarHBondContact OE2-OG1 3.44Å; E166-G173 PolarHBondContact O-N 3.13Å; E166-K174 HydrophobicContact CG-CB 4.45Å; E166-K174 PolarHBondContact N-O 2.95Å; E166-I176 HydrophobicContact CG-CD1 4.35Å; E166-I176 HydrophobicContact CG-CG1 3.68Å
167	T	77.2	Confident	80.4	Confident	116 Å²	116	86.1 Å²	86.1	71%	0.712	43%	0.434	S	S	*	.			trans	-111.3	0.6	-175.8	54.8	0	0	0	0	113.3
168	N	76.8	Confident	80.2	Confident	98 Å²	98	86.5 Å²	86.5	52%	0.524	44%	0.438	S	S	.	.	S	Bend	trans	-77.6	148.1	176.9	-49.7	-37.4	0	0	0	109.4	D170 T171 F172	N168-D170 PolarHBondContact O-N 3.42Å; N168-T171 CarbonylContact O-C 3.53Å; N168-T171 PolarHBondContact O-N 3.04Å; N168-F172 VanDerWaalsContact O-CA 3.28Å; N168-F172 WeakPolarHBondContact O-CA 3.48Å; N168-F172 WeakPolarHBondContact O-CB 3.47Å; N168-F172 PolarHBondContact O-N 3.09Å
169	E	69.7	Low	80.3	Confident	188 Å²	188	88.7 Å²	88.7	88%	0.879	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-59.4	-44.3	-174.9	-62.1	-178	166.6	0	0	112.5	T171	E169-T171 VanDerWaalsContact C-N 3.27Å; E169-T171 PolarHBondContact O-N 3.48Å
170	D	69.9	Low	80.5	Confident	158 Å²	158	91.6 Å²	91.6	85%	0.845	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-68.8	-18.9	-178.8	-58.6	-47	0	0	0	114.8	N168	N168-D170 PolarHBondContact O-N 3.42Å
171	T	70.7	Confident	80.6	Confident	31 Å²	31	92.2 Å²	92.2	19%	0.19	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-127.9	11.5	-174.4	59	0	0	0	0	113.2	E166 N168 E169 G173 K174	E166-T171 WeakPolarHBondContact OE2-CB 3.12Å; E166-T171 PolarHBondContact OE2-OG1 3.44Å; N168-T171 CarbonylContact O-C 3.53Å; N168-T171 PolarHBondContact O-N 3.04Å; E169-T171 VanDerWaalsContact C-N 3.27Å; E169-T171 PolarHBondContact O-N 3.48Å; T171-G173 PolarHBondContact O-N 3.22Å; T171-K174 HydrophobicContact CG2-CD 4.19Å; T171-K174 VanDerWaalsContact O-CB 3.23Å; T171-K174 WeakPolarHBondContact O-CB 3.38Å; T171-K174 WeakPolarHBondContact O-CG 3.24Å; T171-K174 PolarHBondContact O-N 3.36Å
172	F	55.3	Low	81	Confident	158 Å²	158	87.5 Å²	87.5	69%	0.693	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	126.7	-170.1	-173.6	-96.6	0	0	0	112.4	N168 K174	N168-F172 VanDerWaalsContact O-CA 3.28Å; N168-F172 WeakPolarHBondContact O-CA 3.48Å; N168-F172 WeakPolarHBondContact O-CB 3.47Å; N168-F172 PolarHBondContact O-N 3.09Å; F172-K174 VanDerWaalsContact C-N 3.31Å; F172-K174 PolarHBondContact O-N 2.99Å
173	G	68.1	Low	81.6	Confident	24 Å²	24	81.8 Å²	81.8	25%	0.247	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-10.2	-179.5	0	0	0	0	0	115.4	Q165 E166 T171	Q165-G173 WeakPolarHBondContact CG-O 3.41Å; Q165-G173 PolarHBondContact NE2-O 2.81Å; E166-G173 PolarHBondContact O-N 3.13Å; T171-G173 PolarHBondContact O-N 3.22Å
174	K	75.3	Confident	82.1	Confident	84 Å²	84	85.7 Å²	85.7	37%	0.365	44%	0.437	S	S	.	.			trans	-61.9	140.3	173.5	-72.3	-177.1	178.1	173.4	0	110.7	Q165 E166 T171 F172 I176	Q165-K174 CarbonylContact C-O 3.52Å; Q165-K174 VanDerWaalsContact CA-O 3.24Å; Q165-K174 WeakPolarHBondContact CA-O 3.37Å; E166-K174 HydrophobicContact CG-CB 4.45Å; E166-K174 PolarHBondContact N-O 2.95Å; T171-K174 HydrophobicContact CG2-CD 4.19Å; T171-K174 VanDerWaalsContact O-CB 3.23Å; T171-K174 WeakPolarHBondContact O-CB 3.38Å; T171-K174 WeakPolarHBondContact O-CG 3.24Å; T171-K174 PolarHBondContact O-N 3.36Å; F172-K174 VanDerWaalsContact C-N 3.31Å; F172-K174 PolarHBondContact O-N 2.99Å; K174-I176 PolarHBondContact O-N 3.19Å
175	P	82.9	Confident	82.6	Confident	25 Å²	25	78.1 Å²	78.1	16%	0.162	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-73.5	126.6	-177.4	28.9	-33.8	0	0	0	111.6	I163 V177 F213	I163-P175 HydrophobicContact CG2-CB 3.79Å; P175-V177 PolarHBondContact O-N 3.41Å; P175-V177 VanDerWaalsContact O-N 3.1Å; P175-F213 HydrophobicContact CB-CD1 4.2Å; P175-F213 HydrophobicContact CB-CD2 3.4Å; P175-F213 VanDerWaalsContact CB-CD2 3.4Å; P175-F213 HydrophobicContact CB-CE1 4.22Å; P175-F213 HydrophobicContact CB-CE2 3.39Å; P175-F213 HydrophobicContact CB-CG 3.83Å; P175-F213 HydrophobicContact CB-CZ 3.83Å; P175-F213 HydrophobicContact CG-CB 4.37Å; P175-F213 HydrophobicContact CG-CD1 3.52Å; P175-F213 HydrophobicContact CG-CD2 3.71Å; P175-F213 HydrophobicContact CG-CE1 3.63Å; P175-F213 HydrophobicContact CG-CE2 3.77Å; P175-F213 HydrophobicContact CG-CG 3.59Å; P175-F213 HydrophobicContact CG-CZ 3.74Å
176	I	85.6	Confident	83.1	Confident	86 Å²	86	73.6 Å²	73.6	44%	0.441	38%	0.384	S	S	.	.			trans	-73.3	105.1	174.9	-60.7	176.6	0	0	0	108.9	K164 Q165 E166 K174	K164-I176 HydrophobicContact CB-CB 4.24Å; K164-I176 HydrophobicContact CB-CD1 4.05Å; K164-I176 HydrophobicContact CB-CG1 4.46Å; K164-I176 PolarHBondContact O-N 2.84Å; Q165-I176 WeakPolarHBondContact O-CD1 3.37Å; E166-I176 HydrophobicContact CG-CD1 4.35Å; E166-I176 HydrophobicContact CG-CG1 3.68Å; K174-I176 PolarHBondContact O-N 3.19Å
177	V	89.4	Confident	83.9	Confident	43 Å²	43	75.7 Å²	75.7	26%	0.261	39%	0.393	S	S	.	.			trans	-76	124.6	179	-171.7	0	0	0	0	110.5	P175 M179 V182 F213 Q214 A217	P175-V177 PolarHBondContact O-N 3.41Å; P175-V177 VanDerWaalsContact O-N 3.1Å; V177-M179 VanDerWaalsContact C-N 3.31Å; V177-M179 HydrophobicContact CB-SD 4.39Å; V177-M179 HydrophobicContact CG1-SD 3.89Å; V177-M179 PolarHBondContact O-N 3.4Å; V177-V182 HydrophobicContact CG1-CG2 4.06Å; V177-F213 HydrophobicContact CG2-CB 3.76Å; V177-Q214 HydrophobicContact CG1-CB 4.47Å; V177-Q214 HydrophobicContact CG1-CG 3.86Å; V177-A217 HydrophobicContact CG1-CB 4.02Å
178	N	92.1	Very high	84.6	Confident	87 Å²	87	74.1 Å²	74.1	47%	0.465	38%	0.375	S	S	.	.			trans	-75.5	84.8	171.4	179.4	4	0	0	0	110.4	S180 E181 Q214	N178-S180 PolarHBondContact O-N 3.11Å; N178-S180 VanDerWaalsContact OD1-CB 3.31Å; N178-S180 WeakPolarHBondContact OD1-CB 3.31Å; N178-S180 PolarHBondContact OD1-N 3.24Å; N178-E181 PolarHBondContact O-N 2.88Å; N178-Q214 PolarHBondContact O-NE2 2.89Å
179	M	95	Very high	85.2	Confident	76 Å²	76	69.5 Å²	69.5	37%	0.374	35%	0.35	S	S	.	.	H	α-helix	trans	-62.1	-18.6	178.9	-68.9	-56.6	-64.9	0	0	114.1	V177 E181 V182 N183 A217 M221	V177-M179 VanDerWaalsContact C-N 3.31Å; V177-M179 HydrophobicContact CB-SD 4.39Å; V177-M179 HydrophobicContact CG1-SD 3.89Å; V177-M179 PolarHBondContact O-N 3.4Å; M179-E181 VanDerWaalsContact C-N 3.31Å; M179-E181 PolarHBondContact O-N 2.97Å; M179-V182 HydrophobicContact CE-CB 4.24Å; M179-V182 HydrophobicContact CE-CG1 4.21Å; M179-V182 PolarHBondContact O-N 3.02Å; M179-V182 HydrophobicContact SD-CB 4.23Å; M179-V182 HydrophobicContact SD-CG2 4.09Å; M179-N183 VanDerWaalsContact O-CB 3.25Å; M179-N183 WeakPolarHBondContact O-CB 3.27Å; M179-N183 PolarHBondContact O-N 3.43Å; M179-N183 PolarHBondContact O-ND2 2.84Å; M179-A217 HydrophobicContact SD-CB 3.96Å; M179-M221 HydrophobicContact CE-SD 3.97Å
180	S	94.8	Very high	86	Confident	66 Å²	66	63.8 Å²	63.8	46%	0.462	33%	0.325	S	S	.	.	H	α-helix	trans	-61.8	-41.7	174	-172.8	0	0	0	0	111.1	N178 K184	N178-S180 PolarHBondContact O-N 3.11Å; N178-S180 VanDerWaalsContact OD1-CB 3.31Å; N178-S180 WeakPolarHBondContact OD1-CB 3.31Å; N178-S180 PolarHBondContact OD1-N 3.24Å; S180-K184 VanDerWaalsContact O-CG 3.23Å; S180-K184 WeakPolarHBondContact O-CG 3.44Å; S180-K184 PolarHBondContact O-N 3.49Å
181	E	93.2	Very high	86.8	Confident	64 Å²	64	64.8 Å²	64.8	30%	0.299	32%	0.322	S	S	.	.	H	α-helix	trans	-76.6	-34	-179.8	-152.2	59.8	-147.1	0	0	112.6	N178 M179 K184 T185 L210	N178-E181 PolarHBondContact O-N 2.88Å; M179-E181 VanDerWaalsContact C-N 3.31Å; M179-E181 PolarHBondContact O-N 2.97Å; E181-K184 IonicContact OE2-NZ 3.66Å; E181-K184 PolarHBondContact OE2-NZ 3.41Å; E181-T185 WeakPolarHBondContact O-CB 3.49Å; E181-T185 PolarHBondContact O-N 3.2Å; E181-T185 PolarHBondContact O-OG1 2.69Å; E181-L210 HydrophobicContact CG-CD2 4.32Å
182	V	96	Very high	87.2	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61.6	-51.9	172.1	-173	0	0	0	0	109.7	V177 M179 K184 T185 F186 Q214 A217 L218 M221	V177-V182 HydrophobicContact CG1-CG2 4.06Å; M179-V182 HydrophobicContact CE-CB 4.24Å; M179-V182 HydrophobicContact CE-CG1 4.21Å; M179-V182 PolarHBondContact O-N 3.02Å; M179-V182 HydrophobicContact SD-CB 4.23Å; M179-V182 HydrophobicContact SD-CG2 4.09Å; V182-K184 PolarHBondContact O-N 2.93Å; V182-T185 PolarHBondContact O-N 2.92Å; V182-T185 VanDerWaalsContact O-N 3.16Å; V182-F186 WeakPolarHBondContact O-CB 3.23Å; V182-F186 PolarHBondContact O-N 3.41Å; V182-Q214 HydrophobicContact CG2-CB 3.77Å; V182-Q214 HydrophobicContact CG2-CG 3.96Å; V182-A217 HydrophobicContact CG1-CB 4.17Å; V182-A217 HydrophobicContact CG2-CB 4.23Å; V182-L218 HydrophobicContact CG1-CB 4.09Å; V182-L218 HydrophobicContact CG1-CD1 4.31Å; V182-M221 HydrophobicContact CG1-SD 3.65Å
183	N	95.9	Very high	87.2	Confident	59 Å²	59	66 Å²	66	32%	0.316	33%	0.325	S	S	.	.	H	α-helix	trans	-62.7	-40.5	-180	-69.5	-12.3	0	0	0	112.3	M179 H187 M221	M179-N183 VanDerWaalsContact O-CB 3.25Å; M179-N183 WeakPolarHBondContact O-CB 3.27Å; M179-N183 PolarHBondContact O-N 3.43Å; M179-N183 PolarHBondContact O-ND2 2.84Å; N183-H187 VanDerWaalsContact O-CB 3.32Å; N183-H187 WeakPolarHBondContact O-CB 3.44Å; N183-H187 PolarHBondContact O-CD2 3.45Å; N183-H187 VanDerWaalsContact O-CG 3.28Å; N183-H187 PolarHBondContact O-N 2.97Å; N183-M221 VanDerWaalsContact OD1-CE 3.26Å; N183-M221 WeakPolarHBondContact OD1-CE 3.46Å
184	K	94.6	Very high	86.6	Confident	114 Å²	114	71.6 Å²	71.6	50%	0.496	35%	0.35	S	S	.	.	H	α-helix	trans	-57.5	-49	172.5	-75.6	171.8	-152.3	166.5	0	111.4	S180 E181 V182 Y188	S180-K184 VanDerWaalsContact O-CG 3.23Å; S180-K184 WeakPolarHBondContact O-CG 3.44Å; S180-K184 PolarHBondContact O-N 3.49Å; E181-K184 IonicContact OE2-NZ 3.66Å; E181-K184 PolarHBondContact OE2-NZ 3.41Å; V182-K184 PolarHBondContact O-N 2.93Å; K184-Y188 WeakPolarHBondContact O-CB 3.42Å; K184-Y188 PolarHBondContact O-N 3.49Å
185	T	93.9	Very high	85.8	Confident	6 Å²	6	67.8 Å²	67.8	4%	0.037	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-47.9	-179.4	-58.3	0	0	0	0	111	E181 V182 Y188 L189 L206 L210 L218	E181-T185 WeakPolarHBondContact O-CB 3.49Å; E181-T185 PolarHBondContact O-N 3.2Å; E181-T185 PolarHBondContact O-OG1 2.69Å; V182-T185 PolarHBondContact O-N 2.92Å; V182-T185 VanDerWaalsContact O-N 3.16Å; T185-Y188 PolarHBondContact O-N 2.67Å; T185-L189 HydrophobicContact CG2-CD1 3.74Å; T185-L189 HydrophobicContact CG2-CG 4.44Å; T185-L189 WeakPolarHBondContact O-CB 3.15Å; T185-L189 WeakPolarHBondContact O-CD1 3Å; T185-L189 VanDerWaalsContact O-CG 3.24Å; T185-L189 WeakPolarHBondContact O-CG 3.41Å; T185-L189 PolarHBondContact O-N 3.27Å; T185-L206 HydrophobicContact CG2-CB 4.37Å; T185-L210 HydrophobicContact CG2-CD1 4.21Å; T185-L218 HydrophobicContact CG2-CD2 4.17Å
186	F	93.7	Very high	84.7	Confident	4 Å²	4	70.5 Å²	70.5	2%	0.018	35%	0.35	C	S	.	.	H	α-helix	trans	-57.2	-51.6	176	-174.4	-108.6	0	0	0	112.2	V182 Y188 L189 L190 L218 M221 Y222 D225	V182-F186 WeakPolarHBondContact O-CB 3.23Å; V182-F186 PolarHBondContact O-N 3.41Å; F186-Y188 VanDerWaalsContact C-N 3.34Å; F186-Y188 PolarHBondContact O-N 3.12Å; F186-L189 PolarHBondContact O-N 2.87Å; F186-L190 HydrophobicContact CD1-CD1 3.79Å; F186-L190 HydrophobicContact CD1-CG 4.44Å; F186-L190 HydrophobicContact CE1-CD1 3.45Å; F186-L190 VanDerWaalsContact CE1-CD1 3.45Å; F186-L190 HydrophobicContact CE1-CG 4.27Å; F186-L190 HydrophobicContact CZ-CD1 3.93Å; F186-L190 HydrophobicContact CZ-CG 4.39Å; F186-L190 WeakPolarHBondContact O-CG 3.34Å; F186-L190 PolarHBondContact O-N 2.89Å; F186-L218 HydrophobicContact CB-CD1 3.78Å; F186-L218 HydrophobicContact CD2-CD1 3.99Å; F186-L218 HydrophobicContact CG-CD1 4.39Å; F186-M221 HydrophobicContact CB-CE 4.08Å; F186-M221 HydrophobicContact CB-SD 4.37Å; F186-M221 HydrophobicContact CD1-CE 3.41Å; F186-M221 VanDerWaalsContact CD1-CE 3.41Å; F186-M221 HydrophobicContact CD2-CB 3.96Å; F186-M221 HydrophobicContact CD2-CE 4.33Å; F186-M221 HydrophobicContact CE1-CE 3.79Å; F186-M221 HydrophobicContact CE2-CB 3.79Å; F186-M221 HydrophobicContact CG-CB 4.47Å; F186-M221 HydrophobicContact CG-CE 3.7Å; F186-M221 HydrophobicContact CG-SD 4.29Å; F186-M221 HydrophobicContact CZ-CB 4.15Å; F186-M221 HydrophobicContact CZ-CE 4.42Å; F186-Y222 AromaticContact CD2-CD2 3.68Å; F186-Y222 HydrophobicContact CD2-CD2 3.68Å; F186-Y222 AromaticContact CD2-CE2 3.52Å; F186-Y222 HydrophobicContact CD2-CE2 3.52Å; F186-Y222 AromaticContact CE2-CD2 3.63Å; F186-Y222 HydrophobicContact CE2-CD2 3.63Å; F186-Y222 AromaticContact CE2-CE2 3.77Å; F186-Y222 HydrophobicContact CE2-CE2 3.77Å; F186-Y222 HydrophobicContact CE2-CG 4.21Å; F186-D225 WeakPolarHBondContact CE1-OD2 3.39Å; F186-D225 HydrophobicContact CZ-CB 3.98Å; F186-D225 WeakPolarHBondContact CZ-OD2 3.37Å
187	H	92	Very high	84.1	Confident	102 Å²	102	71.8 Å²	71.8	47%	0.472	36%	0.357	S	S	.	.	H	α-helix	trans	-65.2	-33.6	178.1	-69.6	-44.6	0	0	0	113.3	N183 K191	N183-H187 VanDerWaalsContact O-CB 3.32Å; N183-H187 WeakPolarHBondContact O-CB 3.44Å; N183-H187 PolarHBondContact O-CD2 3.45Å; N183-H187 VanDerWaalsContact O-CG 3.28Å; N183-H187 PolarHBondContact O-N 2.97Å; H187-K191 WeakPolarHBondContact O-CB 3.38Å; H187-K191 VanDerWaalsContact O-CG 3.29Å; H187-K191 WeakPolarHBondContact O-CG 3.27Å; H187-K191 PolarHBondContact O-N 2.94Å
188	Y	91.9	Very high	83.9	Confident	83 Å²	83	70.2 Å²	70.2	33%	0.325	35%	0.347	S	S	.	.	H	α-helix	trans	-62.8	-48.6	172.3	178.8	-88.5	0	0	0	110.9	K184 T185 F186 L190 K191 Q192 I198 L206	K184-Y188 WeakPolarHBondContact O-CB 3.42Å; K184-Y188 PolarHBondContact O-N 3.49Å; T185-Y188 PolarHBondContact O-N 2.67Å; F186-Y188 VanDerWaalsContact C-N 3.34Å; F186-Y188 PolarHBondContact O-N 3.12Å; Y188-L190 VanDerWaalsContact C-N 3.32Å; Y188-L190 PolarHBondContact O-N 3.44Å; Y188-K191 PolarHBondContact O-N 3.47Å; Y188-Q192 HydrophobicContact CD1-CG 4.5Å; Y188-Q192 HydrophobicContact CE1-CG 4.14Å; Y188-Q192 PolarHBondContact O-N 3.07Å; Y188-I198 HydrophobicContact CE1-CD1 4.27Å; Y188-L206 HydrophobicContact CD1-CD1 3.6Å; Y188-L206 HydrophobicContact CE1-CD1 3.7Å
189	L	90.2	Very high	83.7	Confident	2 Å²	2	69.5 Å²	69.5	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-65.5	-31.4	-179.8	-67.5	162.7	0	0	0	113.2	T185 F186 I198 L203 L206 L218 Y222 F230	T185-L189 HydrophobicContact CG2-CD1 3.74Å; T185-L189 HydrophobicContact CG2-CG 4.44Å; T185-L189 WeakPolarHBondContact O-CB 3.15Å; T185-L189 WeakPolarHBondContact O-CD1 3Å; T185-L189 VanDerWaalsContact O-CG 3.24Å; T185-L189 WeakPolarHBondContact O-CG 3.41Å; T185-L189 PolarHBondContact O-N 3.27Å; F186-L189 PolarHBondContact O-N 2.87Å; L189-I198 HydrophobicContact CD2-CD1 3.39Å; L189-L203 HydrophobicContact CD2-CD1 4.24Å; L189-L206 HydrophobicContact CD2-CD1 4.18Å; L189-L218 HydrophobicContact CD1-CD2 4.3Å; L189-Y222 WeakPolarHBondContact CB-OH 3.28Å; L189-Y222 HydrophobicContact CD1-CE2 4.31Å; L189-F230 HydrophobicContact CD1-CE2 3.8Å; L189-F230 HydrophobicContact CD1-CZ 4.08Å
190	L	86.7	Confident	83.6	Confident	68 Å²	68	68.7 Å²	68.7	36%	0.356	34%	0.342	S	S	.	.	H	α-helix	trans	-70	-42.3	170.6	-75.1	179.7	0	0	0	112.7	F186 Y188 Q192 L226	F186-L190 HydrophobicContact CD1-CD1 3.79Å; F186-L190 HydrophobicContact CD1-CG 4.44Å; F186-L190 HydrophobicContact CE1-CD1 3.45Å; F186-L190 VanDerWaalsContact CE1-CD1 3.45Å; F186-L190 HydrophobicContact CE1-CG 4.27Å; F186-L190 HydrophobicContact CZ-CD1 3.93Å; F186-L190 HydrophobicContact CZ-CG 4.39Å; F186-L190 WeakPolarHBondContact O-CG 3.34Å; F186-L190 PolarHBondContact O-N 2.89Å; Y188-L190 VanDerWaalsContact C-N 3.32Å; Y188-L190 PolarHBondContact O-N 3.44Å; L190-Q192 VanDerWaalsContact C-N 3.26Å; L190-Q192 PolarHBondContact O-N 3.3Å; L190-L226 HydrophobicContact CD2-CD1 3.83Å; L190-L226 HydrophobicContact CD2-CD2 4.08Å; L190-L226 HydrophobicContact CD2-CG 4.47Å
191	K	85	Confident	83.5	Confident	178 Å²	178	69.2 Å²	69.2	77%	0.774	34%	0.337	S	S	*	.	H	α-helix	trans	-64.9	-28.6	-179.8	-81.3	177.5	178.8	-178	0	113.1	H187 Y188 K193	H187-K191 WeakPolarHBondContact O-CB 3.38Å; H187-K191 VanDerWaalsContact O-CG 3.29Å; H187-K191 WeakPolarHBondContact O-CG 3.27Å; H187-K191 PolarHBondContact O-N 2.94Å; Y188-K191 PolarHBondContact O-N 3.47Å; K191-K193 VanDerWaalsContact C-N 3.3Å; K191-K193 PolarHBondContact O-N 3.31Å
192	Q	79.2	Confident	83.4	Confident	47 Å²	47	69.5 Å²	69.5	22%	0.22	34%	0.338	C	S	.	.	S	Bend	trans	-66.9	92.8	166.6	-56.5	-50.5	-30.3	0	0	108.3	Y188 L190 N194 S195 I198	Y188-Q192 HydrophobicContact CD1-CG 4.5Å; Y188-Q192 HydrophobicContact CE1-CG 4.14Å; Y188-Q192 PolarHBondContact O-N 3.07Å; L190-Q192 VanDerWaalsContact C-N 3.26Å; L190-Q192 PolarHBondContact O-N 3.3Å; Q192-N194 PolarHBondContact O-N 2.9Å; Q192-N194 VanDerWaalsContact O-N 3.12Å; Q192-S195 WeakPolarHBondContact O-CA 3.35Å; Q192-S195 PolarHBondContact O-N 3.28Å; Q192-I198 HydrophobicContact CG-CB 4.43Å
193	K	55.7	Low	83.3	Confident	168 Å²	168	69.5 Å²	69.5	73%	0.73	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-33	109.9	-174.6	-156.1	175.2	-175.5	-179.1	0	112.9	K191 S195 T196	K191-K193 VanDerWaalsContact C-N 3.3Å; K191-K193 PolarHBondContact O-N 3.31Å; K193-S195 PolarHBondContact O-N 2.95Å; K193-S195 VanDerWaalsContact O-N 3.11Å; K193-T196 PolarHBondContact O-N 3.14Å; K193-T196 PolarHBondContact O-OG1 3.35Å; K193-T196 VanDerWaalsContact O-OG1 3.13Å
194	N	56.5	Low	83.3	Confident	142 Å²	142	66.7 Å²	66.7	76%	0.759	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	52	28.1	-176.3	-65.3	-8.4	0	0	0	115.8	Q192 T196 R237	Q192-N194 PolarHBondContact O-N 2.9Å; Q192-N194 VanDerWaalsContact O-N 3.12Å; N194-T196 HydrophobicContact CB-CG2 4.48Å; N194-T196 PolarHBondContact O-N 3.43Å; N194-R237 PolarHBondContact O-NH2 3.33Å; N194-R237 VanDerWaalsContact O-NH2 3.12Å
195	S	56.7	Low	83.4	Confident	4 Å²	4	64.7 Å²	64.7	3%	0.028	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	57.5	15.4	-174.8	-42.8	0	0	0	0	115.2	Q192 K193 R228 R237	Q192-S195 WeakPolarHBondContact O-CA 3.35Å; Q192-S195 PolarHBondContact O-N 3.28Å; K193-S195 PolarHBondContact O-N 2.95Å; K193-S195 VanDerWaalsContact O-N 3.11Å; S195-R228 PolarHBondContact OG-NH2 3.43Å; S195-R237 PolarHBondContact O-NE 2.93Å; S195-R237 VanDerWaalsContact O-NE 3.12Å; S195-R237 PolarHBondContact O-NH1 3.23Å; S195-R237 PolarHBondContact O-NH2 2.84Å; S195-R237 VanDerWaalsContact O-NH2 3.08Å
196	T	60.4	Low	83.4	Confident	81 Å²	81	66.1 Å²	66.1	50%	0.497	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-26.5	-170.4	56.6	0	0	0	0	115.1	K193 N194	K193-T196 PolarHBondContact O-N 3.14Å; K193-T196 PolarHBondContact O-OG1 3.35Å; K193-T196 VanDerWaalsContact O-OG1 3.13Å; N194-T196 HydrophobicContact CB-CG2 4.48Å; N194-T196 PolarHBondContact O-N 3.43Å
197	N	73.2	Confident	83.5	Confident	113 Å²	113	66 Å²	66	60%	0.604	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	3	-168.6	-67.3	20.2	0	0	0	114	T199	N197-T199 PolarHBondContact O-N 3.29Å
198	I	85.5	Confident	83.8	Confident	10 Å²	10	61.3 Å²	61.3	5%	0.051	30%	0.303	C	S	.	.			trans	-75.4	125.3	173.4	-169.3	166.8	0	0	0	109.6	Y188 L189 Q192 Q202 L203 L206 R237	Y188-I198 HydrophobicContact CE1-CD1 4.27Å; L189-I198 HydrophobicContact CD2-CD1 3.39Å; Q192-I198 HydrophobicContact CG-CB 4.43Å; I198-Q202 HydrophobicContact CD1-CB 4.2Å; I198-Q202 HydrophobicContact CG1-CB 3.63Å; I198-L203 HydrophobicContact CD1-CB 4.08Å; I198-L203 HydrophobicContact CD1-CD1 4.21Å; I198-L203 HydrophobicContact CG1-CB 4.37Å; I198-L206 HydrophobicContact CD1-CD1 3.93Å; I198-R237 HydrophobicContact CG2-CB 4.49Å; I198-R237 HydrophobicContact CG2-CG 3.74Å
199	T	88.7	Confident	84	Confident	73 Å²	73	63.1 Å²	63.1	45%	0.448	31%	0.313	S	S	.	.			trans	-78.1	156.2	172.9	70.5	0	0	0	0	110.7	N197 Q201 Q202 L203	N197-T199 PolarHBondContact O-N 3.29Å; T199-Q201 PolarHBondContact O-N 3.29Å; T199-Q202 WeakPolarHBondContact O-CB 3.39Å; T199-Q202 PolarHBondContact O-N 3.19Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.47Å; T199-Q202 PolarHBondContact OG1-N 3.13Å; T199-Q202 VanDerWaalsContact OG1-N 3.16Å; T199-L203 PolarHBondContact O-N 3.19Å
200	E	92.1	Very high	84.2	Confident	59 Å²	59	63.3 Å²	63.3	28%	0.276	31%	0.314	S	S	.	.	H	α-helix	trans	-53.5	-42.2	173.8	179.9	176.2	79.9	0	0	112.3	Q202 L203 S204 S238 S239 M242 L246	E200-Q202 PolarHBondContact O-N 3.08Å; E200-L203 WeakPolarHBondContact O-CB 3.44Å; E200-L203 PolarHBondContact O-N 3.02Å; E200-S204 PolarHBondContact O-N 3.19Å; E200-S204 PolarHBondContact O-OG 3.39Å; E200-S238 WeakPolarHBondContact OE2-CA 3.49Å; E200-S238 WeakPolarHBondContact OE2-CB 3.45Å; E200-S239 PolarHBondContact OE2-N 3.12Å; E200-S239 VanDerWaalsContact OE2-O 3.09Å; E200-M242 HydrophobicContact CG-CB 4.07Å; E200-M242 HydrophobicContact CG-CG 3.58Å; E200-M242 WeakPolarHBondContact OE1-CB 3.44Å; E200-L246 HydrophobicContact CG-CD1 4.37Å
201	Q	91.9	Very high	84.5	Confident	76 Å²	76	61 Å²	61	36%	0.355	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-34.1	176.4	-169.3	66.8	54.5	0	0	113	T199 S204 N205	T199-Q201 PolarHBondContact O-N 3.29Å; Q201-S204 WeakPolarHBondContact CA-OG 3.26Å; Q201-S204 PolarHBondContact NE2-OG 3.11Å; Q201-S204 PolarHBondContact O-OG 2.55Å; Q201-S204 VanDerWaalsContact O-OG 3.07Å; Q201-N205 PolarHBondContact NE2-OD1 2.8Å; Q201-N205 WeakPolarHBondContact O-CB 3.21Å; Q201-N205 PolarHBondContact O-N 2.98Å; Q201-N205 PolarHBondContact O-ND2 3.3Å; Q201-N205 PolarHBondContact O-OD1 2.95Å
202	Q	92.5	Very high	84.9	Confident	71 Å²	71	52.5 Å²	52.5	33%	0.332	27%	0.265	S	S	.	.	H	α-helix	trans	-68.5	-39.1	173.1	-75.9	169.5	-21.4	0	0	111	I198 T199 E200 L206	I198-Q202 HydrophobicContact CD1-CB 4.2Å; I198-Q202 HydrophobicContact CG1-CB 3.63Å; T199-Q202 WeakPolarHBondContact O-CB 3.39Å; T199-Q202 PolarHBondContact O-N 3.19Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.47Å; T199-Q202 PolarHBondContact OG1-N 3.13Å; T199-Q202 VanDerWaalsContact OG1-N 3.16Å; E200-Q202 PolarHBondContact O-N 3.08Å; Q202-L206 WeakPolarHBondContact O-CD1 3.25Å; Q202-L206 VanDerWaalsContact O-CG 3.27Å; Q202-L206 WeakPolarHBondContact O-CG 3.32Å; Q202-L206 PolarHBondContact O-N 3.08Å
203	L	93.9	Very high	85.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.1	-45.9	176.3	-174.4	61.4	0	0	0	111.2	L189 I198 T199 E200 L206 L207 F230 I234 R237 L246	L189-L203 HydrophobicContact CD2-CD1 4.24Å; I198-L203 HydrophobicContact CD1-CB 4.08Å; I198-L203 HydrophobicContact CD1-CD1 4.21Å; I198-L203 HydrophobicContact CG1-CB 4.37Å; T199-L203 PolarHBondContact O-N 3.19Å; E200-L203 WeakPolarHBondContact O-CB 3.44Å; E200-L203 PolarHBondContact O-N 3.02Å; L203-L206 PolarHBondContact O-N 2.75Å; L203-L207 HydrophobicContact CD1-CD1 3.83Å; L203-L207 HydrophobicContact CD1-CG 4.09Å; L203-L207 HydrophobicContact CG-CD1 4.01Å; L203-L207 HydrophobicContact CG-CG 4.47Å; L203-L207 WeakPolarHBondContact O-CG 3.18Å; L203-L207 PolarHBondContact O-N 3.39Å; L203-F230 HydrophobicContact CD1-CZ 3.99Å; L203-I234 HydrophobicContact CD2-CG1 4.38Å; L203-R237 HydrophobicContact CD2-CB 4.04Å; L203-L246 HydrophobicContact CD2-CD1 4.19Å; L203-L246 HydrophobicContact CG-CD1 4.4Å
204	S	95.8	Very high	87.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-44.4	177.5	70	0	0	0	0	112.3	E200 Q201 L206 L207 C208	E200-S204 PolarHBondContact O-N 3.19Å; E200-S204 PolarHBondContact O-OG 3.39Å; Q201-S204 WeakPolarHBondContact CA-OG 3.26Å; Q201-S204 PolarHBondContact NE2-OG 3.11Å; Q201-S204 PolarHBondContact O-OG 2.55Å; Q201-S204 VanDerWaalsContact O-OG 3.07Å; S204-L206 PolarHBondContact O-N 3.02Å; S204-L207 PolarHBondContact O-N 3.43Å; S204-C208 WeakPolarHBondContact O-CB 3.4Å; S204-C208 PolarHBondContact O-N 3.38Å; S204-C208 PolarHBondContact O-SG 3.15Å; S204-C208 VanDerWaalsContact O-SG 3.36Å
205	N	95.3	Very high	89.2	Confident	71 Å²	71	36.7 Å²	36.7	38%	0.38	19%	0.189	S	C	.	.	H	α-helix	trans	-64.4	-17.2	176.8	-73.4	-6.7	0	0	0	114.7	Q201 K209	Q201-N205 PolarHBondContact NE2-OD1 2.8Å; Q201-N205 WeakPolarHBondContact O-CB 3.21Å; Q201-N205 PolarHBondContact O-N 2.98Å; Q201-N205 PolarHBondContact O-ND2 3.3Å; Q201-N205 PolarHBondContact O-OD1 2.95Å; N205-K209 WeakPolarHBondContact O-CD 3.38Å; N205-K209 VanDerWaalsContact O-CE 3.24Å; N205-K209 WeakPolarHBondContact O-CE 3.33Å; N205-K209 PolarHBondContact O-NZ 3.46Å
206	L	95.1	Very high	91	Very high	36 Å²	36	37.2 Å²	37.2	19%	0.188	19%	0.191	C	C	.	.	H	α-helix	trans	-89.6	-54.5	171.8	-72.1	167	0	0	0	110.6	T185 Y188 L189 I198 Q202 L203 S204 C208 K209	T185-L206 HydrophobicContact CG2-CB 4.37Å; Y188-L206 HydrophobicContact CD1-CD1 3.6Å; Y188-L206 HydrophobicContact CE1-CD1 3.7Å; L189-L206 HydrophobicContact CD2-CD1 4.18Å; I198-L206 HydrophobicContact CD1-CD1 3.93Å; Q202-L206 WeakPolarHBondContact O-CD1 3.25Å; Q202-L206 VanDerWaalsContact O-CG 3.27Å; Q202-L206 WeakPolarHBondContact O-CG 3.32Å; Q202-L206 PolarHBondContact O-N 3.08Å; L203-L206 PolarHBondContact O-N 2.75Å; S204-L206 PolarHBondContact O-N 3.02Å; L206-C208 PolarHBondContact O-N 2.63Å; L206-K209 PolarHBondContact O-N 3.21Å
207	L	95.8	Very high	92.6	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-69.2	-31.4	-171.3	-62.8	-175.7	0	0	0	113.2	L203 S204 K209 L210 L215 L218 F230 I234 L246 L249	L203-L207 HydrophobicContact CD1-CD1 3.83Å; L203-L207 HydrophobicContact CD1-CG 4.09Å; L203-L207 HydrophobicContact CG-CD1 4.01Å; L203-L207 HydrophobicContact CG-CG 4.47Å; L203-L207 WeakPolarHBondContact O-CG 3.18Å; L203-L207 PolarHBondContact O-N 3.39Å; S204-L207 PolarHBondContact O-N 3.43Å; L207-K209 PolarHBondContact O-N 3.5Å; L207-K209 VanDerWaalsContact O-N 3.13Å; L207-L210 HydrophobicContact CD2-CD1 4.13Å; L207-L210 PolarHBondContact O-N 3.21Å; L207-L210 VanDerWaalsContact O-N 3.14Å; L207-L215 HydrophobicContact CB-CD1 4.33Å; L207-L215 HydrophobicContact CD2-CD1 4.31Å; L207-L218 HydrophobicContact CD2-CD2 3.98Å; L207-F230 HydrophobicContact CD1-CE1 3.61Å; L207-F230 HydrophobicContact CD1-CZ 4Å; L207-F230 HydrophobicContact CD2-CE1 3.55Å; L207-F230 HydrophobicContact CD2-CZ 3.77Å; L207-F230 HydrophobicContact CG-CE1 4.21Å; L207-F230 HydrophobicContact CG-CZ 4.39Å; L207-I234 HydrophobicContact CD1-CD1 4.03Å; L207-I234 HydrophobicContact CD1-CG1 4.2Å; L207-L246 HydrophobicContact CB-CD2 4.41Å; L207-L246 HydrophobicContact CD1-CD2 4.11Å; L207-L249 HydrophobicContact CB-CD2 4.28Å
208	C	96.9	Very high	93.7	Very high	4 Å²	4	28.3 Å²	28.3	3%	0.027	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.9	177.4	77.8	0	0	0	0	113.9	F151 C154 V155 T158 S204 L206	F151-C208 HydrophobicContact CD2-CB 3.7Å; F151-C208 HydrophobicContact CE2-CB 3.79Å; C154-C208 CarbonylContact C-O 3.51Å; C154-C208 HydrophobicContact CB-CB 3.52Å; C154-C208 WeakPolarHBondContact CB-SG 3.46Å; C154-C208 WeakPolarHBondContact SG-CB 3.02Å; C154-C208 PolarHBondContact SG-O 3.25Å; C154-C208 VanDerWaalsContact SG-O 3.36Å; C154-C208 CovalentContact SG-SG 2.04Å; C154-C208 PolarHBondContact SG-SG 3.36Å; V155-C208 HydrophobicContact CG2-CB 3.9Å; T158-C208 PolarHBondContact OG1-O 3.21Å; S204-C208 WeakPolarHBondContact O-CB 3.4Å; S204-C208 PolarHBondContact O-N 3.38Å; S204-C208 PolarHBondContact O-SG 3.15Å; S204-C208 VanDerWaalsContact O-SG 3.36Å; L206-C208 PolarHBondContact O-N 2.63Å
209	K	96	Very high	94.1	Very high	122 Å²	122	27.9 Å²	27.9	53%	0.53	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-7.6	179.5	-62.3	174.9	-176.3	146.1	0	113.7	N205 L206 L207	N205-K209 WeakPolarHBondContact O-CD 3.38Å; N205-K209 VanDerWaalsContact O-CE 3.24Å; N205-K209 WeakPolarHBondContact O-CE 3.33Å; N205-K209 PolarHBondContact O-NZ 3.46Å; L206-K209 PolarHBondContact O-N 3.21Å; L207-K209 PolarHBondContact O-N 3.5Å; L207-K209 VanDerWaalsContact O-N 3.13Å
210	L	95.5	Very high	94.4	Very high	5 Å²	5	28 Å²	28	3%	0.026	14%	0.135	C	C	.	.	S	Bend	trans	-91.4	127.9	174.7	-59.9	-174	0	0	0	108.9	E181 T185 L207 Q214 L215 L218	E181-L210 HydrophobicContact CG-CD2 4.32Å; T185-L210 HydrophobicContact CG2-CD1 4.21Å; L207-L210 HydrophobicContact CD2-CD1 4.13Å; L207-L210 PolarHBondContact O-N 3.21Å; L207-L210 VanDerWaalsContact O-N 3.14Å; L210-Q214 HydrophobicContact CB-CB 4.05Å; L210-Q214 HydrophobicContact CD2-CB 4.15Å; L210-L215 HydrophobicContact CB-CB 4.25Å; L210-L215 HydrophobicContact CB-CD1 4.42Å; L210-L218 HydrophobicContact CD1-CD2 3.87Å
211	N	93.4	Very high	94.4	Very high	20 Å²	20	26.4 Å²	26.4	11%	0.107	13%	0.128	C	C	.	.			trans	-70.7	161.3	165.9	73.8	55.3	0	0	0	110.2	T158 I163 F213 Q214 L215	T158-N211 HydrophobicContact CG2-CB 4.17Å; I163-N211 HydrophobicContact CD1-CB 3.92Å; N211-F213 VanDerWaalsContact C-N 3.31Å; N211-F213 PolarHBondContact O-N 3.36Å; N211-F213 VanDerWaalsContact O-N 3.14Å; N211-F213 PolarHBondContact OD1-N 3.33Å; N211-F213 VanDerWaalsContact OD1-N 3.13Å; N211-Q214 PolarHBondContact ND2-OE1 3.45Å; N211-Q214 WeakPolarHBondContact O-CB 3.35Å; N211-Q214 PolarHBondContact O-N 3.1Å; N211-Q214 PolarHBondContact OD1-N 3.14Å; N211-L215 PolarHBondContact O-N 2.77Å
212	P	92.2	Very high	94.5	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-47.1	-44	-177.6	-36.6	39.9	0	0	0	116	L60 W117 Q214 L215 E216 Y252	L60-P212 HydrophobicContact CD1-CB 4.1Å; L60-P212 HydrophobicContact CD2-CB 3.84Å; W117-P212 HydrophobicContact CH2-CB 4.18Å; W117-P212 HydrophobicContact CH2-CG 3.62Å; W117-P212 HydrophobicContact CZ2-CB 4.42Å; W117-P212 HydrophobicContact CZ2-CG 3.75Å; P212-Q214 VanDerWaalsContact C-N 3.34Å; P212-Q214 PolarHBondContact O-N 3.34Å; P212-L215 PolarHBondContact O-N 3.47Å; P212-L215 VanDerWaalsContact O-N 3.16Å; P212-E216 WeakPolarHBondContact O-CB 3.33Å; P212-E216 PolarHBondContact O-N 3.23Å; P212-Y252 HydrophobicContact CG-CD1 4.33Å; P212-Y252 HydrophobicContact CG-CE1 3.95Å
213	F	92.6	Very high	94.4	Very high	12 Å²	12	22.8 Å²	22.8	5%	0.053	11%	0.111	C	C	.	.	H	α-helix	trans	-69.5	-30.8	179.8	-42.4	-60.8	0	0	0	113.2	P59 L60 W117 I163 P175 V177 N211 L215 A217	P59-F213 HydrophobicContact CB-CE1 3.63Å; P59-F213 HydrophobicContact CB-CZ 3.58Å; P59-F213 HydrophobicContact CG-CE1 3.64Å; P59-F213 HydrophobicContact CG-CZ 3.47Å; P59-F213 VanDerWaalsContact CG-CZ 3.47Å; P59-F213 WeakPolarHBondContact O-CE1 3.4Å; L60-F213 HydrophobicContact CD2-CD1 3.41Å; L60-F213 VanDerWaalsContact CD2-CD1 3.41Å; L60-F213 HydrophobicContact CD2-CE1 3.47Å; L60-F213 VanDerWaalsContact CD2-CE1 3.47Å; L60-F213 HydrophobicContact CG-CD1 4.49Å; L60-F213 HydrophobicContact CG-CE1 4.09Å; W117-F213 HydrophobicContact CH2-CE2 4.19Å; W117-F213 HydrophobicContact CH2-CZ 4.26Å; I163-F213 HydrophobicContact CD1-CD2 3.65Å; I163-F213 HydrophobicContact CD1-CE2 3.5Å; I163-F213 HydrophobicContact CG2-CD2 4.19Å; I163-F213 HydrophobicContact CG2-CE2 4.11Å; P175-F213 HydrophobicContact CB-CD1 4.2Å; P175-F213 HydrophobicContact CB-CD2 3.4Å; P175-F213 VanDerWaalsContact CB-CD2 3.4Å; P175-F213 HydrophobicContact CB-CE1 4.22Å; P175-F213 HydrophobicContact CB-CE2 3.39Å; P175-F213 HydrophobicContact CB-CG 3.83Å; P175-F213 HydrophobicContact CB-CZ 3.83Å; P175-F213 HydrophobicContact CG-CB 4.37Å; P175-F213 HydrophobicContact CG-CD1 3.52Å; P175-F213 HydrophobicContact CG-CD2 3.71Å; P175-F213 HydrophobicContact CG-CE1 3.63Å; P175-F213 HydrophobicContact CG-CE2 3.77Å; P175-F213 HydrophobicContact CG-CG 3.59Å; P175-F213 HydrophobicContact CG-CZ 3.74Å; V177-F213 HydrophobicContact CG2-CB 3.76Å; N211-F213 VanDerWaalsContact C-N 3.31Å; N211-F213 PolarHBondContact O-N 3.36Å; N211-F213 VanDerWaalsContact O-N 3.14Å; N211-F213 PolarHBondContact OD1-N 3.33Å; N211-F213 VanDerWaalsContact OD1-N 3.13Å; F213-L215 VanDerWaalsContact C-N 3.33Å; F213-A217 VanDerWaalsContact O-CB 3.26Å; F213-A217 WeakPolarHBondContact O-CB 3.48Å; F213-A217 PolarHBondContact O-N 3.41Å
214	Q	94.9	Very high	94.4	Very high	13 Å²	13	28.9 Å²	28.9	6%	0.061	14%	0.14	C	C	.	.	H	α-helix	trans	-71.3	-32.2	173.4	-68.9	176.5	-61.1	0	0	111.7	V177 N178 V182 L210 N211 P212 L218	V177-Q214 HydrophobicContact CG1-CB 4.47Å; V177-Q214 HydrophobicContact CG1-CG 3.86Å; N178-Q214 PolarHBondContact O-NE2 2.89Å; V182-Q214 HydrophobicContact CG2-CB 3.77Å; V182-Q214 HydrophobicContact CG2-CG 3.96Å; L210-Q214 HydrophobicContact CB-CB 4.05Å; L210-Q214 HydrophobicContact CD2-CB 4.15Å; N211-Q214 PolarHBondContact ND2-OE1 3.45Å; N211-Q214 WeakPolarHBondContact O-CB 3.35Å; N211-Q214 PolarHBondContact O-N 3.1Å; N211-Q214 PolarHBondContact OD1-N 3.14Å; P212-Q214 VanDerWaalsContact C-N 3.34Å; P212-Q214 PolarHBondContact O-N 3.34Å; Q214-L218 WeakPolarHBondContact O-CB 3.29Å; Q214-L218 PolarHBondContact O-N 3.09Å
215	L	95.3	Very high	94.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-79.3	-34.8	178.5	-153.4	153.4	0	0	0	111.1	L207 L210 N211 P212 F213 L218 D219 L249 Y250 V254	L207-L215 HydrophobicContact CB-CD1 4.33Å; L207-L215 HydrophobicContact CD2-CD1 4.31Å; L210-L215 HydrophobicContact CB-CB 4.25Å; L210-L215 HydrophobicContact CB-CD1 4.42Å; N211-L215 PolarHBondContact O-N 2.77Å; P212-L215 PolarHBondContact O-N 3.47Å; P212-L215 VanDerWaalsContact O-N 3.16Å; F213-L215 VanDerWaalsContact C-N 3.33Å; L215-L218 WeakPolarHBondContact O-CB 3.22Å; L215-L218 PolarHBondContact O-N 2.83Å; L215-D219 PolarHBondContact O-N 3.27Å; L215-L249 HydrophobicContact CD1-CD2 4.13Å; L215-L249 HydrophobicContact CD1-CG 4.06Å; L215-Y250 HydrophobicContact CD2-CD2 3.77Å; L215-Y250 HydrophobicContact CD2-CG 4.43Å; L215-V254 HydrophobicContact CD2-CG2 4.42Å
216	E	94.3	Very high	93.9	Very high	15 Å²	15	33.1 Å²	33.1	7%	0.07	16%	0.162	C	C	.	.	H	α-helix	trans	-60.8	-48.2	165.9	-169.6	-170.4	164	0	0	111.6	L60 N61 P212 L218 D219 M220	L60-E216 WeakPolarHBondContact CD2-OE2 3.45Å; N61-E216 WeakPolarHBondContact CB-OE1 3.29Å; N61-E216 PolarHBondContact ND2-OE1 3.17Å; P212-E216 WeakPolarHBondContact O-CB 3.33Å; P212-E216 PolarHBondContact O-N 3.23Å; E216-L218 VanDerWaalsContact C-N 3.31Å; E216-L218 PolarHBondContact O-N 3.2Å; E216-D219 PolarHBondContact O-N 3.02Å; E216-D219 VanDerWaalsContact O-N 3.17Å; E216-M220 HydrophobicContact CG-CE 4.43Å; E216-M220 PolarHBondContact O-N 2.91Å
217	A	94.6	Very high	93.6	Very high	7 Å²	7	39.6 Å²	39.6	6%	0.058	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-37	175	0	0	0	0	0	112.8	V177 M179 V182 F213 M220 M221	V177-A217 HydrophobicContact CG1-CB 4.02Å; M179-A217 HydrophobicContact SD-CB 3.96Å; V182-A217 HydrophobicContact CG1-CB 4.17Å; V182-A217 HydrophobicContact CG2-CB 4.23Å; F213-A217 VanDerWaalsContact O-CB 3.26Å; F213-A217 WeakPolarHBondContact O-CB 3.48Å; F213-A217 PolarHBondContact O-N 3.41Å; A217-M220 HydrophobicContact CB-CE 4.35Å; A217-M220 PolarHBondContact O-N 3.14Å; A217-M221 WeakPolarHBondContact O-CG 3.39Å; A217-M221 PolarHBondContact O-N 3.35Å; A217-M221 VanDerWaalsContact O-N 3.08Å
218	L	95.1	Very high	93.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.6	-45.9	173.1	-175.3	66.3	0	0	0	111.1	V182 T185 F186 L189 L207 L210 Q214 L215 E216 M221 Y222 F230	V182-L218 HydrophobicContact CG1-CB 4.09Å; V182-L218 HydrophobicContact CG1-CD1 4.31Å; T185-L218 HydrophobicContact CG2-CD2 4.17Å; F186-L218 HydrophobicContact CB-CD1 3.78Å; F186-L218 HydrophobicContact CD2-CD1 3.99Å; F186-L218 HydrophobicContact CG-CD1 4.39Å; L189-L218 HydrophobicContact CD1-CD2 4.3Å; L207-L218 HydrophobicContact CD2-CD2 3.98Å; L210-L218 HydrophobicContact CD1-CD2 3.87Å; Q214-L218 WeakPolarHBondContact O-CB 3.29Å; Q214-L218 PolarHBondContact O-N 3.09Å; L215-L218 WeakPolarHBondContact O-CB 3.22Å; L215-L218 PolarHBondContact O-N 2.83Å; E216-L218 VanDerWaalsContact C-N 3.31Å; E216-L218 PolarHBondContact O-N 3.2Å; L218-M221 PolarHBondContact O-N 3.41Å; L218-Y222 HydrophobicContact CD1-CD2 4.24Å; L218-Y222 HydrophobicContact CD1-CE2 4.02Å; L218-Y222 HydrophobicContact CG-CD2 4.23Å; L218-Y222 HydrophobicContact CG-CE2 4.25Å; L218-Y222 WeakPolarHBondContact O-CD2 3.5Å; L218-Y222 PolarHBondContact O-N 3.17Å; L218-Y222 VanDerWaalsContact O-N 3.09Å; L218-F230 HydrophobicContact CD2-CD1 4.16Å; L218-F230 HydrophobicContact CD2-CD2 4.48Å; L218-F230 HydrophobicContact CD2-CE1 3.88Å; L218-F230 HydrophobicContact CD2-CE2 4.24Å; L218-F230 HydrophobicContact CD2-CG 4.45Å; L218-F230 HydrophobicContact CD2-CZ 3.93Å
219	D	94.5	Very high	93	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-43.9	177.6	-170.6	65.3	0	0	0	112	L215 E216 M221 Y222 Q223 F230 Y250 V254	L215-D219 PolarHBondContact O-N 3.27Å; E216-D219 PolarHBondContact O-N 3.02Å; E216-D219 VanDerWaalsContact O-N 3.17Å; D219-M221 VanDerWaalsContact C-N 3.32Å; D219-M221 PolarHBondContact O-N 3.44Å; D219-Y222 WeakPolarHBondContact O-CA 3.08Å; D219-Y222 WeakPolarHBondContact O-CB 3.18Å; D219-Y222 PolarHBondContact O-N 3.06Å; D219-Q223 WeakPolarHBondContact O-CG 3.4Å; D219-Q223 PolarHBondContact O-N 3.22Å; D219-Q223 PolarHBondContact OD2-NE2 3.13Å; D219-F230 HydrophobicContact CB-CB 4.26Å; D219-F230 WeakPolarHBondContact OD1-CA 3.23Å; D219-F230 WeakPolarHBondContact OD1-CB 3.38Å; D219-F230 PolarHBondContact OD1-N 3.38Å; D219-Y250 HydrophobicContact CB-CE2 4.12Å; D219-Y250 VanDerWaalsContact CG-OH 3.27Å; D219-Y250 WeakPolarHBondContact OD1-CE2 3Å; D219-Y250 PolarHBondContact OD1-OH 3.49Å; D219-Y250 PolarHBondContact OD2-OH 2.9Å; D219-V254 HydrophobicContact CB-CG2 3.96Å
220	M	94.3	Very high	92.8	Very high	74 Å²	74	38.6 Å²	38.6	37%	0.365	19%	0.186	S	C	.	.	H	α-helix	trans	-56.9	-42.1	174.6	-72.3	-169	-74.3	0	0	112.6	E216 A217 Y222 Q223 Q224	E216-M220 HydrophobicContact CG-CE 4.43Å; E216-M220 PolarHBondContact O-N 2.91Å; A217-M220 HydrophobicContact CB-CE 4.35Å; A217-M220 PolarHBondContact O-N 3.14Å; M220-Y222 PolarHBondContact O-N 2.87Å; M220-Q223 PolarHBondContact O-N 3.32Å; M220-Q224 WeakPolarHBondContact O-CB 3.43Å; M220-Q224 VanDerWaalsContact O-CG 3.29Å; M220-Q224 WeakPolarHBondContact O-CG 3.12Å; M220-Q224 PolarHBondContact O-N 3.37Å
221	M	93.7	Very high	92.6	Very high	27 Å²	27	41.5 Å²	41.5	13%	0.133	20%	0.199	C	C	.	.	H	α-helix	trans	-63.2	-40.3	174.5	-68.2	177.2	76.4	0	0	112.1	M179 V182 N183 F186 A217 L218 D219 Q224 D225	M179-M221 HydrophobicContact CE-SD 3.97Å; V182-M221 HydrophobicContact CG1-SD 3.65Å; N183-M221 VanDerWaalsContact OD1-CE 3.26Å; N183-M221 WeakPolarHBondContact OD1-CE 3.46Å; F186-M221 HydrophobicContact CB-CE 4.08Å; F186-M221 HydrophobicContact CB-SD 4.37Å; F186-M221 HydrophobicContact CD1-CE 3.41Å; F186-M221 VanDerWaalsContact CD1-CE 3.41Å; F186-M221 HydrophobicContact CD2-CB 3.96Å; F186-M221 HydrophobicContact CD2-CE 4.33Å; F186-M221 HydrophobicContact CE1-CE 3.79Å; F186-M221 HydrophobicContact CE2-CB 3.79Å; F186-M221 HydrophobicContact CG-CB 4.47Å; F186-M221 HydrophobicContact CG-CE 3.7Å; F186-M221 HydrophobicContact CG-SD 4.29Å; F186-M221 HydrophobicContact CZ-CB 4.15Å; F186-M221 HydrophobicContact CZ-CE 4.42Å; A217-M221 WeakPolarHBondContact O-CG 3.39Å; A217-M221 PolarHBondContact O-N 3.35Å; A217-M221 VanDerWaalsContact O-N 3.08Å; L218-M221 PolarHBondContact O-N 3.41Å; D219-M221 VanDerWaalsContact C-N 3.32Å; D219-M221 PolarHBondContact O-N 3.44Å; M221-Q224 PolarHBondContact O-N 2.95Å; M221-D225 WeakPolarHBondContact O-CB 3.19Å; M221-D225 PolarHBondContact O-N 3.23Å
222	Y	92.1	Very high	92.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-43.4	175	-94.7	-96	0	0	0	112.3	F186 L189 L218 D219 M220 L226 K227 R228 F230 V233	F186-Y222 AromaticContact CD2-CD2 3.68Å; F186-Y222 HydrophobicContact CD2-CD2 3.68Å; F186-Y222 AromaticContact CD2-CE2 3.52Å; F186-Y222 HydrophobicContact CD2-CE2 3.52Å; F186-Y222 AromaticContact CE2-CD2 3.63Å; F186-Y222 HydrophobicContact CE2-CD2 3.63Å; F186-Y222 AromaticContact CE2-CE2 3.77Å; F186-Y222 HydrophobicContact CE2-CE2 3.77Å; F186-Y222 HydrophobicContact CE2-CG 4.21Å; L189-Y222 WeakPolarHBondContact CB-OH 3.28Å; L189-Y222 HydrophobicContact CD1-CE2 4.31Å; L218-Y222 HydrophobicContact CD1-CD2 4.24Å; L218-Y222 HydrophobicContact CD1-CE2 4.02Å; L218-Y222 HydrophobicContact CG-CD2 4.23Å; L218-Y222 HydrophobicContact CG-CE2 4.25Å; L218-Y222 WeakPolarHBondContact O-CD2 3.5Å; L218-Y222 PolarHBondContact O-N 3.17Å; L218-Y222 VanDerWaalsContact O-N 3.09Å; D219-Y222 WeakPolarHBondContact O-CA 3.08Å; D219-Y222 WeakPolarHBondContact O-CB 3.18Å; D219-Y222 PolarHBondContact O-N 3.06Å; M220-Y222 PolarHBondContact O-N 2.87Å; Y222-L226 HydrophobicContact CD1-CD1 3.67Å; Y222-L226 HydrophobicContact CE1-CD1 3.62Å; Y222-L226 HydrophobicContact CG-CD1 4.44Å; Y222-L226 CarbonylContact O-C 3.08Å; Y222-L226 WeakPolarHBondContact O-CA 3.32Å; Y222-L226 WeakPolarHBondContact O-CB 3.1Å; Y222-L226 PolarHBondContact O-N 3.2Å; Y222-K227 PolarHBondContact O-N 3.46Å; Y222-R228 CarbonylContact C-O 3.59Å; Y222-R228 HydrophobicContact CD1-CG 4.37Å; Y222-R228 VanDerWaalsContact O-O 3.08Å; Y222-F230 HydrophobicContact CD1-CD2 4.09Å; Y222-F230 HydrophobicContact CD2-CB 4.19Å; Y222-F230 AromaticContact CD2-CD2 3.66Å; Y222-F230 HydrophobicContact CD2-CD2 3.66Å; Y222-F230 HydrophobicContact CD2-CE2 4.48Å; Y222-F230 HydrophobicContact CD2-CG 4.24Å; Y222-F230 AromaticContact CE1-CD2 3.91Å; Y222-F230 HydrophobicContact CE1-CD2 3.91Å; Y222-F230 HydrophobicContact CE1-CE2 4.48Å; Y222-F230 AromaticContact CE2-CD2 3.42Å; Y222-F230 HydrophobicContact CE2-CD2 3.42Å; Y222-F230 VanDerWaalsContact CE2-CD2 3.42Å; Y222-F230 AromaticContact CE2-CE2 3.83Å; Y222-F230 HydrophobicContact CE2-CE2 3.83Å; Y222-F230 HydrophobicContact CE2-CG 4.38Å; Y222-F230 HydrophobicContact CG-CB 4.07Å; Y222-F230 AromaticContact CG-CD2 3.99Å; Y222-F230 HydrophobicContact CG-CD2 3.99Å; Y222-F230 HydrophobicContact CG-CG 4.48Å; Y222-F230 AromaticContact CZ-CD2 3.57Å; Y222-F230 AromaticContact CZ-CE2 3.84Å; Y222-V233 HydrophobicContact CD1-CG2 3.93Å; Y222-V233 HydrophobicContact CE1-CG2 3.5Å; Y222-V233 VanDerWaalsContact CE1-CG2 3.5Å
223	Q	92	Very high	92.4	Very high	71 Å²	71	43.9 Å²	43.9	33%	0.332	21%	0.209	S	C	.	.	H	α-helix	trans	-65.1	-42.6	176.2	-65.7	-171.9	33.6	0	0	112	D219 M220 K227 R228 T229	D219-Q223 WeakPolarHBondContact O-CG 3.4Å; D219-Q223 PolarHBondContact O-N 3.22Å; D219-Q223 PolarHBondContact OD2-NE2 3.13Å; M220-Q223 PolarHBondContact O-N 3.32Å; Q223-K227 WeakPolarHBondContact O-CA 3.42Å; Q223-K227 WeakPolarHBondContact O-CD 3.19Å; Q223-K227 PolarHBondContact O-N 3.12Å; Q223-R228 WeakPolarHBondContact CA-O 3.42Å; Q223-R228 PolarHBondContact N-O 3.04Å; Q223-T229 HydrophobicContact CG-CG2 4.43Å
224	Q	92.9	Very high	92.4	Very high	127 Å²	127	43.3 Å²	43.3	59%	0.593	21%	0.207	S	C	*	.	H	α-helix	trans	-71.7	-52.6	-177.9	-72.7	177.5	3.7	0	0	112.5	M220 M221 K227	M220-Q224 WeakPolarHBondContact O-CB 3.43Å; M220-Q224 VanDerWaalsContact O-CG 3.29Å; M220-Q224 WeakPolarHBondContact O-CG 3.12Å; M220-Q224 PolarHBondContact O-N 3.37Å; M221-Q224 PolarHBondContact O-N 2.95Å; Q224-K227 WeakPolarHBondContact O-CE 3.09Å; Q224-K227 PolarHBondContact O-NZ 3.29Å
225	D	90.8	Very high	92.3	Very high	102 Å²	102	48.9 Å²	48.9	55%	0.545	23%	0.231	S	C	.	.	H	α-helix	trans	-85.7	-33.1	-171.2	-69.3	-7.1	0	0	0	113.1	F186 M221	F186-D225 WeakPolarHBondContact CE1-OD2 3.39Å; F186-D225 HydrophobicContact CZ-CB 3.98Å; F186-D225 WeakPolarHBondContact CZ-OD2 3.37Å; M221-D225 WeakPolarHBondContact O-CB 3.19Å; M221-D225 PolarHBondContact O-N 3.23Å
226	L	89	Confident	92	Very high	58 Å²	58	56.4 Å²	56.4	30%	0.304	26%	0.259	S	S	.	.	H	α-helix	trans	-115.9	-1.8	-171.2	-54.2	-177.7	0	0	0	114.3	L190 Y222 R228	L190-L226 HydrophobicContact CD2-CD1 3.83Å; L190-L226 HydrophobicContact CD2-CD2 4.08Å; L190-L226 HydrophobicContact CD2-CG 4.47Å; Y222-L226 HydrophobicContact CD1-CD1 3.67Å; Y222-L226 HydrophobicContact CE1-CD1 3.62Å; Y222-L226 HydrophobicContact CG-CD1 4.44Å; Y222-L226 CarbonylContact O-C 3.08Å; Y222-L226 WeakPolarHBondContact O-CA 3.32Å; Y222-L226 WeakPolarHBondContact O-CB 3.1Å; Y222-L226 PolarHBondContact O-N 3.2Å; L226-R228 HydrophobicContact CB-CG 3.99Å; L226-R228 PolarHBondContact O-N 3.46Å
227	K	90.3	Very high	91.8	Very high	173 Å²	173	58.6 Å²	58.6	75%	0.752	27%	0.267	S	S	*	.	S	Bend	trans	52.6	35.6	179.6	-51.3	-48.4	-173.4	-163.2	0	114	Y222 Q223 Q224	Y222-K227 PolarHBondContact O-N 3.46Å; Q223-K227 WeakPolarHBondContact O-CA 3.42Å; Q223-K227 WeakPolarHBondContact O-CD 3.19Å; Q223-K227 PolarHBondContact O-N 3.12Å; Q224-K227 WeakPolarHBondContact O-CE 3.09Å; Q224-K227 PolarHBondContact O-NZ 3.29Å
228	R	88.6	Confident	91.7	Very high	60 Å²	60	58.8 Å²	58.8	23%	0.226	27%	0.268	C	S	.	.	S	Bend	trans	-145.3	154.2	176.7	65.1	-177.4	179.4	170.1	1.6	109.8	S195 Y222 Q223 L226	S195-R228 PolarHBondContact OG-NH2 3.43Å; Y222-R228 CarbonylContact C-O 3.59Å; Y222-R228 HydrophobicContact CD1-CG 4.37Å; Y222-R228 VanDerWaalsContact O-O 3.08Å; Q223-R228 WeakPolarHBondContact CA-O 3.42Å; Q223-R228 PolarHBondContact N-O 3.04Å; L226-R228 HydrophobicContact CB-CG 3.99Å; L226-R228 PolarHBondContact O-N 3.46Å
229	T	89.9	Confident	91.7	Very high	46 Å²	46	63 Å²	63	28%	0.282	30%	0.297	S	S	.	.			trans	-76.3	154.9	172.5	57.9	0	0	0	0	110.9	Q223 F231 E232	Q223-T229 HydrophobicContact CG-CG2 4.43Å; T229-F231 VanDerWaalsContact C-N 3.25Å; T229-E232 PolarHBondContact O-N 2.98Å
230	F	91.9	Very high	91.7	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-71.9	-22.9	170.3	-172.2	-111.9	0	0	0	111.8	L189 L203 L207 L218 D219 Y222 E232 V233 I234 Y250	L189-F230 HydrophobicContact CD1-CE2 3.8Å; L189-F230 HydrophobicContact CD1-CZ 4.08Å; L203-F230 HydrophobicContact CD1-CZ 3.99Å; L207-F230 HydrophobicContact CD1-CE1 3.61Å; L207-F230 HydrophobicContact CD1-CZ 4Å; L207-F230 HydrophobicContact CD2-CE1 3.55Å; L207-F230 HydrophobicContact CD2-CZ 3.77Å; L207-F230 HydrophobicContact CG-CE1 4.21Å; L207-F230 HydrophobicContact CG-CZ 4.39Å; L218-F230 HydrophobicContact CD2-CD1 4.16Å; L218-F230 HydrophobicContact CD2-CD2 4.48Å; L218-F230 HydrophobicContact CD2-CE1 3.88Å; L218-F230 HydrophobicContact CD2-CE2 4.24Å; L218-F230 HydrophobicContact CD2-CG 4.45Å; L218-F230 HydrophobicContact CD2-CZ 3.93Å; D219-F230 HydrophobicContact CB-CB 4.26Å; D219-F230 WeakPolarHBondContact OD1-CA 3.23Å; D219-F230 WeakPolarHBondContact OD1-CB 3.38Å; D219-F230 PolarHBondContact OD1-N 3.38Å; Y222-F230 HydrophobicContact CD1-CD2 4.09Å; Y222-F230 HydrophobicContact CD2-CB 4.19Å; Y222-F230 AromaticContact CD2-CD2 3.66Å; Y222-F230 HydrophobicContact CD2-CD2 3.66Å; Y222-F230 HydrophobicContact CD2-CE2 4.48Å; Y222-F230 HydrophobicContact CD2-CG 4.24Å; Y222-F230 AromaticContact CE1-CD2 3.91Å; Y222-F230 HydrophobicContact CE1-CD2 3.91Å; Y222-F230 HydrophobicContact CE1-CE2 4.48Å; Y222-F230 AromaticContact CE2-CD2 3.42Å; Y222-F230 HydrophobicContact CE2-CD2 3.42Å; Y222-F230 VanDerWaalsContact CE2-CD2 3.42Å; Y222-F230 AromaticContact CE2-CE2 3.83Å; Y222-F230 HydrophobicContact CE2-CE2 3.83Å; Y222-F230 HydrophobicContact CE2-CG 4.38Å; Y222-F230 HydrophobicContact CG-CB 4.07Å; Y222-F230 AromaticContact CG-CD2 3.99Å; Y222-F230 HydrophobicContact CG-CD2 3.99Å; Y222-F230 HydrophobicContact CG-CG 4.48Å; Y222-F230 AromaticContact CZ-CD2 3.57Å; Y222-F230 AromaticContact CZ-CE2 3.84Å; F230-E232 VanDerWaalsContact C-N 3.27Å; F230-E232 PolarHBondContact O-N 2.04Å; F230-V233 HydrophobicContact CD2-CB 3.82Å; F230-V233 HydrophobicContact CD2-CG1 4.3Å; F230-V233 HydrophobicContact CD2-CG2 3.87Å; F230-V233 HydrophobicContact CE2-CB 3.89Å; F230-V233 HydrophobicContact CE2-CG1 3.88Å; F230-V233 HydrophobicContact CE2-CG2 4.29Å; F230-V233 WeakPolarHBondContact O-CA 3.45Å; F230-V233 WeakPolarHBondContact O-CB 3.23Å; F230-V233 PolarHBondContact O-N 3.26Å; F230-I234 HydrophobicContact CD1-CD1 4.06Å; F230-I234 HydrophobicContact CD1-CG1 4.29Å; F230-I234 HydrophobicContact CE1-CD1 3.91Å; F230-I234 HydrophobicContact CE1-CG1 3.94Å; F230-I234 HydrophobicContact CZ-CG1 4.39Å; F230-I234 PolarHBondContact O-N 3.06Å; F230-I234 VanDerWaalsContact O-N 3.14Å; F230-Y250 HydrophobicContact CB-CE2 4.02Å; F230-Y250 HydrophobicContact CD1-CD2 4.02Å; F230-Y250 HydrophobicContact CD1-CE2 4.25Å
231	F	92.9	Very high	91.8	Very high	66 Å²	66	65.1 Å²	65.1	29%	0.289	32%	0.32	S	S	.	.	H	α-helix	trans	-48	-46.5	165.9	-176	-95	0	0	0	112.7	T229 V233 I234 K235 L247 Y250	T229-F231 VanDerWaalsContact C-N 3.25Å; F231-V233 PolarHBondContact O-N 3.48Å; F231-I234 PolarHBondContact O-N 2.84Å; F231-K235 HydrophobicContact CE1-CD 4Å; F231-K235 WeakPolarHBondContact O-CB 3.39Å; F231-K235 PolarHBondContact O-N 3.36Å; F231-L247 HydrophobicContact CD2-CD2 3.74Å; F231-L247 HydrophobicContact CE2-CD1 4.19Å; F231-L247 HydrophobicContact CE2-CD2 3.62Å; F231-L247 HydrophobicContact CE2-CG 4.43Å; F231-L247 HydrophobicContact CG-CD2 4.49Å; F231-L247 HydrophobicContact CZ-CD1 4.33Å; F231-L247 HydrophobicContact CZ-CD2 4.28Å; F231-Y250 HydrophobicContact CB-CD1 4.24Å; F231-Y250 HydrophobicContact CB-CE1 3.6Å; F231-Y250 HydrophobicContact CB-CE2 4.34Å; F231-Y250 AromaticContact CD2-CD1 3.76Å; F231-Y250 HydrophobicContact CD2-CD1 3.76Å; F231-Y250 AromaticContact CD2-CE1 3.69Å; F231-Y250 HydrophobicContact CD2-CE1 3.69Å; F231-Y250 HydrophobicContact CG-CE1 4.12Å
232	E	90.3	Very high	91.9	Very high	68 Å²	68	64.5 Å²	64.5	32%	0.318	32%	0.317	S	S	.	.	H	α-helix	trans	-63.5	-29.4	177.7	-74.6	-176.6	-125.3	0	0	113.5	T229 F230 R236	T229-E232 PolarHBondContact O-N 2.98Å; F230-E232 VanDerWaalsContact C-N 3.27Å; F230-E232 PolarHBondContact O-N 2.04Å; E232-R236 WeakPolarHBondContact O-CD 3.37Å; E232-R236 WeakPolarHBondContact O-CG 3.4Å; E232-R236 PolarHBondContact O-N 3.34Å; E232-R236 IonicContact OE2-CZ 3.21Å; E232-R236 IonicContact OE2-NH2 2.77Å; E232-R236 PolarHBondContact OE2-NH2 3.19Å
233	V	89.8	Confident	92.1	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.006	33%	0.325	C	S	.	.	H	α-helix	trans	-70.3	-46.8	177.1	-176.1	0	0	0	0	109.4	Y222 F230 F231 R236 R237	Y222-V233 HydrophobicContact CD1-CG2 3.93Å; Y222-V233 HydrophobicContact CE1-CG2 3.5Å; Y222-V233 VanDerWaalsContact CE1-CG2 3.5Å; F230-V233 HydrophobicContact CD2-CB 3.82Å; F230-V233 HydrophobicContact CD2-CG1 4.3Å; F230-V233 HydrophobicContact CD2-CG2 3.87Å; F230-V233 HydrophobicContact CE2-CB 3.89Å; F230-V233 HydrophobicContact CE2-CG1 3.88Å; F230-V233 HydrophobicContact CE2-CG2 4.29Å; F230-V233 WeakPolarHBondContact O-CA 3.45Å; F230-V233 WeakPolarHBondContact O-CB 3.23Å; F230-V233 PolarHBondContact O-N 3.26Å; F231-V233 PolarHBondContact O-N 3.48Å; V233-R236 PolarHBondContact O-N 3.22Å; V233-R237 WeakPolarHBondContact O-CB 3.4Å; V233-R237 VanDerWaalsContact O-CD 3.29Å; V233-R237 WeakPolarHBondContact O-CD 3.44Å; V233-R237 PolarHBondContact O-N 3.02Å
234	I	93.3	Very high	92.3	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-60.2	-53	175.7	-58.4	170	0	0	0	109.6	L203 L207 F230 F231 R236 R237 S238 L246 L247 Y250	L203-I234 HydrophobicContact CD2-CG1 4.38Å; L207-I234 HydrophobicContact CD1-CD1 4.03Å; L207-I234 HydrophobicContact CD1-CG1 4.2Å; F230-I234 HydrophobicContact CD1-CD1 4.06Å; F230-I234 HydrophobicContact CD1-CG1 4.29Å; F230-I234 HydrophobicContact CE1-CD1 3.91Å; F230-I234 HydrophobicContact CE1-CG1 3.94Å; F230-I234 HydrophobicContact CZ-CG1 4.39Å; F230-I234 PolarHBondContact O-N 3.06Å; F230-I234 VanDerWaalsContact O-N 3.14Å; F231-I234 PolarHBondContact O-N 2.84Å; I234-R236 PolarHBondContact O-N 3.21Å; I234-R237 PolarHBondContact O-N 3.32Å; I234-S238 WeakPolarHBondContact CG2-OG 3.5Å; I234-S238 PolarHBondContact O-N 3.07Å; I234-S238 VanDerWaalsContact O-N 3.13Å; I234-S238 PolarHBondContact O-OG 3.43Å; I234-L246 HydrophobicContact CG2-CB 3.61Å; I234-L246 HydrophobicContact CG2-CD1 4.49Å; I234-L247 HydrophobicContact CB-CD2 3.91Å; I234-L247 HydrophobicContact CG2-CD2 3.59Å; I234-L247 HydrophobicContact CG2-CG 4.11Å; I234-Y250 HydrophobicContact CD1-CD2 3.94Å; I234-Y250 HydrophobicContact CD1-CG 3.91Å
235	K	92.8	Very high	92.5	Very high	131 Å²	131	61.4 Å²	61.4	57%	0.57	31%	0.305	S	S	*	.	H	α-helix	trans	-54.7	-29.1	-176.8	-174	172	-178.4	175	0	114.2	F231	F231-K235 HydrophobicContact CE1-CD 4Å; F231-K235 WeakPolarHBondContact O-CB 3.39Å; F231-K235 PolarHBondContact O-N 3.36Å
236	R	89.8	Confident	92.8	Very high	157 Å²	157	56.5 Å²	56.5	59%	0.592	28%	0.279	S	S	*	.	H	α-helix	trans	-90.1	-14.2	178.4	-65.8	174.7	-158.9	-154.8	9.3	114.1	E232 V233 I234	E232-R236 WeakPolarHBondContact O-CD 3.37Å; E232-R236 WeakPolarHBondContact O-CG 3.4Å; E232-R236 PolarHBondContact O-N 3.34Å; E232-R236 IonicContact OE2-CZ 3.21Å; E232-R236 IonicContact OE2-NH2 2.77Å; E232-R236 PolarHBondContact OE2-NH2 3.19Å; V233-R236 PolarHBondContact O-N 3.22Å; I234-R236 PolarHBondContact O-N 3.21Å
237	R	88.9	Confident	93.2	Very high	61 Å²	61	55 Å²	55	23%	0.23	27%	0.272	C	S	.	.	H	α-helix	trans	-119.7	-11.1	-165.2	-81.5	47.4	172.7	104.2	-11.5	114.4	N194 S195 I198 L203 V233 I234	N194-R237 PolarHBondContact O-NH2 3.33Å; N194-R237 VanDerWaalsContact O-NH2 3.12Å; S195-R237 PolarHBondContact O-NE 2.93Å; S195-R237 VanDerWaalsContact O-NE 3.12Å; S195-R237 PolarHBondContact O-NH1 3.23Å; S195-R237 PolarHBondContact O-NH2 2.84Å; S195-R237 VanDerWaalsContact O-NH2 3.08Å; I198-R237 HydrophobicContact CG2-CB 4.49Å; I198-R237 HydrophobicContact CG2-CG 3.74Å; L203-R237 HydrophobicContact CD2-CB 4.04Å; V233-R237 WeakPolarHBondContact O-CB 3.4Å; V233-R237 VanDerWaalsContact O-CD 3.29Å; V233-R237 WeakPolarHBondContact O-CD 3.44Å; V233-R237 PolarHBondContact O-N 3.02Å; I234-R237 PolarHBondContact O-N 3.32Å
238	S	93	Very high	93.5	Very high	11 Å²	11	47.8 Å²	47.8	8%	0.077	24%	0.243	C	C	.	.			trans	-123.7	157.2	175.2	53.4	0	0	0	0	112	E200 I234 H243	E200-S238 WeakPolarHBondContact OE2-CA 3.49Å; E200-S238 WeakPolarHBondContact OE2-CB 3.45Å; I234-S238 WeakPolarHBondContact CG2-OG 3.5Å; I234-S238 PolarHBondContact O-N 3.07Å; I234-S238 VanDerWaalsContact O-N 3.13Å; I234-S238 PolarHBondContact O-OG 3.43Å; S238-H243 PolarHBondContact O-ND1 3.28Å; S238-H243 WeakPolarHBondContact OG-CA 3.26Å; S238-H243 PolarHBondContact OG-ND1 3.23Å; S238-H243 VanDerWaalsContact OG-ND1 3.15Å
239	S	94.3	Very high	93.9	Very high	88 Å²	88	45 Å²	45	62%	0.615	23%	0.233	S	C	*	.			trans	-142.2	169.7	170	66.4	0	0	0	0	112.1	E200 H243	E200-S239 PolarHBondContact OE2-N 3.12Å; E200-S239 VanDerWaalsContact OE2-O 3.09Å; S239-H243 VanDerWaalsContact C-CB 3.47Å; S239-H243 PolarHBondContact O-N 3.03Å
240	G	95.4	Very high	94.2	Very high	52 Å²	52	43.5 Å²	43.5	54%	0.536	22%	0.222	S	C	.	.	H	α-helix	trans	58	-148.3	177.4	0	0	0	0	0	114.5	M242 H243 D244	G240-M242 VanDerWaalsContact C-N 3.33Å; G240-M242 PolarHBondContact O-N 3.45Å; G240-H243 VanDerWaalsContact O-CB 3.29Å; G240-H243 WeakPolarHBondContact O-CB 3.41Å; G240-H243 PolarHBondContact O-N 3.16Å; G240-H243 VanDerWaalsContact O-N 3.14Å; G240-D244 PolarHBondContact O-N 2.96Å
241	Q	95.7	Very high	94.4	Very high	69 Å²	69	44.2 Å²	44.2	32%	0.322	23%	0.226	S	C	.	.	H	α-helix	trans	-59.8	-39	-173.5	-176.1	179	86.5	0	0	113.4	I106 F144 T148 H243 D244 L245	I106-Q241 HydrophobicContact CG1-CG 4.2Å; F144-Q241 PolarHBondContact O-OE1 3.19Å; F144-Q241 VanDerWaalsContact O-OE1 3.1Å; T148-Q241 PolarHBondContact OG1-OE1 2.95Å; Q241-H243 VanDerWaalsContact C-N 3.32Å; Q241-H243 PolarHBondContact O-N 2.85Å; Q241-D244 PolarHBondContact O-N 3.37Å; Q241-L245 HydrophobicContact CG-CD1 4.33Å; Q241-L245 WeakPolarHBondContact O-CG 3.49Å; Q241-L245 PolarHBondContact O-N 3.34Å
242	M	96.8	Very high	94.4	Very high	13 Å²	13	41.1 Å²	41.1	6%	0.064	21%	0.213	C	C	.	.	H	α-helix	trans	-70.3	-29.8	-179.4	-173.6	58.1	63	0	0	111.7	P147 F151 E200 G240 L245 L246	P147-M242 HydrophobicContact CB-CE 4.32Å; P147-M242 WeakPolarHBondContact O-CE 3.22Å; F151-M242 HydrophobicContact CB-CE 3.95Å; F151-M242 HydrophobicContact CB-SD 4.31Å; F151-M242 HydrophobicContact CD1-SD 4.37Å; F151-M242 HydrophobicContact CD2-SD 4.21Å; F151-M242 HydrophobicContact CG-CE 4.32Å; F151-M242 HydrophobicContact CG-SD 4.03Å; E200-M242 HydrophobicContact CG-CB 4.07Å; E200-M242 HydrophobicContact CG-CG 3.58Å; E200-M242 WeakPolarHBondContact OE1-CB 3.44Å; G240-M242 VanDerWaalsContact C-N 3.33Å; G240-M242 PolarHBondContact O-N 3.45Å; M242-L245 HydrophobicContact CE-CD1 4.13Å; M242-L245 PolarHBondContact O-N 3.23Å; M242-L245 HydrophobicContact SD-CB 4.37Å; M242-L245 HydrophobicContact SD-CD1 4.23Å; M242-L246 HydrophobicContact CG-CD1 3.97Å; M242-L246 HydrophobicContact CG-CG 4.32Å; M242-L246 WeakPolarHBondContact O-CB 3.49Å; M242-L246 WeakPolarHBondContact O-CD1 3.3Å; M242-L246 WeakPolarHBondContact O-CG 3.34Å; M242-L246 PolarHBondContact O-N 3.4Å; M242-L246 HydrophobicContact SD-CD1 4.48Å; M242-L246 HydrophobicContact SD-CG 4.26Å
243	H	96.1	Very high	94.6	Very high	37 Å²	37	37.9 Å²	37.9	17%	0.171	20%	0.197	C	C	.	.	H	α-helix	trans	-59.9	-48.3	168.6	-178.9	109.7	0	0	0	112.3	S238 S239 G240 Q241 L245 L246 L247	S238-H243 PolarHBondContact O-ND1 3.28Å; S238-H243 WeakPolarHBondContact OG-CA 3.26Å; S238-H243 PolarHBondContact OG-ND1 3.23Å; S238-H243 VanDerWaalsContact OG-ND1 3.15Å; S239-H243 VanDerWaalsContact C-CB 3.47Å; S239-H243 PolarHBondContact O-N 3.03Å; G240-H243 VanDerWaalsContact O-CB 3.29Å; G240-H243 WeakPolarHBondContact O-CB 3.41Å; G240-H243 PolarHBondContact O-N 3.16Å; G240-H243 VanDerWaalsContact O-N 3.14Å; Q241-H243 VanDerWaalsContact C-N 3.32Å; Q241-H243 PolarHBondContact O-N 2.85Å; H243-L245 VanDerWaalsContact C-N 3.28Å; H243-L245 PolarHBondContact O-N 3.01Å; H243-L246 PolarHBondContact O-N 3.09Å; H243-L247 VanDerWaalsContact NE2-CD1 3.3Å; H243-L247 WeakPolarHBondContact NE2-CD1 3.17Å; H243-L247 WeakPolarHBondContact O-CB 3.34Å; H243-L247 WeakPolarHBondContact O-CG 3.37Å; H243-L247 PolarHBondContact O-N 2.7Å
244	D	95.2	Very high	94.6	Very high	94 Å²	94	38.1 Å²	38.1	50%	0.503	20%	0.199	S	C	.	.	H	α-helix	trans	-63.7	-36.4	-179.9	-59.7	-28.1	0	0	0	111.5	G240 Q241 S248	G240-D244 PolarHBondContact O-N 2.96Å; Q241-D244 PolarHBondContact O-N 3.37Å; D244-S248 WeakPolarHBondContact O-CB 3.36Å; D244-S248 PolarHBondContact O-N 2.88Å; D244-S248 PolarHBondContact O-OG 3.26Å
245	L	97.5	Very high	94.5	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-65.9	-46.1	173.8	-70.4	174.5	0	0	0	112.7	I106 T110 T148 F151 L152 Q241 M242 H243 S248 L249	I106-L245 HydrophobicContact CD1-CD2 4.08Å; I106-L245 HydrophobicContact CG1-CD2 4.06Å; T110-L245 HydrophobicContact CG2-CD2 3.86Å; T110-L245 WeakPolarHBondContact OG1-CD2 3.43Å; T148-L245 HydrophobicContact CG2-CD1 3.68Å; F151-L245 HydrophobicContact CD1-CB 4.08Å; F151-L245 HydrophobicContact CD1-CD1 4.16Å; F151-L245 HydrophobicContact CE1-CB 3.76Å; L152-L245 HydrophobicContact CD2-CD2 4.17Å; Q241-L245 HydrophobicContact CG-CD1 4.33Å; Q241-L245 WeakPolarHBondContact O-CG 3.49Å; Q241-L245 PolarHBondContact O-N 3.34Å; M242-L245 HydrophobicContact CE-CD1 4.13Å; M242-L245 PolarHBondContact O-N 3.23Å; M242-L245 HydrophobicContact SD-CB 4.37Å; M242-L245 HydrophobicContact SD-CD1 4.23Å; H243-L245 VanDerWaalsContact C-N 3.28Å; H243-L245 PolarHBondContact O-N 3.01Å; L245-S248 PolarHBondContact O-N 2.87Å; L245-L249 WeakPolarHBondContact O-CB 3.42Å; L245-L249 PolarHBondContact O-N 2.92Å
246	L	97.5	Very high	94.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.2	-40.6	179.5	-67.3	166.6	0	0	0	111.6	F151 E200 L203 L207 I234 M242 H243 L249 Y250	F151-L246 HydrophobicContact CE2-CD2 3.6Å; F151-L246 HydrophobicContact CZ-CD2 3.83Å; E200-L246 HydrophobicContact CG-CD1 4.37Å; L203-L246 HydrophobicContact CD2-CD1 4.19Å; L203-L246 HydrophobicContact CG-CD1 4.4Å; L207-L246 HydrophobicContact CB-CD2 4.41Å; L207-L246 HydrophobicContact CD1-CD2 4.11Å; I234-L246 HydrophobicContact CG2-CB 3.61Å; I234-L246 HydrophobicContact CG2-CD1 4.49Å; M242-L246 HydrophobicContact CG-CD1 3.97Å; M242-L246 HydrophobicContact CG-CG 4.32Å; M242-L246 WeakPolarHBondContact O-CB 3.49Å; M242-L246 WeakPolarHBondContact O-CD1 3.3Å; M242-L246 WeakPolarHBondContact O-CG 3.34Å; M242-L246 PolarHBondContact O-N 3.4Å; M242-L246 HydrophobicContact SD-CD1 4.48Å; M242-L246 HydrophobicContact SD-CG 4.26Å; H243-L246 PolarHBondContact O-N 3.09Å; L246-L249 PolarHBondContact O-N 3.06Å; L246-Y250 WeakPolarHBondContact O-CB 3.48Å; L246-Y250 PolarHBondContact O-N 3.38Å
247	L	96.9	Very high	94.3	Very high	26 Å²	26	25.6 Å²	25.6	14%	0.136	15%	0.15	C	C	.	.	H	α-helix	trans	-67.4	-36.2	172.9	-70.1	-169.9	0	0	0	112.2	F231 I234 H243 T251	F231-L247 HydrophobicContact CD2-CD2 3.74Å; F231-L247 HydrophobicContact CE2-CD1 4.19Å; F231-L247 HydrophobicContact CE2-CD2 3.62Å; F231-L247 HydrophobicContact CE2-CG 4.43Å; F231-L247 HydrophobicContact CG-CD2 4.49Å; F231-L247 HydrophobicContact CZ-CD1 4.33Å; F231-L247 HydrophobicContact CZ-CD2 4.28Å; I234-L247 HydrophobicContact CB-CD2 3.91Å; I234-L247 HydrophobicContact CG2-CD2 3.59Å; I234-L247 HydrophobicContact CG2-CG 4.11Å; H243-L247 VanDerWaalsContact NE2-CD1 3.3Å; H243-L247 WeakPolarHBondContact NE2-CD1 3.17Å; H243-L247 WeakPolarHBondContact O-CB 3.34Å; H243-L247 WeakPolarHBondContact O-CG 3.37Å; H243-L247 PolarHBondContact O-N 2.7Å; L247-T251 VanDerWaalsContact O-CB 3.25Å; L247-T251 WeakPolarHBondContact O-CB 3.45Å; L247-T251 PolarHBondContact O-N 3.38Å; L247-T251 PolarHBondContact O-OG1 3.34Å
248	S	96.1	Very high	94.5	Very high	22 Å²	22	25.1 Å²	25.1	15%	0.154	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-48.5	173.5	-66.9	0	0	0	0	111.5	D244 L245 Y250 T251 Y252	D244-S248 WeakPolarHBondContact O-CB 3.36Å; D244-S248 PolarHBondContact O-N 2.88Å; D244-S248 PolarHBondContact O-OG 3.26Å; L245-S248 PolarHBondContact O-N 2.87Å; S248-Y250 PolarHBondContact O-N 3.42Å; S248-T251 PolarHBondContact O-N 3.33Å; S248-Y252 WeakPolarHBondContact O-CB 3.33Å; S248-Y252 PolarHBondContact O-N 3.42Å
249	L	97.1	Very high	94.5	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-44.3	177.4	179.3	63.5	0	0	0	111.8	F151 V155 L207 L215 L245 L246 S253	F151-L249 HydrophobicContact CE2-CD2 4.13Å; F151-L249 HydrophobicContact CZ-CB 4.21Å; F151-L249 HydrophobicContact CZ-CD2 3.65Å; V155-L249 HydrophobicContact CG1-CD1 3.93Å; V155-L249 HydrophobicContact CG2-CD1 4.16Å; V155-L249 HydrophobicContact CG2-CD2 3.88Å; L207-L249 HydrophobicContact CB-CD2 4.28Å; L215-L249 HydrophobicContact CD1-CD2 4.13Å; L215-L249 HydrophobicContact CD1-CG 4.06Å; L245-L249 WeakPolarHBondContact O-CB 3.42Å; L245-L249 PolarHBondContact O-N 2.92Å; L246-L249 PolarHBondContact O-N 3.06Å; L249-S253 VanDerWaalsContact O-CB 3.31Å; L249-S253 WeakPolarHBondContact O-CB 3.23Å; L249-S253 PolarHBondContact O-N 3.44Å; L249-S253 PolarHBondContact O-OG 3.15Å
250	Y	96.5	Very high	94.4	Very high	13 Å²	13	21.3 Å²	21.3	5%	0.051	12%	0.122	C	C	.	.	H	α-helix	trans	-61	-54.4	175.8	171	-87.5	0	0	0	111.6	L215 D219 F230 F231 I234 L246 S248 Y252 S253 V254	L215-Y250 HydrophobicContact CD2-CD2 3.77Å; L215-Y250 HydrophobicContact CD2-CG 4.43Å; D219-Y250 HydrophobicContact CB-CE2 4.12Å; D219-Y250 VanDerWaalsContact CG-OH 3.27Å; D219-Y250 WeakPolarHBondContact OD1-CE2 3Å; D219-Y250 PolarHBondContact OD1-OH 3.49Å; D219-Y250 PolarHBondContact OD2-OH 2.9Å; F230-Y250 HydrophobicContact CB-CE2 4.02Å; F230-Y250 HydrophobicContact CD1-CD2 4.02Å; F230-Y250 HydrophobicContact CD1-CE2 4.25Å; F231-Y250 HydrophobicContact CB-CD1 4.24Å; F231-Y250 HydrophobicContact CB-CE1 3.6Å; F231-Y250 HydrophobicContact CB-CE2 4.34Å; F231-Y250 AromaticContact CD2-CD1 3.76Å; F231-Y250 HydrophobicContact CD2-CD1 3.76Å; F231-Y250 AromaticContact CD2-CE1 3.69Å; F231-Y250 HydrophobicContact CD2-CE1 3.69Å; F231-Y250 HydrophobicContact CG-CE1 4.12Å; I234-Y250 HydrophobicContact CD1-CD2 3.94Å; I234-Y250 HydrophobicContact CD1-CG 3.91Å; L246-Y250 WeakPolarHBondContact O-CB 3.48Å; L246-Y250 PolarHBondContact O-N 3.38Å; S248-Y250 PolarHBondContact O-N 3.42Å; Y250-Y252 PolarHBondContact O-N 3.47Å; Y250-S253 WeakPolarHBondContact O-CA 3.01Å; Y250-S253 PolarHBondContact O-N 3.22Å; Y250-V254 HydrophobicContact CD2-CG2 3.98Å; Y250-V254 HydrophobicContact CE1-CB 4.3Å; Y250-V254 HydrophobicContact CE1-CG2 4.27Å; Y250-V254 HydrophobicContact CE2-CB 4.46Å; Y250-V254 HydrophobicContact CE2-CG2 3.61Å; Y250-V254 HydrophobicContact CG-CG2 4.48Å; Y250-V254 PolarHBondContact O-N 2.82Å
251	T	95.3	Very high	94.2	Very high	16 Å²	16	18.8 Å²	18.8	10%	0.098	10%	0.096	C	C	.	.	H	α-helix	trans	-64.4	-43.1	-173.7	-50.6	0	0	0	0	110.3	L247 S248 S253 N255 M258	L247-T251 VanDerWaalsContact O-CB 3.25Å; L247-T251 WeakPolarHBondContact O-CB 3.45Å; L247-T251 PolarHBondContact O-N 3.38Å; L247-T251 PolarHBondContact O-OG1 3.34Å; S248-T251 PolarHBondContact O-N 3.33Å; T251-S253 PolarHBondContact O-N 2.95Å; T251-N255 CarbonylContact O-C 3.01Å; T251-N255 WeakPolarHBondContact O-CA 3.17Å; T251-N255 PolarHBondContact O-N 3.03Å; T251-M258 HydrophobicContact CG2-CE 3.62Å; T251-M258 HydrophobicContact CG2-CG 4.31Å
252	Y	94.7	Very high	94	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-56	-36.6	172.4	174.8	-78.5	0	0	0	112.6	L60 I114 D115 W117 R159 P212 S248 Y250 K256 Y259 F260	L60-Y252 HydrophobicContact CD1-CE1 4.44Å; L60-Y252 VanDerWaalsContact CD1-O 3.24Å; L60-Y252 WeakPolarHBondContact CD1-O 3.26Å; I114-Y252 HydrophobicContact CD1-CD2 3.65Å; I114-Y252 HydrophobicContact CD1-CG 3.72Å; I114-Y252 HydrophobicContact CG1-CD2 3.72Å; I114-Y252 HydrophobicContact CG1-CE2 4.12Å; I114-Y252 HydrophobicContact CG1-CG 4.08Å; I114-Y252 VanDerWaalsContact O-CZ 3.24Å; I114-Y252 PolarHBondContact O-OH 3.03Å; D115-Y252 HydrophobicContact CB-CE2 3.97Å; D115-Y252 WeakPolarHBondContact OD1-CE2 3.14Å; D115-Y252 VanDerWaalsContact OD1-CZ 3.26Å; D115-Y252 PolarHBondContact OD1-OH 3.05Å; W117-Y252 PolarHBondContact NE1-OH 2.92Å; R159-Y252 PolarHBondContact NH1-OH 3.3Å; P212-Y252 HydrophobicContact CG-CD1 4.33Å; P212-Y252 HydrophobicContact CG-CE1 3.95Å; S248-Y252 WeakPolarHBondContact O-CB 3.33Å; S248-Y252 PolarHBondContact O-N 3.42Å; Y250-Y252 PolarHBondContact O-N 3.47Å; Y252-K256 HydrophobicContact CD2-CG 4.23Å; Y252-K256 HydrophobicContact CE2-CD 4.22Å; Y252-K256 HydrophobicContact CE2-CG 4.15Å; Y252-K256 WeakPolarHBondContact O-CA 3.2Å; Y252-K256 WeakPolarHBondContact O-CB 3.48Å; Y252-K256 PolarHBondContact O-N 2.99Å; Y252-K256 WeakPolarHBondContact OH-CE 3.23Å; Y252-K256 PolarHBondContact OH-NZ 3.19Å; Y252-Y259 HydrophobicContact CD2-CD1 4.03Å; Y252-Y259 HydrophobicContact CD2-CE1 4.33Å; Y252-F260 HydrophobicContact CD2-CE2 4.38Å; Y252-F260 HydrophobicContact CE2-CE2 4.23Å; Y252-F260 HydrophobicContact CE2-CZ 4.37Å
253	S	93.4	Very high	93.8	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-85	-34.2	-173.8	-56.8	0	0	0	0	113.7	L60 L249 Y250 T251	L60-S253 WeakPolarHBondContact CD2-O 3.42Å; L249-S253 VanDerWaalsContact O-CB 3.31Å; L249-S253 WeakPolarHBondContact O-CB 3.23Å; L249-S253 PolarHBondContact O-N 3.44Å; L249-S253 PolarHBondContact O-OG 3.15Å; Y250-S253 WeakPolarHBondContact O-CA 3.01Å; Y250-S253 PolarHBondContact O-N 3.22Å; T251-S253 PolarHBondContact O-N 2.95Å
254	V	91	Very high	93.4	Very high	7 Å²	7	15.6 Å²	15.6	4%	0.042	9%	0.085	C	C	.	.	H	α-helix	trans	-95	-27.3	-178.8	-178.7	0	0	0	0	112	I63 L215 D219 Y250	I63-V254 HydrophobicContact CD1-CG1 3.68Å; I63-V254 HydrophobicContact CG1-CG1 4.39Å; L215-V254 HydrophobicContact CD2-CG2 4.42Å; D219-V254 HydrophobicContact CB-CG2 3.96Å; Y250-V254 HydrophobicContact CD2-CG2 3.98Å; Y250-V254 HydrophobicContact CE1-CB 4.3Å; Y250-V254 HydrophobicContact CE1-CG2 4.27Å; Y250-V254 HydrophobicContact CE2-CB 4.46Å; Y250-V254 HydrophobicContact CE2-CG2 3.61Å; Y250-V254 HydrophobicContact CG-CG2 4.48Å; Y250-V254 PolarHBondContact O-N 2.82Å
255	N	89.9	Confident	93.2	Very high	8 Å²	8	13.1 Å²	13.1	4%	0.043	7%	0.07	C	C	.	.			trans	-155.1	72.8	-178.9	-164.6	-14.9	0	0	0	111.2	I63 T251 P257 M258 Y259	I63-N255 PolarHBondContact O-ND2 3.13Å; T251-N255 CarbonylContact O-C 3.01Å; T251-N255 WeakPolarHBondContact O-CA 3.17Å; T251-N255 PolarHBondContact O-N 3.03Å; N255-P257 VanDerWaalsContact C-CD 3.48Å; N255-P257 WeakPolarHBondContact OD1-CD 3.23Å; N255-M258 HydrophobicContact CB-CB 3.91Å; N255-M258 HydrophobicContact CB-CE 4.31Å; N255-M258 WeakPolarHBondContact ND2-CB 3.46Å; N255-M258 WeakPolarHBondContact O-CB 3.42Å; N255-M258 PolarHBondContact O-N 3.44Å; N255-M258 VanDerWaalsContact O-N 3.15Å; N255-M258 WeakPolarHBondContact OD1-CB 3.38Å; N255-M258 PolarHBondContact OD1-N 2.88Å; N255-Y259 PolarHBondContact O-N 3.46Å
256	K	89.8	Confident	92.8	Very high	9 Å²	9	13.9 Å²	13.9	4%	0.039	7%	0.074	C	C	.	.	H	α-helix	trans	-50.7	-45.4	-178.7	-174.8	-172.6	-64.2	-155	0	113.9	L60 D115 Y252 M258 Y259 F260 D289	L60-K256 HydrophobicContact CD1-CB 4.13Å; D115-K256 IonicContact OD1-NZ 3.76Å; D115-K256 PolarHBondContact OD1-NZ 2.86Å; Y252-K256 HydrophobicContact CD2-CG 4.23Å; Y252-K256 HydrophobicContact CE2-CD 4.22Å; Y252-K256 HydrophobicContact CE2-CG 4.15Å; Y252-K256 WeakPolarHBondContact O-CA 3.2Å; Y252-K256 WeakPolarHBondContact O-CB 3.48Å; Y252-K256 PolarHBondContact O-N 2.99Å; Y252-K256 WeakPolarHBondContact OH-CE 3.23Å; Y252-K256 PolarHBondContact OH-NZ 3.19Å; K256-M258 PolarHBondContact O-N 3.45Å; K256-Y259 WeakPolarHBondContact O-CB 3.28Å; K256-Y259 PolarHBondContact O-N 3.12Å; K256-F260 HydrophobicContact CD-CD2 4.45Å; K256-F260 HydrophobicContact CD-CE2 3.99Å; K256-F260 HydrophobicContact CG-CD2 3.81Å; K256-F260 HydrophobicContact CG-CE2 3.65Å; K256-F260 WeakPolarHBondContact O-CD2 3.33Å; K256-F260 PolarHBondContact O-N 3.24Å; K256-F260 VanDerWaalsContact O-N 3.13Å; K256-D289 WeakPolarHBondContact CD-OD2 3.49Å
257	P	90.1	Very high	92.1	Very high	8 Å²	8	14 Å²	14	5%	0.052	7%	0.074	C	C	.	.	H	α-helix	trans	-69.9	-33.8	-177.7	-11.3	25.4	0	0	0	112	H62 N255 Y259 F260 A261 L292 V293 I296	H62-P257 HydrophobicContact CB-CG 4.2Å; N255-P257 VanDerWaalsContact C-CD 3.48Å; N255-P257 WeakPolarHBondContact OD1-CD 3.23Å; P257-Y259 PolarHBondContact O-N 3.28Å; P257-F260 PolarHBondContact O-N 2.93Å; P257-A261 WeakPolarHBondContact O-CB 3.45Å; P257-A261 PolarHBondContact O-N 2.8Å; P257-L292 HydrophobicContact CB-CB 4.38Å; P257-L292 HydrophobicContact CB-CD2 4.23Å; P257-L292 HydrophobicContact CB-CG 3.82Å; P257-L292 HydrophobicContact CG-CB 4.44Å; P257-L292 HydrophobicContact CG-CD2 3.48Å; P257-L292 VanDerWaalsContact CG-CD2 3.48Å; P257-L292 HydrophobicContact CG-CG 3.65Å; P257-V293 HydrophobicContact CB-CG2 3.91Å; P257-I296 HydrophobicContact CB-CD1 3.98Å; P257-I296 HydrophobicContact CG-CD1 4.46Å
258	M	92	Very high	91.5	Very high	50 Å²	50	12.9 Å²	12.9	25%	0.246	7%	0.069	C	C	.	.	H	α-helix	trans	-61	-41.7	169.3	178.3	167.2	92.1	0	0	112.4	T251 N255 K256 F260 A261 T262 I296 L300	T251-M258 HydrophobicContact CG2-CE 3.62Å; T251-M258 HydrophobicContact CG2-CG 4.31Å; N255-M258 HydrophobicContact CB-CB 3.91Å; N255-M258 HydrophobicContact CB-CE 4.31Å; N255-M258 WeakPolarHBondContact ND2-CB 3.46Å; N255-M258 WeakPolarHBondContact O-CB 3.42Å; N255-M258 PolarHBondContact O-N 3.44Å; N255-M258 VanDerWaalsContact O-N 3.15Å; N255-M258 WeakPolarHBondContact OD1-CB 3.38Å; N255-M258 PolarHBondContact OD1-N 2.88Å; K256-M258 PolarHBondContact O-N 3.45Å; M258-F260 VanDerWaalsContact C-N 3.34Å; M258-F260 PolarHBondContact O-N 2.88Å; M258-A261 PolarHBondContact O-N 2.71Å; M258-T262 WeakPolarHBondContact O-CB 3.46Å; M258-T262 PolarHBondContact O-N 3.22Å; M258-T262 PolarHBondContact O-OG1 2.96Å; M258-T262 VanDerWaalsContact O-OG1 3.1Å; M258-I296 HydrophobicContact CB-CG2 4.01Å; M258-I296 HydrophobicContact CG-CG2 4.49Å; M258-L300 HydrophobicContact CG-CD1 4Å
259	Y	93.4	Very high	91	Very high	14 Å²	14	16 Å²	16	6%	0.055	8%	0.08	C	C	.	.	H	α-helix	trans	-57.3	-46.8	174.9	173.2	-100.2	0	0	0	111.8	S111 I114 Y252 N255 K256 P257 L263	S111-Y259 VanDerWaalsContact CA-OH 3.23Å; S111-Y259 WeakPolarHBondContact CA-OH 3.3Å; S111-Y259 WeakPolarHBondContact CB-OH 3.43Å; I114-Y259 HydrophobicContact CD1-CD1 4.48Å; I114-Y259 HydrophobicContact CD1-CE1 3.79Å; I114-Y259 HydrophobicContact CD1-CE2 4.21Å; Y252-Y259 HydrophobicContact CD2-CD1 4.03Å; Y252-Y259 HydrophobicContact CD2-CE1 4.33Å; N255-Y259 PolarHBondContact O-N 3.46Å; K256-Y259 WeakPolarHBondContact O-CB 3.28Å; K256-Y259 PolarHBondContact O-N 3.12Å; P257-Y259 PolarHBondContact O-N 3.28Å; Y259-L263 WeakPolarHBondContact O-CB 3.49Å; Y259-L263 PolarHBondContact O-N 3.25Å
260	F	90.9	Very high	90.3	Very high	5 Å²	5	21.4 Å²	21.4	2%	0.022	10%	0.104	C	C	.	.	H	α-helix	trans	-72.4	-34	178.3	-74.3	-66	0	0	0	113.2	D115 Y252 K256 P257 M258 L263 F264 R285 V293	D115-F260 HydrophobicContact CB-CZ 4.44Å; Y252-F260 HydrophobicContact CD2-CE2 4.38Å; Y252-F260 HydrophobicContact CE2-CE2 4.23Å; Y252-F260 HydrophobicContact CE2-CZ 4.37Å; K256-F260 HydrophobicContact CD-CD2 4.45Å; K256-F260 HydrophobicContact CD-CE2 3.99Å; K256-F260 HydrophobicContact CG-CD2 3.81Å; K256-F260 HydrophobicContact CG-CE2 3.65Å; K256-F260 WeakPolarHBondContact O-CD2 3.33Å; K256-F260 PolarHBondContact O-N 3.24Å; K256-F260 VanDerWaalsContact O-N 3.13Å; P257-F260 PolarHBondContact O-N 2.93Å; M258-F260 VanDerWaalsContact C-N 3.34Å; M258-F260 PolarHBondContact O-N 2.88Å; F260-L263 HydrophobicContact CD1-CD2 3.95Å; F260-L263 HydrophobicContact CE1-CD2 4.25Å; F260-L263 WeakPolarHBondContact O-CB 3.47Å; F260-L263 PolarHBondContact O-N 3.3Å; F260-F264 HydrophobicContact CB-CD2 4.49Å; F260-F264 HydrophobicContact CB-CE2 4.19Å; F260-F264 WeakPolarHBondContact O-CD2 3.21Å; F260-F264 WeakPolarHBondContact O-CG 3.18Å; F260-F264 PolarHBondContact O-N 2.69Å; F260-R285 HydrophobicContact CD1-CG 4.34Å; F260-R285 VanDerWaalsContact CE2-CZ 3.4Å; F260-R285 HydrophobicContact CG-CG 4.38Å; F260-V293 HydrophobicContact CB-CG1 4Å; F260-V293 HydrophobicContact CB-CG2 3.85Å
261	A	91.8	Very high	89.1	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.4	-48	173.6	0	0	0	0	0	110.9	P257 M258 L263 F264 H265 V293 I296 Y297 L300	P257-A261 WeakPolarHBondContact O-CB 3.45Å; P257-A261 PolarHBondContact O-N 2.8Å; M258-A261 PolarHBondContact O-N 2.71Å; A261-L263 VanDerWaalsContact C-N 3.34Å; A261-L263 PolarHBondContact O-N 2.99Å; A261-F264 PolarHBondContact O-N 3.08Å; A261-H265 PolarHBondContact O-N 3.42Å; A261-V293 HydrophobicContact CB-CG1 4.11Å; A261-I296 HydrophobicContact CB-CG2 4.16Å; A261-Y297 HydrophobicContact CB-CD2 4.21Å; A261-Y297 WeakPolarHBondContact O-CD2 3.35Å; A261-L300 HydrophobicContact CB-CD1 4.3Å
262	T	92	Very high	87.8	Confident	48 Å²	48	30.5 Å²	30.5	29%	0.294	15%	0.148	S	C	.	.	H	α-helix	trans	-62.9	-39.5	174.6	-57.4	0	0	0	0	112.4	M258 H265 D266 Y301	M258-T262 WeakPolarHBondContact O-CB 3.46Å; M258-T262 PolarHBondContact O-N 3.22Å; M258-T262 PolarHBondContact O-OG1 2.96Å; M258-T262 VanDerWaalsContact O-OG1 3.1Å; T262-H265 PolarHBondContact O-N 3.3Å; T262-D266 WeakPolarHBondContact O-CB 3.31Å; T262-D266 PolarHBondContact O-N 3.47Å; T262-Y301 WeakPolarHBondContact CA-OH 3.41Å; T262-Y301 PolarHBondContact OG1-OH 3.21Å
263	L	91.5	Very high	86.5	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-59.4	-48.9	173.6	-176.4	66.9	0	0	0	111.3	Q107 I108 Y259 F260 A261 H265 D266 V267 L281	Q107-L263 HydrophobicContact CG-CD1 3.64Å; I108-L263 HydrophobicContact CD1-CD1 3.91Å; Y259-L263 WeakPolarHBondContact O-CB 3.49Å; Y259-L263 PolarHBondContact O-N 3.25Å; F260-L263 HydrophobicContact CD1-CD2 3.95Å; F260-L263 HydrophobicContact CE1-CD2 4.25Å; F260-L263 WeakPolarHBondContact O-CB 3.47Å; F260-L263 PolarHBondContact O-N 3.3Å; A261-L263 VanDerWaalsContact C-N 3.34Å; A261-L263 PolarHBondContact O-N 2.99Å; L263-H265 PolarHBondContact O-N 3.17Å; L263-D266 PolarHBondContact O-N 2.91Å; L263-V267 HydrophobicContact CD1-CG2 4.5Å; L263-V267 HydrophobicContact CG-CG2 4.47Å; L263-V267 VanDerWaalsContact O-CB 3.24Å; L263-V267 WeakPolarHBondContact O-CB 3.45Å; L263-V267 WeakPolarHBondContact O-CG2 3.09Å; L263-V267 PolarHBondContact O-N 2.98Å; L263-L281 HydrophobicContact CD2-CD1 4.36Å
264	F	89.7	Confident	85.2	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.009	17%	0.172	C	C	.	.	H	α-helix	trans	-64.3	-38.8	-179.9	-70.8	-51.7	0	0	0	112.7	F260 A261 V267 L268 L281 L282 R285 L290 V293 Y297 L305	F260-F264 HydrophobicContact CB-CD2 4.49Å; F260-F264 HydrophobicContact CB-CE2 4.19Å; F260-F264 WeakPolarHBondContact O-CD2 3.21Å; F260-F264 WeakPolarHBondContact O-CG 3.18Å; F260-F264 PolarHBondContact O-N 2.69Å; A261-F264 PolarHBondContact O-N 3.08Å; F264-V267 WeakPolarHBondContact O-CB 3.47Å; F264-V267 PolarHBondContact O-N 2.89Å; F264-L268 WeakPolarHBondContact O-CB 3.41Å; F264-L268 WeakPolarHBondContact O-CD1 3.43Å; F264-L268 VanDerWaalsContact O-CG 3.23Å; F264-L268 WeakPolarHBondContact O-CG 3.44Å; F264-L268 PolarHBondContact O-N 3.2Å; F264-L281 HydrophobicContact CE1-CB 3.62Å; F264-L281 HydrophobicContact CZ-CB 4.19Å; F264-L282 HydrophobicContact CD1-CD2 3.76Å; F264-L282 HydrophobicContact CD1-CG 4.04Å; F264-L282 HydrophobicContact CD2-CD2 4.11Å; F264-L282 HydrophobicContact CE1-CB 4.39Å; F264-L282 HydrophobicContact CE1-CD2 3.47Å; F264-L282 VanDerWaalsContact CE1-CD2 3.47Å; F264-L282 HydrophobicContact CE1-CG 3.56Å; F264-L282 HydrophobicContact CE2-CD2 3.84Å; F264-L282 HydrophobicContact CG-CD2 4.09Å; F264-L282 HydrophobicContact CZ-CB 4.5Å; F264-L282 HydrophobicContact CZ-CD2 3.53Å; F264-L282 HydrophobicContact CZ-CG 3.97Å; F264-R285 HydrophobicContact CE2-CG 3.97Å; F264-R285 HydrophobicContact CZ-CG 3.78Å; F264-L290 HydrophobicContact CE2-CD1 4.39Å; F264-V293 HydrophobicContact CD2-CG1 3.7Å; F264-V293 HydrophobicContact CE2-CG1 3.84Å; F264-Y297 HydrophobicContact CB-CD2 4.38Å; F264-Y297 HydrophobicContact CB-CE2 4.1Å; F264-L305 HydrophobicContact CB-CD1 3.84Å; F264-L305 HydrophobicContact CD2-CD2 4.03Å; F264-L305 HydrophobicContact CG-CD1 4.39Å; F264-L305 HydrophobicContact CG-CD2 4.42Å
265	H	91	Very high	84	Confident	41 Å²	41	36.7 Å²	36.7	19%	0.19	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-47.8	177.6	173.6	-82.8	0	0	0	110.9	A261 T262 L263 V267 L268 H269 Y297 Y301	A261-H265 PolarHBondContact O-N 3.42Å; T262-H265 PolarHBondContact O-N 3.3Å; L263-H265 PolarHBondContact O-N 3.17Å; H265-V267 VanDerWaalsContact C-N 3.29Å; H265-V267 PolarHBondContact O-N 3.27Å; H265-L268 PolarHBondContact O-N 3.17Å; H265-H269 AromaticContact CD2-CD2 3.39Å; H265-H269 PolarHBondContact CD2-CD2 3.4Å; H265-H269 AromaticContact CD2-NE2 3.97Å; H265-H269 AromaticContact CG-CD2 3.95Å; H265-H269 AromaticContact NE2-CD2 3.47Å; H265-H269 PolarHBondContact NE2-CD2 2.93Å; H265-H269 WeakPolarHBondContact O-CB 3.46Å; H265-H269 PolarHBondContact O-CD2 3.47Å; H265-H269 PolarHBondContact O-N 3.16Å; H265-Y297 HydrophobicContact CB-CE2 3.66Å; H265-Y301 HydrophobicContact CB-CD1 4.46Å; H265-Y301 HydrophobicContact CB-CD2 3.94Å; H265-Y301 HydrophobicContact CB-CE1 4.03Å; H265-Y301 HydrophobicContact CB-CE2 3.44Å; H265-Y301 VanDerWaalsContact CB-CE2 3.44Å; H265-Y301 HydrophobicContact CB-CG 4.44Å; H265-Y301 AromaticContact CD2-CD1 3.23Å; H265-Y301 WeakPolarHBondContact CD2-CD1 3.3Å; H265-Y301 AromaticContact CD2-CD2 3.84Å; H265-Y301 AromaticContact CD2-CE1 3.45Å; H265-Y301 VanDerWaalsContact CD2-CE1 3.45Å; H265-Y301 WeakPolarHBondContact CD2-CE1 3.08Å; H265-Y301 AromaticContact CD2-CG 3.45Å; H265-Y301 VanDerWaalsContact CD2-CG 3.45Å; H265-Y301 AromaticContact CD2-CZ 3.86Å; H265-Y301 AromaticContact CE1-CE1 3.92Å; H265-Y301 AromaticContact CG-CD1 3.76Å; H265-Y301 AromaticContact CG-CE1 3.46Å; H265-Y301 VanDerWaalsContact CG-CE1 3.46Å; H265-Y301 AromaticContact CG-CE2 3.8Å; H265-Y301 AromaticContact CG-CZ 3.49Å; H265-Y301 VanDerWaalsContact CG-CZ 3.49Å; H265-Y301 AromaticContact ND1-CE1 3.76Å; H265-Y301 AromaticContact NE2-CD1 3.53Å; H265-Y301 AromaticContact NE2-CE1 3.75Å
266	D	87.8	Confident	82.9	Confident	18 Å²	18	40.3 Å²	40.3	10%	0.096	21%	0.206	C	C	.	.	H	α-helix	trans	-59.7	-41	176.2	-82	10.6	0	0	0	112.2	Q107 T262 L263 K270 L272	Q107-D266 PolarHBondContact NE2-OD2 3.26Å; T262-D266 WeakPolarHBondContact O-CB 3.31Å; T262-D266 PolarHBondContact O-N 3.47Å; L263-D266 PolarHBondContact O-N 2.91Å; D266-K270 HydrophobicContact CB-CD 4.05Å; D266-K270 WeakPolarHBondContact O-CA 3.16Å; D266-K270 VanDerWaalsContact O-CB 3.23Å; D266-K270 WeakPolarHBondContact O-CB 3.42Å; D266-K270 PolarHBondContact O-N 3.42Å; D266-K270 WeakPolarHBondContact OD1-CE 3.44Å; D266-K270 IonicContact OD1-NZ 2.67Å; D266-K270 PolarHBondContact OD1-NZ 3.08Å; D266-K270 IonicContact OD2-NZ 3.8Å; D266-K270 PolarHBondContact OD2-NZ 3.28Å; D266-L272 HydrophobicContact CB-CD1 4.35Å
267	V	82.5	Confident	81.9	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-42.4	175.6	151.4	0	0	0	0	112.9	I108 L263 F264 H265 I273 A278	I108-V267 HydrophobicContact CD1-CG2 4.42Å; L263-V267 HydrophobicContact CD1-CG2 4.5Å; L263-V267 HydrophobicContact CG-CG2 4.47Å; L263-V267 VanDerWaalsContact O-CB 3.24Å; L263-V267 WeakPolarHBondContact O-CB 3.45Å; L263-V267 WeakPolarHBondContact O-CG2 3.09Å; L263-V267 PolarHBondContact O-N 2.98Å; F264-V267 WeakPolarHBondContact O-CB 3.47Å; F264-V267 PolarHBondContact O-N 2.89Å; H265-V267 VanDerWaalsContact C-N 3.29Å; H265-V267 PolarHBondContact O-N 3.27Å; V267-I273 HydrophobicContact CB-CD1 3.92Å; V267-I273 HydrophobicContact CB-CG1 4.03Å; V267-I273 HydrophobicContact CG1-CD1 3.43Å; V267-I273 VanDerWaalsContact CG1-CD1 3.43Å; V267-I273 HydrophobicContact CG1-CG1 3.63Å; V267-I273 HydrophobicContact CG2-CD1 3.29Å; V267-I273 HydrophobicContact CG2-CG1 3.67Å; V267-I273 HydrophobicContact CG2-CG2 4.41Å; V267-A278 HydrophobicContact CG1-CB 3.36Å
268	L	84.7	Confident	81	Confident	4 Å²	4	40 Å²	40	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-79.6	-45.9	-176.4	-69.2	162.5	0	0	0	111.6	F264 H265 L305 D308 V309 K312 Y313	F264-L268 WeakPolarHBondContact O-CB 3.41Å; F264-L268 WeakPolarHBondContact O-CD1 3.43Å; F264-L268 VanDerWaalsContact O-CG 3.23Å; F264-L268 WeakPolarHBondContact O-CG 3.44Å; F264-L268 PolarHBondContact O-N 3.2Å; H265-L268 PolarHBondContact O-N 3.17Å; L268-L305 HydrophobicContact CD1-CD1 3.61Å; L268-D308 HydrophobicContact CD1-CB 3.85Å; L268-V309 HydrophobicContact CD1-CG2 3.8Å; L268-V309 HydrophobicContact CD2-CG2 3.98Å; L268-K312 HydrophobicContact CD2-CB 3.76Å; L268-K312 HydrophobicContact CD2-CG 4.09Å; L268-K312 WeakPolarHBondContact O-CD 3.14Å; L268-K312 WeakPolarHBondContact O-CE 3.33Å; L268-K312 PolarHBondContact O-NZ 2.83Å; L268-Y313 HydrophobicContact CD2-CE2 3.8Å; L268-Y313 WeakPolarHBondContact CD2-OH 3.41Å
269	H	86.3	Confident	80	Confident	86 Å²	86	39 Å²	39	40%	0.398	20%	0.2	S	C	.	.	H	α-helix	trans	-94.2	-32.7	-170.3	-68.6	-72.5	0	0	0	114.7	H265 D308	H265-H269 AromaticContact CD2-CD2 3.39Å; H265-H269 PolarHBondContact CD2-CD2 3.4Å; H265-H269 AromaticContact CD2-NE2 3.97Å; H265-H269 AromaticContact CG-CD2 3.95Å; H265-H269 AromaticContact NE2-CD2 3.47Å; H265-H269 PolarHBondContact NE2-CD2 2.93Å; H265-H269 WeakPolarHBondContact O-CB 3.46Å; H265-H269 PolarHBondContact O-CD2 3.47Å; H265-H269 PolarHBondContact O-N 3.16Å; H269-D308 IonicContact CD2-OD2 3.31Å; H269-D308 IonicContact CE1-OD2 2.69Å; H269-D308 IonicContact NE2-OD2 2.71Å; H269-D308 PolarHBondContact NE2-OD2 3.21Å
270	K	82.6	Confident	78.9	Confident	116 Å²	116	40.7 Å²	40.7	50%	0.504	21%	0.206	S	C	.	.	S	Bend	trans	-94.1	2.1	-178.3	-55.2	173.7	180	167.3	0	113.7	D266 L272	D266-K270 HydrophobicContact CB-CD 4.05Å; D266-K270 WeakPolarHBondContact O-CA 3.16Å; D266-K270 VanDerWaalsContact O-CB 3.23Å; D266-K270 WeakPolarHBondContact O-CB 3.42Å; D266-K270 PolarHBondContact O-N 3.42Å; D266-K270 WeakPolarHBondContact OD1-CE 3.44Å; D266-K270 IonicContact OD1-NZ 2.67Å; D266-K270 PolarHBondContact OD1-NZ 3.08Å; D266-K270 IonicContact OD2-NZ 3.8Å; D266-K270 PolarHBondContact OD2-NZ 3.28Å; K270-L272 HydrophobicContact CB-CD1 3.9Å; K270-L272 HydrophobicContact CB-CD2 4.29Å; K270-L272 HydrophobicContact CB-CG 3.7Å; K270-L272 HydrophobicContact CD-CD1 4.03Å; K270-L272 PolarHBondContact O-N 3.29Å; K270-L272 VanDerWaalsContact O-N 3.07Å
271	E	71.5	Confident	78.1	Confident	141 Å²	141	40.8 Å²	40.8	66%	0.659	21%	0.206	S	C	*	.			trans	55.2	22.2	179.3	-47.5	-151	138.1	0	0	115.5	I273 K312	E271-I273 PolarHBondContact O-N 3.33Å; E271-K312 WeakPolarHBondContact OE1-CE 3.27Å; E271-K312 IonicContact OE1-NZ 3.69Å; E271-K312 PolarHBondContact OE1-NZ 3.12Å
272	L	67.5	Low	77.3	Confident	79 Å²	79	40.9 Å²	40.9	41%	0.414	21%	0.207	S	C	.	.			trans	-67.8	-13.6	-171	-60.8	173.9	0	0	0	113.8	N105 D266 K270	N105-L272 PolarHBondContact ND2-O 3.26Å; D266-L272 HydrophobicContact CB-CD1 4.35Å; K270-L272 HydrophobicContact CB-CD1 3.9Å; K270-L272 HydrophobicContact CB-CD2 4.29Å; K270-L272 HydrophobicContact CB-CG 3.7Å; K270-L272 HydrophobicContact CD-CD1 4.03Å; K270-L272 PolarHBondContact O-N 3.29Å; K270-L272 VanDerWaalsContact O-N 3.07Å
273	I	67.9	Low	76.3	Confident	25 Å²	25	41.2 Å²	41.2	13%	0.128	21%	0.206	C	C	.	.	S	Bend	trans	-140.3	157	179.6	70.3	171.1	0	0	0	112.8	N105 I108 V267 E271 T277 A278 L281	N105-I273 WeakPolarHBondContact ND2-CG2 3.34Å; I108-I273 HydrophobicContact CD1-CD1 4.41Å; I108-I273 HydrophobicContact CD1-CG2 3.94Å; I108-I273 HydrophobicContact CG1-CG2 3.49Å; I108-I273 VanDerWaalsContact CG1-CG2 3.49Å; V267-I273 HydrophobicContact CB-CD1 3.92Å; V267-I273 HydrophobicContact CB-CG1 4.03Å; V267-I273 HydrophobicContact CG1-CD1 3.43Å; V267-I273 VanDerWaalsContact CG1-CD1 3.43Å; V267-I273 HydrophobicContact CG1-CG1 3.63Å; V267-I273 HydrophobicContact CG2-CD1 3.29Å; V267-I273 HydrophobicContact CG2-CG1 3.67Å; V267-I273 HydrophobicContact CG2-CG2 4.41Å; E271-I273 PolarHBondContact O-N 3.33Å; I273-T277 HydrophobicContact CB-CG2 4.38Å; I273-T277 HydrophobicContact CD1-CG2 3.69Å; I273-A278 HydrophobicContact CD1-CB 3.87Å; I273-A278 VanDerWaalsContact CD1-N 3.32Å; I273-A278 HydrophobicContact CG1-CB 4.43Å; I273-L281 HydrophobicContact CD1-CD1 3.97Å
274	S	66.2	Low	75.5	Confident	54 Å²	54	42.1 Å²	42.1	38%	0.378	21%	0.21	S	C	.	.			trans	-65.2	145.7	169.3	66.7	0	0	0	0	112	K99 L276 T277 A278	K99-S274 PolarHBondContact NZ-OG 2.63Å; S274-L276 PolarHBondContact O-N 2.54Å; S274-L276 VanDerWaalsContact O-N 3.08Å; S274-T277 WeakPolarHBondContact O-CB 2.98Å; S274-T277 PolarHBondContact O-N 2.83Å; S274-T277 PolarHBondContact OG-OG1 3.45Å; S274-A278 PolarHBondContact O-N 3.46Å
275	V	66	Low	74.8	Confident	59 Å²	59	42.3 Å²	42.3	36%	0.358	21%	0.211	S	C	.	.	H	α-helix	trans	-35.4	-52.8	169.8	-179.3	0	0	0	0	113	T277 A278 Q279 Y313	V275-T277 PolarHBondContact O-N 2.72Å; V275-A278 WeakPolarHBondContact O-CB 3.38Å; V275-A278 PolarHBondContact O-N 2.68Å; V275-A278 VanDerWaalsContact O-N 3.09Å; V275-Q279 HydrophobicContact CG1-CG 4.28Å; V275-Q279 WeakPolarHBondContact O-CG 3.4Å; V275-Q279 PolarHBondContact O-N 3.2Å; V275-Y313 HydrophobicContact CB-CD1 4.01Å; V275-Y313 HydrophobicContact CB-CE1 3.86Å; V275-Y313 HydrophobicContact CG1-CD1 3.43Å; V275-Y313 VanDerWaalsContact CG1-CD1 3.43Å; V275-Y313 HydrophobicContact CG1-CD2 4.35Å; V275-Y313 HydrophobicContact CG1-CE1 3.65Å; V275-Y313 HydrophobicContact CG1-CG 3.84Å; V275-Y313 HydrophobicContact CG2-CD1 3.67Å; V275-Y313 HydrophobicContact CG2-CE1 3.62Å
276	L	66.2	Low	73.8	Confident	84 Å²	84	41.5 Å²	41.5	44%	0.44	21%	0.21	S	C	.	.	H	α-helix	trans	-60	-30.2	-176.5	-65.7	173.9	0	0	0	114	S274 R280	S274-L276 PolarHBondContact O-N 2.54Å; S274-L276 VanDerWaalsContact O-N 3.08Å; L276-R280 WeakPolarHBondContact O-CB 3.24Å; L276-R280 WeakPolarHBondContact O-CD 3.45Å; L276-R280 WeakPolarHBondContact O-CG 3.4Å; L276-R280 PolarHBondContact O-N 3.08Å
277	T	67.9	Low	72.5	Confident	8 Å²	8	44.9 Å²	44.9	5%	0.049	23%	0.225	C	C	.	.	H	α-helix	trans	-77.7	-37.9	177.9	-60.2	0	0	0	0	110.3	E96 K99 I108 I273 S274 V275 R280 L281	E96-T277 VanDerWaalsContact OE2-CB 3.24Å; E96-T277 WeakPolarHBondContact OE2-CB 3.46Å; E96-T277 VanDerWaalsContact OE2-CG2 3.23Å; E96-T277 WeakPolarHBondContact OE2-CG2 3.24Å; E96-T277 PolarHBondContact OE2-OG1 2.85Å; K99-T277 PolarHBondContact NZ-OG1 3.06Å; I108-T277 HydrophobicContact CG1-CG2 4.28Å; I108-T277 HydrophobicContact CG2-CG2 4.13Å; I273-T277 HydrophobicContact CB-CG2 4.38Å; I273-T277 HydrophobicContact CD1-CG2 3.69Å; S274-T277 WeakPolarHBondContact O-CB 2.98Å; S274-T277 PolarHBondContact O-N 2.83Å; S274-T277 PolarHBondContact OG-OG1 3.45Å; V275-T277 PolarHBondContact O-N 2.72Å; T277-R280 PolarHBondContact O-N 3.26Å; T277-L281 HydrophobicContact CG2-CD1 4.2Å; T277-L281 VanDerWaalsContact O-CG 3.31Å; T277-L281 WeakPolarHBondContact O-CG 3.36Å; T277-L281 PolarHBondContact O-N 2.86Å
278	A	71.9	Confident	71.9	Confident	1 Å²	1	47 Å²	47	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-62.3	-47.2	174.6	0	0	0	0	0	111.6	V267 I273 S274 V275 R280 L281 L282 Y313	V267-A278 HydrophobicContact CG1-CB 3.36Å; I273-A278 HydrophobicContact CD1-CB 3.87Å; I273-A278 VanDerWaalsContact CD1-N 3.32Å; I273-A278 HydrophobicContact CG1-CB 4.43Å; S274-A278 PolarHBondContact O-N 3.46Å; V275-A278 WeakPolarHBondContact O-CB 3.38Å; V275-A278 PolarHBondContact O-N 2.68Å; V275-A278 VanDerWaalsContact O-N 3.09Å; A278-R280 VanDerWaalsContact C-N 3.3Å; A278-R280 PolarHBondContact O-N 2.81Å; A278-L281 PolarHBondContact O-N 3.37Å; A278-L282 WeakPolarHBondContact O-CG 3.14Å; A278-L282 PolarHBondContact O-N 3.16Å; A278-Y313 HydrophobicContact CB-CE2 4.23Å; A278-Y313 WeakPolarHBondContact CB-OH 3.41Å
279	Q	70	Confident	71.6	Confident	31 Å²	31	47.8 Å²	47.8	15%	0.145	24%	0.242	C	C	.	.	H	α-helix	trans	-56.4	-44.6	175.9	-68.6	-177.7	-27.5	0	0	111.9	V275 L282 I283 L321	V275-Q279 HydrophobicContact CG1-CG 4.28Å; V275-Q279 WeakPolarHBondContact O-CG 3.4Å; V275-Q279 PolarHBondContact O-N 3.2Å; Q279-L282 PolarHBondContact O-N 2.9Å; Q279-I283 WeakPolarHBondContact O-CD1 3.23Å; Q279-I283 VanDerWaalsContact O-CG1 3.26Å; Q279-I283 WeakPolarHBondContact O-CG1 3.35Å; Q279-I283 PolarHBondContact O-N 3.25Å; Q279-L321 HydrophobicContact CB-CD1 4.32Å; Q279-L321 HydrophobicContact CG-CD1 4.35Å; Q279-L321 HydrophobicContact CG-CD2 3.78Å
280	R	70.9	Confident	71.3	Confident	48 Å²	48	44.2 Å²	44.2	18%	0.181	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-44.5	177.6	-75.6	171.6	-163.2	-168.2	14.3	112	E96 L276 T277 A278 L282 I283 F284	E96-R280 HydrophobicContact CG-CB 4.29Å; E96-R280 VanDerWaalsContact CG-CD 3.49Å; E96-R280 WeakPolarHBondContact OE1-CD 3.3Å; E96-R280 IonicContact OE1-CZ 3.29Å; E96-R280 VanDerWaalsContact OE1-CZ 3.31Å; E96-R280 IonicContact OE1-NE 2.89Å; E96-R280 IonicContact OE1-NH1 2.78Å; E96-R280 PolarHBondContact OE1-NH1 2.77Å; L276-R280 WeakPolarHBondContact O-CB 3.24Å; L276-R280 WeakPolarHBondContact O-CD 3.45Å; L276-R280 WeakPolarHBondContact O-CG 3.4Å; L276-R280 PolarHBondContact O-N 3.08Å; T277-R280 PolarHBondContact O-N 3.26Å; A278-R280 VanDerWaalsContact C-N 3.3Å; A278-R280 PolarHBondContact O-N 2.81Å; R280-L282 VanDerWaalsContact C-N 3.34Å; R280-L282 PolarHBondContact O-N 2.88Å; R280-I283 PolarHBondContact O-N 3.19Å; R280-F284 HydrophobicContact CB-CE1 4.4Å; R280-F284 HydrophobicContact CB-CE2 3.78Å; R280-F284 HydrophobicContact CB-CZ 3.69Å; R280-F284 HydrophobicContact CG-CZ 4.32Å; R280-F284 VanDerWaalsContact O-CD1 3.28Å; R280-F284 WeakPolarHBondContact O-CD1 3.45Å; R280-F284 WeakPolarHBondContact O-CD2 3.04Å; R280-F284 WeakPolarHBondContact O-CG 3.45Å; R280-F284 PolarHBondContact O-N 3.31Å
281	L	75	Confident	71.3	Confident	8 Å²	8	42.4 Å²	42.4	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-42.5	175.4	-70.4	164.6	0	0	0	112.1	I108 L112 L263 F264 I273 T277 A278 F284 R285	I108-L281 HydrophobicContact CD1-CD1 3.71Å; L112-L281 HydrophobicContact CD2-CD2 4.07Å; L263-L281 HydrophobicContact CD2-CD1 4.36Å; F264-L281 HydrophobicContact CE1-CB 3.62Å; F264-L281 HydrophobicContact CZ-CB 4.19Å; I273-L281 HydrophobicContact CD1-CD1 3.97Å; T277-L281 HydrophobicContact CG2-CD1 4.2Å; T277-L281 VanDerWaalsContact O-CG 3.31Å; T277-L281 WeakPolarHBondContact O-CG 3.36Å; T277-L281 PolarHBondContact O-N 2.86Å; A278-L281 PolarHBondContact O-N 3.37Å; L281-F284 HydrophobicContact CD2-CD2 4.4Å; L281-F284 PolarHBondContact O-N 3.29Å; L281-R285 WeakPolarHBondContact O-CG 3.25Å; L281-R285 PolarHBondContact O-N 3.23Å; L281-R285 VanDerWaalsContact O-N 3.11Å
282	L	75.1	Confident	72	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-45.6	175.2	-69.9	165.4	0	0	0	111.7	F264 A278 Q279 R280 F284 R285 S286 L290 L305 V309 L321 L325	F264-L282 HydrophobicContact CD1-CD2 3.76Å; F264-L282 HydrophobicContact CD1-CG 4.04Å; F264-L282 HydrophobicContact CD2-CD2 4.11Å; F264-L282 HydrophobicContact CE1-CB 4.39Å; F264-L282 HydrophobicContact CE1-CD2 3.47Å; F264-L282 VanDerWaalsContact CE1-CD2 3.47Å; F264-L282 HydrophobicContact CE1-CG 3.56Å; F264-L282 HydrophobicContact CE2-CD2 3.84Å; F264-L282 HydrophobicContact CG-CD2 4.09Å; F264-L282 HydrophobicContact CZ-CB 4.5Å; F264-L282 HydrophobicContact CZ-CD2 3.53Å; F264-L282 HydrophobicContact CZ-CG 3.97Å; A278-L282 WeakPolarHBondContact O-CG 3.14Å; A278-L282 PolarHBondContact O-N 3.16Å; Q279-L282 PolarHBondContact O-N 2.9Å; R280-L282 VanDerWaalsContact C-N 3.34Å; R280-L282 PolarHBondContact O-N 2.88Å; L282-F284 VanDerWaalsContact C-N 3.29Å; L282-F284 PolarHBondContact O-N 2.76Å; L282-R285 PolarHBondContact O-N 3.07Å; L282-R285 VanDerWaalsContact O-N 3.12Å; L282-S286 PolarHBondContact O-N 2.97Å; L282-S286 VanDerWaalsContact O-N 3.09Å; L282-L290 HydrophobicContact CD2-CD1 4Å; L282-L305 HydrophobicContact CD2-CD2 3.89Å; L282-L305 HydrophobicContact CD2-CG 4.48Å; L282-V309 HydrophobicContact CD1-CG1 4.47Å; L282-V309 HydrophobicContact CD1-CG2 3.9Å; L282-L321 HydrophobicContact CB-CD1 3.99Å; L282-L321 HydrophobicContact CD1-CD1 3.89Å; L282-L321 HydrophobicContact CD1-CD2 3.99Å; L282-L321 HydrophobicContact CD1-CG 4.15Å; L282-L325 HydrophobicContact CD1-CD1 4.46Å; L282-L325 HydrophobicContact CD2-CD2 4.29Å
283	I	70.4	Confident	73	Confident	54 Å²	54	34 Å²	34	28%	0.277	18%	0.179	S	C	.	.	H	α-helix	trans	-60.2	-38.1	173.5	-67.3	162.8	0	0	0	111.2	I89 Q279 R280 R285 S286 L324	I89-I283 HydrophobicContact CD1-CG2 4.08Å; I89-I283 HydrophobicContact CG1-CG2 4.08Å; I89-I283 HydrophobicContact CG2-CG2 4.44Å; Q279-I283 WeakPolarHBondContact O-CD1 3.23Å; Q279-I283 VanDerWaalsContact O-CG1 3.26Å; Q279-I283 WeakPolarHBondContact O-CG1 3.35Å; Q279-I283 PolarHBondContact O-N 3.25Å; R280-I283 PolarHBondContact O-N 3.19Å; I283-R285 VanDerWaalsContact C-N 3.28Å; I283-R285 PolarHBondContact O-N 3.33Å; I283-S286 PolarHBondContact O-N 3.46Å; I283-S286 PolarHBondContact O-OG 3.14Å; I283-L324 HydrophobicContact CG1-CD2 4.11Å
284	F	73.6	Confident	73.9	Confident	22 Å²	22	33.7 Å²	33.7	10%	0.096	18%	0.179	C	C	.	.	H	α-helix	trans	-69.2	-22.6	177.2	-55.3	-27.9	0	0	0	113.4	I89 Q92 I93 R280 L281 L282	I89-F284 HydrophobicContact CG2-CD1 3.56Å; I89-F284 HydrophobicContact CG2-CE1 3.8Å; I89-F284 WeakPolarHBondContact O-CE1 3.39Å; Q92-F284 HydrophobicContact CB-CE1 4.16Å; Q92-F284 HydrophobicContact CB-CZ 4.02Å; I93-F284 HydrophobicContact CB-CE1 4.46Å; I93-F284 HydrophobicContact CB-CE2 4.25Å; I93-F284 HydrophobicContact CB-CZ 4.11Å; I93-F284 HydrophobicContact CD1-CD1 3.99Å; I93-F284 HydrophobicContact CD1-CD2 4.48Å; I93-F284 HydrophobicContact CD1-CE1 4.28Å; I93-F284 HydrophobicContact CD1-CG 4.13Å; I93-F284 HydrophobicContact CG1-CD1 3.53Å; I93-F284 HydrophobicContact CG1-CD2 3.71Å; I93-F284 HydrophobicContact CG1-CE1 3.38Å; I93-F284 HydrophobicContact CG1-CE2 3.56Å; I93-F284 HydrophobicContact CG1-CG 3.72Å; I93-F284 HydrophobicContact CG1-CZ 3.39Å; R280-F284 HydrophobicContact CB-CE1 4.4Å; R280-F284 HydrophobicContact CB-CE2 3.78Å; R280-F284 HydrophobicContact CB-CZ 3.69Å; R280-F284 HydrophobicContact CG-CZ 4.32Å; R280-F284 VanDerWaalsContact O-CD1 3.28Å; R280-F284 WeakPolarHBondContact O-CD1 3.45Å; R280-F284 WeakPolarHBondContact O-CD2 3.04Å; R280-F284 WeakPolarHBondContact O-CG 3.45Å; R280-F284 PolarHBondContact O-N 3.31Å; L281-F284 HydrophobicContact CD2-CD2 4.4Å; L281-F284 PolarHBondContact O-N 3.29Å; L282-F284 VanDerWaalsContact C-N 3.29Å; L282-F284 PolarHBondContact O-N 2.76Å
285	R	76.6	Confident	75.1	Confident	6 Å²	6	34.7 Å²	34.7	2%	0.023	18%	0.18	C	C	.	.	H	α-helix	trans	-90.8	-22.1	175.4	-60.5	-39.6	-59.6	167.5	-14.5	113.9	D115 F260 F264 L281 L282 I283 E287 V288 D289 L290	D115-R285 IonicContact OD2-CZ 3.06Å; D115-R285 IonicContact OD2-NH1 2.72Å; D115-R285 PolarHBondContact OD2-NH1 3.07Å; F260-R285 HydrophobicContact CD1-CG 4.34Å; F260-R285 VanDerWaalsContact CE2-CZ 3.4Å; F260-R285 HydrophobicContact CG-CG 4.38Å; F264-R285 HydrophobicContact CE2-CG 3.97Å; F264-R285 HydrophobicContact CZ-CG 3.78Å; L281-R285 WeakPolarHBondContact O-CG 3.25Å; L281-R285 PolarHBondContact O-N 3.23Å; L281-R285 VanDerWaalsContact O-N 3.11Å; L282-R285 PolarHBondContact O-N 3.07Å; L282-R285 VanDerWaalsContact O-N 3.12Å; I283-R285 VanDerWaalsContact C-N 3.28Å; I283-R285 PolarHBondContact O-N 3.33Å; R285-E287 PolarHBondContact O-N 2.99Å; R285-V288 VanDerWaalsContact NH2-CG1 3.32Å; R285-V288 PolarHBondContact O-N 3.48Å; R285-D289 IonicContact CZ-OD1 3.4Å; R285-D289 IonicContact CZ-OD2 3.26Å; R285-D289 IonicContact NE-OD1 3.76Å; R285-D289 PolarHBondContact NE-OD1 3.15Å; R285-D289 IonicContact NE-OD2 3.39Å; R285-D289 IonicContact NH2-OD1 3.19Å; R285-D289 PolarHBondContact NH2-OD1 2.67Å; R285-D289 IonicContact NH2-OD2 2.68Å; R285-D289 PolarHBondContact NH2-OD2 2.96Å; R285-D289 PolarHBondContact O-N 3.27Å; R285-D289 VanDerWaalsContact O-N 3.07Å; R285-L290 HydrophobicContact CB-CB 4Å; R285-L290 HydrophobicContact CB-CD1 4.15Å; R285-L290 WeakPolarHBondContact O-CB 3.44Å; R285-L290 PolarHBondContact O-N 3.24Å; R285-L290 VanDerWaalsContact O-N 3.1Å
286	S	69	Low	76.2	Confident	24 Å²	24	32.5 Å²	32.5	17%	0.168	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-27.4	-171.8	58.7	0	0	0	0	114.5	L282 I283	L282-S286 PolarHBondContact O-N 2.97Å; L282-S286 VanDerWaalsContact O-N 3.09Å; I283-S286 PolarHBondContact O-N 3.46Å; I283-S286 PolarHBondContact O-OG 3.14Å
287	E	61.8	Low	77.4	Confident	88 Å²	88	28.5 Å²	28.5	41%	0.411	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-1.2	175.1	-62.8	179.6	-170.7	0	0	113.6	C81 R285	C81-E287 PolarHBondContact SG-OE1 3.09Å; R285-E287 PolarHBondContact O-N 2.99Å
288	V	69.5	Low	78.7	Confident	48 Å²	48	31.7 Å²	31.7	29%	0.291	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-64.3	-167.5	-170.5	0	0	0	0	112.9	R57 R285	R57-V288 HydrophobicContact CB-CG1 4.27Å; R57-V288 WeakPolarHBondContact O-CG1 3.45Å; R285-V288 VanDerWaalsContact NH2-CG1 3.32Å; R285-V288 PolarHBondContact O-N 3.48Å
289	D	77.3	Confident	79.8	Confident	20 Å²	20	34.4 Å²	34.4	11%	0.107	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-156.7	14.5	-173.5	61.7	5.4	0	0	0	114.4	K256 R285 Q291 L292 V293	K256-D289 WeakPolarHBondContact CD-OD2 3.49Å; R285-D289 IonicContact CZ-OD1 3.4Å; R285-D289 IonicContact CZ-OD2 3.26Å; R285-D289 IonicContact NE-OD1 3.76Å; R285-D289 PolarHBondContact NE-OD1 3.15Å; R285-D289 IonicContact NE-OD2 3.39Å; R285-D289 IonicContact NH2-OD1 3.19Å; R285-D289 PolarHBondContact NH2-OD1 2.67Å; R285-D289 IonicContact NH2-OD2 2.68Å; R285-D289 PolarHBondContact NH2-OD2 2.96Å; R285-D289 PolarHBondContact O-N 3.27Å; R285-D289 VanDerWaalsContact O-N 3.07Å; D289-Q291 VanDerWaalsContact C-N 3.25Å; D289-Q291 PolarHBondContact O-N 3.05Å; D289-Q291 VanDerWaalsContact O-N 3.09Å; D289-L292 PolarHBondContact O-N 3.09Å; D289-V293 PolarHBondContact O-N 3.44Å
290	L	80.8	Confident	80.9	Confident	10 Å²	10	35.9 Å²	35.9	5%	0.052	19%	0.191	C	C	.	.	H	α-helix	trans	-53.4	-36.5	-172.5	-177.6	59.8	0	0	0	114.2	F264 L282 R285 V293 C294 L305 L324 L325	F264-L290 HydrophobicContact CE2-CD1 4.39Å; L282-L290 HydrophobicContact CD2-CD1 4Å; R285-L290 HydrophobicContact CB-CB 4Å; R285-L290 HydrophobicContact CB-CD1 4.15Å; R285-L290 WeakPolarHBondContact O-CB 3.44Å; R285-L290 PolarHBondContact O-N 3.24Å; R285-L290 VanDerWaalsContact O-N 3.1Å; L290-V293 CarbonylContact O-C 3.5Å; L290-V293 WeakPolarHBondContact O-CB 3.33Å; L290-V293 PolarHBondContact O-N 3.11Å; L290-C294 PolarHBondContact O-N 2.95Å; L290-C294 PolarHBondContact O-SG 3.03Å; L290-L305 HydrophobicContact CD1-CD2 4.31Å; L290-L324 HydrophobicContact CD2-CD2 4.27Å; L290-L324 HydrophobicContact CD2-CG 4.27Å; L290-L325 HydrophobicContact CD1-CD2 4.07Å; L290-L325 HydrophobicContact CD2-CD2 3.92Å; L290-L325 HydrophobicContact CG-CD2 4.18Å
291	Q	82.6	Confident	82.1	Confident	78 Å²	78	37 Å²	37	36%	0.364	20%	0.195	S	C	.	.	H	α-helix	trans	-61.3	-49.2	176.8	-174	56.5	47.3	0	0	111.5	D289 V293 C294 D295	D289-Q291 VanDerWaalsContact C-N 3.25Å; D289-Q291 PolarHBondContact O-N 3.05Å; D289-Q291 VanDerWaalsContact O-N 3.09Å; Q291-V293 PolarHBondContact O-N 3.16Å; Q291-C294 WeakPolarHBondContact O-CA 3.49Å; Q291-C294 VanDerWaalsContact O-CB 3.3Å; Q291-C294 WeakPolarHBondContact O-CB 3.37Å; Q291-C294 PolarHBondContact O-N 3.48Å; Q291-D295 PolarHBondContact NE2-OD1 2.7Å; Q291-D295 PolarHBondContact O-N 3.2Å
292	L	86.4	Confident	83	Confident	44 Å²	44	39.9 Å²	39.9	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-28.3	177.2	-176.9	58	0	0	0	112.2	P257 D289 I296	P257-L292 HydrophobicContact CB-CB 4.38Å; P257-L292 HydrophobicContact CB-CD2 4.23Å; P257-L292 HydrophobicContact CB-CG 3.82Å; P257-L292 HydrophobicContact CG-CB 4.44Å; P257-L292 HydrophobicContact CG-CD2 3.48Å; P257-L292 VanDerWaalsContact CG-CD2 3.48Å; P257-L292 HydrophobicContact CG-CG 3.65Å; D289-L292 PolarHBondContact O-N 3.09Å; L292-I296 HydrophobicContact CD1-CG1 4.45Å; L292-I296 WeakPolarHBondContact O-CG1 3.26Å; L292-I296 PolarHBondContact O-N 3.08Å; L292-I296 VanDerWaalsContact O-N 3.12Å
293	V	87.9	Confident	83.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-67	-41.5	169.1	179	0	0	0	0	111.1	P257 F260 A261 F264 D289 L290 Q291 Y297	P257-V293 HydrophobicContact CB-CG2 3.91Å; F260-V293 HydrophobicContact CB-CG1 4Å; F260-V293 HydrophobicContact CB-CG2 3.85Å; A261-V293 HydrophobicContact CB-CG1 4.11Å; F264-V293 HydrophobicContact CD2-CG1 3.7Å; F264-V293 HydrophobicContact CE2-CG1 3.84Å; D289-V293 PolarHBondContact O-N 3.44Å; L290-V293 CarbonylContact O-C 3.5Å; L290-V293 WeakPolarHBondContact O-CB 3.33Å; L290-V293 PolarHBondContact O-N 3.11Å; Q291-V293 PolarHBondContact O-N 3.16Å; V293-Y297 WeakPolarHBondContact O-CB 3.23Å; V293-Y297 PolarHBondContact O-N 3.34Å
294	C	87.7	Confident	84.8	Confident	19 Å²	19	45.1 Å²	45.1	13%	0.128	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-46.4	174.6	-69.9	0	0	0	0	111.8	L290 Q291 I296 Y297 E298	L290-C294 PolarHBondContact O-N 2.95Å; L290-C294 PolarHBondContact O-SG 3.03Å; Q291-C294 WeakPolarHBondContact O-CA 3.49Å; Q291-C294 VanDerWaalsContact O-CB 3.3Å; Q291-C294 WeakPolarHBondContact O-CB 3.37Å; Q291-C294 PolarHBondContact O-N 3.48Å; C294-I296 PolarHBondContact O-N 3.42Å; C294-Y297 WeakPolarHBondContact O-CB 3.38Å; C294-Y297 PolarHBondContact O-N 2.86Å; C294-Y297 VanDerWaalsContact O-N 3.14Å; C294-E298 PolarHBondContact O-N 3.03Å
295	D	89.9	Confident	85.4	Confident	75 Å²	75	44.1 Å²	44.1	40%	0.401	25%	0.245	S	C	.	.	H	α-helix	trans	-60.5	-45.5	179.8	-54.5	-18.7	0	0	0	111	Q291 A299	Q291-D295 PolarHBondContact NE2-OD1 2.7Å; Q291-D295 PolarHBondContact O-N 3.2Å; D295-A299 WeakPolarHBondContact O-CB 3.4Å; D295-A299 PolarHBondContact O-N 2.95Å; D295-A299 VanDerWaalsContact O-N 3.14Å
296	I	90.1	Very high	85.7	Confident	13 Å²	13	44.3 Å²	44.3	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-69.8	-32.7	175.8	-66	-167.6	0	0	0	111.8	P257 M258 A261 L292 C294 A299 L300	P257-I296 HydrophobicContact CB-CD1 3.98Å; P257-I296 HydrophobicContact CG-CD1 4.46Å; M258-I296 HydrophobicContact CB-CG2 4.01Å; M258-I296 HydrophobicContact CG-CG2 4.49Å; A261-I296 HydrophobicContact CB-CG2 4.16Å; L292-I296 HydrophobicContact CD1-CG1 4.45Å; L292-I296 WeakPolarHBondContact O-CG1 3.26Å; L292-I296 PolarHBondContact O-N 3.08Å; L292-I296 VanDerWaalsContact O-N 3.12Å; C294-I296 PolarHBondContact O-N 3.42Å; I296-A299 PolarHBondContact O-N 2.61Å; I296-L300 HydrophobicContact CG2-CD1 3.58Å; I296-L300 HydrophobicContact CG2-CG 4.03Å; I296-L300 WeakPolarHBondContact O-CB 3.34Å; I296-L300 VanDerWaalsContact O-CG 3.26Å; I296-L300 WeakPolarHBondContact O-CG 3.23Å; I296-L300 PolarHBondContact O-N 2.78Å
297	Y	92	Very high	86.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-49.8	176.1	-168.8	-75.1	0	0	0	111.7	A261 F264 H265 V293 C294 A299 L300 Y301 T303 L305 D308	A261-Y297 HydrophobicContact CB-CD2 4.21Å; A261-Y297 WeakPolarHBondContact O-CD2 3.35Å; F264-Y297 HydrophobicContact CB-CD2 4.38Å; F264-Y297 HydrophobicContact CB-CE2 4.1Å; H265-Y297 HydrophobicContact CB-CE2 3.66Å; V293-Y297 WeakPolarHBondContact O-CB 3.23Å; V293-Y297 PolarHBondContact O-N 3.34Å; C294-Y297 WeakPolarHBondContact O-CB 3.38Å; C294-Y297 PolarHBondContact O-N 2.86Å; C294-Y297 VanDerWaalsContact O-N 3.14Å; Y297-A299 VanDerWaalsContact C-N 3.3Å; Y297-A299 PolarHBondContact O-N 3.4Å; Y297-L300 PolarHBondContact O-N 3.1Å; Y297-Y301 AromaticContact CD1-CD2 3.94Å; Y297-Y301 HydrophobicContact CD1-CD2 3.94Å; Y297-Y301 AromaticContact CD2-CD2 3.91Å; Y297-Y301 HydrophobicContact CD2-CD2 3.91Å; Y297-Y301 HydrophobicContact CD2-CE2 4.15Å; Y297-Y301 AromaticContact CE1-CD2 3.99Å; Y297-Y301 HydrophobicContact CE1-CD2 3.99Å; Y297-Y301 HydrophobicContact CE1-CG 4.44Å; Y297-Y301 AromaticContact CE2-CD2 3.97Å; Y297-Y301 HydrophobicContact CE2-CD2 3.97Å; Y297-Y301 HydrophobicContact CE2-CE2 4.24Å; Y297-Y301 AromaticContact CG-CD2 3.89Å; Y297-Y301 HydrophobicContact CG-CD2 3.89Å; Y297-Y301 HydrophobicContact CG-CE2 4.49Å; Y297-Y301 AromaticContact CZ-CD2 4Å; Y297-Y301 WeakPolarHBondContact O-CD2 3.31Å; Y297-Y301 PolarHBondContact O-N 3.33Å; Y297-T303 WeakPolarHBondContact CD1-O 3.38Å; Y297-L305 HydrophobicContact CD1-CB 3.84Å; Y297-L305 HydrophobicContact CD2-CB 4.15Å; Y297-L305 HydrophobicContact CD2-CD1 3.88Å; Y297-L305 HydrophobicContact CD2-CD2 4.48Å; Y297-L305 HydrophobicContact CD2-CG 4.39Å; Y297-L305 HydrophobicContact CE1-CB 4.23Å; Y297-L305 HydrophobicContact CE1-CD1 4.47Å; Y297-L305 HydrophobicContact CE2-CB 4.49Å; Y297-L305 HydrophobicContact CE2-CD1 3.63Å; Y297-L305 HydrophobicContact CG-CB 3.81Å; Y297-L305 HydrophobicContact CG-CD1 4.4Å; Y297-D308 WeakPolarHBondContact CE1-OD2 3.41Å; Y297-D308 PolarHBondContact OH-OD2 3.37Å
298	E	94.9	Very high	87.8	Confident	75 Å²	75	42.5 Å²	42.5	35%	0.35	24%	0.239	S	C	.	.	H	α-helix	trans	-56.8	-47.1	175.4	-179	-176.3	-171.5	0	0	110.5	C294 L300 G302 T303 Y304	C294-E298 PolarHBondContact O-N 3.03Å; E298-L300 VanDerWaalsContact C-N 3.33Å; E298-L300 PolarHBondContact O-N 3.05Å; E298-G302 WeakPolarHBondContact O-CA 3.24Å; E298-G302 PolarHBondContact O-N 2.91Å; E298-T303 WeakPolarHBondContact CA-O 3.32Å; E298-Y304 HydrophobicContact CG-CD1 4.31Å; E298-Y304 HydrophobicContact CG-CE1 4.02Å; E298-Y304 WeakPolarHBondContact OE1-CE1 3.41Å; E298-Y304 PolarHBondContact OE1-OH 2.85Å; E298-Y304 VanDerWaalsContact OE2-CE1 3.26Å; E298-Y304 WeakPolarHBondContact OE2-CE1 3.48Å
299	A	93.9	Very high	88.2	Confident	58 Å²	58	40.2 Å²	40.2	48%	0.479	23%	0.225	S	C	.	.	H	α-helix	trans	-64.2	-34.5	-178.9	0	0	0	0	0	113.3	L65 D295 I296 Y297	L65-A299 VanDerWaalsContact CD1-C 3.44Å; L65-A299 HydrophobicContact CD1-CB 3.49Å; L65-A299 VanDerWaalsContact CD1-CB 3.49Å; L65-A299 WeakPolarHBondContact CD1-O 3.35Å; L65-A299 HydrophobicContact CG-CB 4.13Å; D295-A299 WeakPolarHBondContact O-CB 3.4Å; D295-A299 PolarHBondContact O-N 2.95Å; D295-A299 VanDerWaalsContact O-N 3.14Å; I296-A299 PolarHBondContact O-N 2.61Å; Y297-A299 VanDerWaalsContact C-N 3.3Å; Y297-A299 PolarHBondContact O-N 3.4Å
300	L	93.8	Very high	88.2	Confident	62 Å²	62	41.5 Å²	41.5	33%	0.325	23%	0.229	S	C	.	.	H	α-helix	trans	-81.7	-38.2	-179.9	-76	171.6	0	0	0	114	L65 M258 A261 I296 Y297 E298	L65-L300 HydrophobicContact CD1-CD2 4.35Å; L65-L300 HydrophobicContact CD2-CD2 3.6Å; L65-L300 HydrophobicContact CD2-CG 4.15Å; M258-L300 HydrophobicContact CG-CD1 4Å; A261-L300 HydrophobicContact CB-CD1 4.3Å; I296-L300 HydrophobicContact CG2-CD1 3.58Å; I296-L300 HydrophobicContact CG2-CG 4.03Å; I296-L300 WeakPolarHBondContact O-CB 3.34Å; I296-L300 VanDerWaalsContact O-CG 3.26Å; I296-L300 WeakPolarHBondContact O-CG 3.23Å; I296-L300 PolarHBondContact O-N 2.78Å; Y297-L300 PolarHBondContact O-N 3.1Å; E298-L300 VanDerWaalsContact C-N 3.33Å; E298-L300 PolarHBondContact O-N 3.05Å
301	Y	94.8	Very high	88.2	Confident	72 Å²	72	48.4 Å²	48.4	28%	0.282	26%	0.261	S	S	.	.	H	α-helix	trans	-113.6	-12.1	-167.1	-59.6	-63.1	0	0	0	114	T262 H265 Y297 T303	T262-Y301 WeakPolarHBondContact CA-OH 3.41Å; T262-Y301 PolarHBondContact OG1-OH 3.21Å; H265-Y301 HydrophobicContact CB-CD1 4.46Å; H265-Y301 HydrophobicContact CB-CD2 3.94Å; H265-Y301 HydrophobicContact CB-CE1 4.03Å; H265-Y301 HydrophobicContact CB-CE2 3.44Å; H265-Y301 VanDerWaalsContact CB-CE2 3.44Å; H265-Y301 HydrophobicContact CB-CG 4.44Å; H265-Y301 AromaticContact CD2-CD1 3.23Å; H265-Y301 WeakPolarHBondContact CD2-CD1 3.3Å; H265-Y301 AromaticContact CD2-CD2 3.84Å; H265-Y301 AromaticContact CD2-CE1 3.45Å; H265-Y301 VanDerWaalsContact CD2-CE1 3.45Å; H265-Y301 WeakPolarHBondContact CD2-CE1 3.08Å; H265-Y301 AromaticContact CD2-CG 3.45Å; H265-Y301 VanDerWaalsContact CD2-CG 3.45Å; H265-Y301 AromaticContact CD2-CZ 3.86Å; H265-Y301 AromaticContact CE1-CE1 3.92Å; H265-Y301 AromaticContact CG-CD1 3.76Å; H265-Y301 AromaticContact CG-CE1 3.46Å; H265-Y301 VanDerWaalsContact CG-CE1 3.46Å; H265-Y301 AromaticContact CG-CE2 3.8Å; H265-Y301 AromaticContact CG-CZ 3.49Å; H265-Y301 VanDerWaalsContact CG-CZ 3.49Å; H265-Y301 AromaticContact ND1-CE1 3.76Å; H265-Y301 AromaticContact NE2-CD1 3.53Å; H265-Y301 AromaticContact NE2-CE1 3.75Å; Y297-Y301 AromaticContact CD1-CD2 3.94Å; Y297-Y301 HydrophobicContact CD1-CD2 3.94Å; Y297-Y301 AromaticContact CD2-CD2 3.91Å; Y297-Y301 HydrophobicContact CD2-CD2 3.91Å; Y297-Y301 HydrophobicContact CD2-CE2 4.15Å; Y297-Y301 AromaticContact CE1-CD2 3.99Å; Y297-Y301 HydrophobicContact CE1-CD2 3.99Å; Y297-Y301 HydrophobicContact CE1-CG 4.44Å; Y297-Y301 AromaticContact CE2-CD2 3.97Å; Y297-Y301 HydrophobicContact CE2-CD2 3.97Å; Y297-Y301 HydrophobicContact CE2-CE2 4.24Å; Y297-Y301 AromaticContact CG-CD2 3.89Å; Y297-Y301 HydrophobicContact CG-CD2 3.89Å; Y297-Y301 HydrophobicContact CG-CE2 4.49Å; Y297-Y301 AromaticContact CZ-CD2 4Å; Y297-Y301 WeakPolarHBondContact O-CD2 3.31Å; Y297-Y301 PolarHBondContact O-N 3.33Å; Y301-T303 PolarHBondContact O-N 3.43Å
302	G	93.9	Very high	87.8	Confident	67 Å²	67	48.3 Å²	48.3	69%	0.691	26%	0.26	S	S	*	.	S	Bend	trans	71.5	12.2	-180	0	0	0	0	0	114.3	E298	E298-G302 WeakPolarHBondContact O-CA 3.24Å; E298-G302 PolarHBondContact O-N 2.91Å
303	T	92.7	Very high	86.9	Confident	54 Å²	54	47.1 Å²	47.1	33%	0.331	25%	0.252	S	S	.	.	S	Bend	trans	-132	150.2	175.9	62.5	0	0	0	0	110.2	Y297 E298 Y301 D308	Y297-T303 WeakPolarHBondContact CD1-O 3.38Å; E298-T303 WeakPolarHBondContact CA-O 3.32Å; Y301-T303 PolarHBondContact O-N 3.43Å; T303-D308 WeakPolarHBondContact CB-OD1 3.23Å; T303-D308 VanDerWaalsContact OG1-CG 3.31Å; T303-D308 PolarHBondContact OG1-OD1 3.36Å; T303-D308 PolarHBondContact OG1-OD2 3.2Å; T303-D308 VanDerWaalsContact OG1-OD2 3.08Å
304	Y	90.7	Very high	85.5	Confident	112 Å²	112	49.9 Å²	49.9	44%	0.439	26%	0.264	S	S	.	.			trans	-70.4	134.4	172.5	-65	-71.2	0	0	0	110.2	E298 S306 D307 D308	E298-Y304 HydrophobicContact CG-CD1 4.31Å; E298-Y304 HydrophobicContact CG-CE1 4.02Å; E298-Y304 WeakPolarHBondContact OE1-CE1 3.41Å; E298-Y304 PolarHBondContact OE1-OH 2.85Å; E298-Y304 VanDerWaalsContact OE2-CE1 3.26Å; E298-Y304 WeakPolarHBondContact OE2-CE1 3.48Å; Y304-S306 PolarHBondContact O-N 3.14Å; Y304-S306 VanDerWaalsContact O-N 3.09Å; Y304-D307 WeakPolarHBondContact CD2-OD2 3.21Å; Y304-D307 WeakPolarHBondContact O-CA 3.48Å; Y304-D307 PolarHBondContact O-N 3.2Å; Y304-D308 PolarHBondContact O-N 3.45Å; Y304-D308 VanDerWaalsContact O-N 3.14Å
305	L	87.7	Confident	83.8	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-52.9	-34.1	169.7	176.9	57.9	0	0	0	111.3	F264 L268 L282 L290 Y297 D307 V309 L325	F264-L305 HydrophobicContact CB-CD1 3.84Å; F264-L305 HydrophobicContact CD2-CD2 4.03Å; F264-L305 HydrophobicContact CG-CD1 4.39Å; F264-L305 HydrophobicContact CG-CD2 4.42Å; L268-L305 HydrophobicContact CD1-CD1 3.61Å; L282-L305 HydrophobicContact CD2-CD2 3.89Å; L282-L305 HydrophobicContact CD2-CG 4.48Å; L290-L305 HydrophobicContact CD1-CD2 4.31Å; Y297-L305 HydrophobicContact CD1-CB 3.84Å; Y297-L305 HydrophobicContact CD2-CB 4.15Å; Y297-L305 HydrophobicContact CD2-CD1 3.88Å; Y297-L305 HydrophobicContact CD2-CD2 4.48Å; Y297-L305 HydrophobicContact CD2-CG 4.39Å; Y297-L305 HydrophobicContact CE1-CB 4.23Å; Y297-L305 HydrophobicContact CE1-CD1 4.47Å; Y297-L305 HydrophobicContact CE2-CB 4.49Å; Y297-L305 HydrophobicContact CE2-CD1 3.63Å; Y297-L305 HydrophobicContact CG-CB 3.81Å; Y297-L305 HydrophobicContact CG-CD1 4.4Å; L305-D307 VanDerWaalsContact C-N 3.28Å; L305-D307 PolarHBondContact O-N 3.37Å; L305-V309 HydrophobicContact CD1-CG2 3.87Å; L305-V309 HydrophobicContact CG-CG2 4.29Å; L305-V309 WeakPolarHBondContact O-CB 3.44Å; L305-V309 WeakPolarHBondContact O-CG2 3.28Å; L305-V309 PolarHBondContact O-N 3.23Å; L305-L325 HydrophobicContact CD2-CD2 4.21Å; L305-L325 HydrophobicContact CG-CD2 4.37Å
306	S	83.3	Confident	82	Confident	9 Å²	9	58.6 Å²	58.6	6%	0.063	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-30.1	175.8	92.5	0	0	0	0	113.4	Y304 K310	Y304-S306 PolarHBondContact O-N 3.14Å; Y304-S306 VanDerWaalsContact O-N 3.09Å; S306-K310 WeakPolarHBondContact O-CB 3.44Å; S306-K310 WeakPolarHBondContact O-CD 3.06Å; S306-K310 WeakPolarHBondContact O-CE 3.29Å; S306-K310 WeakPolarHBondContact O-CG 3.47Å; S306-K310 PolarHBondContact O-N 3.15Å; S306-K310 PolarHBondContact OG-NZ 3.22Å
307	D	86.5	Confident	79.8	Confident	67 Å²	67	62.6 Å²	62.6	36%	0.358	34%	0.337	S	S	.	.	H	α-helix	trans	-83	-41.4	179.7	-72.6	-28	0	0	0	112.4	Y304 L305 V309 K310 Q311	Y304-D307 WeakPolarHBondContact CD2-OD2 3.21Å; Y304-D307 WeakPolarHBondContact O-CA 3.48Å; Y304-D307 PolarHBondContact O-N 3.2Å; L305-D307 VanDerWaalsContact C-N 3.28Å; L305-D307 PolarHBondContact O-N 3.37Å; D307-V309 VanDerWaalsContact C-N 3.29Å; D307-V309 PolarHBondContact O-N 3.48Å; D307-K310 WeakPolarHBondContact O-CB 3.44Å; D307-K310 PolarHBondContact O-N 3.09Å; D307-K310 WeakPolarHBondContact OD1-CD 3.01Å; D307-K310 WeakPolarHBondContact OD1-CE 3.39Å; D307-K310 IonicContact OD1-NZ 3.79Å; D307-K310 PolarHBondContact OD1-NZ 2.95Å; D307-Q311 WeakPolarHBondContact O-CB 3.47Å; D307-Q311 PolarHBondContact O-N 3.44Å
308	D	86.8	Confident	77.8	Confident	8 Å²	8	67 Å²	67	4%	0.043	36%	0.361	C	S	.	.	H	α-helix	trans	-64.3	-38.6	173.5	-69.7	7.8	0	0	0	110.8	L268 H269 Y297 T303 Y304 Q311 K312	L268-D308 HydrophobicContact CD1-CB 3.85Å; H269-D308 IonicContact CD2-OD2 3.31Å; H269-D308 IonicContact CE1-OD2 2.69Å; H269-D308 IonicContact NE2-OD2 2.71Å; H269-D308 PolarHBondContact NE2-OD2 3.21Å; Y297-D308 WeakPolarHBondContact CE1-OD2 3.41Å; Y297-D308 PolarHBondContact OH-OD2 3.37Å; T303-D308 WeakPolarHBondContact CB-OD1 3.23Å; T303-D308 VanDerWaalsContact OG1-CG 3.31Å; T303-D308 PolarHBondContact OG1-OD1 3.36Å; T303-D308 PolarHBondContact OG1-OD2 3.2Å; T303-D308 VanDerWaalsContact OG1-OD2 3.08Å; Y304-D308 PolarHBondContact O-N 3.45Å; Y304-D308 VanDerWaalsContact O-N 3.14Å; D308-Q311 PolarHBondContact O-N 2.96Å; D308-K312 WeakPolarHBondContact O-CB 3.42Å; D308-K312 PolarHBondContact O-N 3.32Å
309	V	79.2	Confident	75.9	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-64.7	-42.1	172.2	168.6	0	0	0	0	111.8	L268 L282 L305 D307 Y313 L321 L325	L268-V309 HydrophobicContact CD1-CG2 3.8Å; L268-V309 HydrophobicContact CD2-CG2 3.98Å; L282-V309 HydrophobicContact CD1-CG1 4.47Å; L282-V309 HydrophobicContact CD1-CG2 3.9Å; L305-V309 HydrophobicContact CD1-CG2 3.87Å; L305-V309 HydrophobicContact CG-CG2 4.29Å; L305-V309 WeakPolarHBondContact O-CB 3.44Å; L305-V309 WeakPolarHBondContact O-CG2 3.28Å; L305-V309 PolarHBondContact O-N 3.23Å; D307-V309 VanDerWaalsContact C-N 3.29Å; D307-V309 PolarHBondContact O-N 3.48Å; V309-Y313 HydrophobicContact CG1-CD2 3.95Å; V309-Y313 HydrophobicContact CG1-CE2 4.27Å; V309-Y313 WeakPolarHBondContact O-CD2 3.42Å; V309-Y313 PolarHBondContact O-N 3.18Å; V309-L321 HydrophobicContact CG1-CD2 3.41Å; V309-L321 VanDerWaalsContact CG1-CD2 3.41Å; V309-L321 HydrophobicContact CG1-CG 4.14Å; V309-L325 HydrophobicContact CB-CD1 3.91Å; V309-L325 HydrophobicContact CG1-CD1 3.78Å; V309-L325 HydrophobicContact CG2-CD1 3.89Å
310	K	77.4	Confident	74.1	Confident	46 Å²	46	70 Å²	70	20%	0.2	38%	0.382	C	S	.	.	H	α-helix	trans	-57.7	-55.4	172	-79.4	159.3	-143.9	158.4	0	109.8	S306 D307 K312 Y313 F314 T322	S306-K310 WeakPolarHBondContact O-CB 3.44Å; S306-K310 WeakPolarHBondContact O-CD 3.06Å; S306-K310 WeakPolarHBondContact O-CE 3.29Å; S306-K310 WeakPolarHBondContact O-CG 3.47Å; S306-K310 PolarHBondContact O-N 3.15Å; S306-K310 PolarHBondContact OG-NZ 3.22Å; D307-K310 WeakPolarHBondContact O-CB 3.44Å; D307-K310 PolarHBondContact O-N 3.09Å; D307-K310 WeakPolarHBondContact OD1-CD 3.01Å; D307-K310 WeakPolarHBondContact OD1-CE 3.39Å; D307-K310 IonicContact OD1-NZ 3.79Å; D307-K310 PolarHBondContact OD1-NZ 2.95Å; K310-K312 VanDerWaalsContact C-N 3.29Å; K310-K312 PolarHBondContact O-N 3.3Å; K310-Y313 PolarHBondContact O-N 3.4Å; K310-F314 VanDerWaalsContact CA-CD2 3.46Å; K310-F314 HydrophobicContact CB-CD2 3.67Å; K310-F314 HydrophobicContact CB-CE2 3.93Å; K310-F314 HydrophobicContact CG-CD2 3.7Å; K310-F314 HydrophobicContact CG-CE2 3.5Å; K310-F314 VanDerWaalsContact O-CB 3.25Å; K310-F314 WeakPolarHBondContact O-CB 3.33Å; K310-F314 WeakPolarHBondContact O-CG 3.39Å; K310-F314 PolarHBondContact O-N 3.35Å; K310-T322 HydrophobicContact CD-CG2 4.35Å; K310-T322 HydrophobicContact CG-CG2 4.13Å
311	Q	81.1	Confident	72.2	Confident	155 Å²	155	67.8 Å²	67.8	72%	0.724	37%	0.371	S	S	*	.	H	α-helix	trans	-58.7	-40.1	-176	-169.9	-176.5	33.2	0	0	112	D307 D308	D307-Q311 WeakPolarHBondContact O-CB 3.47Å; D307-Q311 PolarHBondContact O-N 3.44Å; D308-Q311 PolarHBondContact O-N 2.96Å
312	K	74.1	Confident	70.2	Confident	77 Å²	77	64.4 Å²	64.4	34%	0.335	36%	0.358	S	S	.	.	H	α-helix	trans	-74.8	-32	-177.9	-159.8	67.6	178.8	-167.1	0	114	L268 E271 D308 K310	L268-K312 HydrophobicContact CD2-CB 3.76Å; L268-K312 HydrophobicContact CD2-CG 4.09Å; L268-K312 WeakPolarHBondContact O-CD 3.14Å; L268-K312 WeakPolarHBondContact O-CE 3.33Å; L268-K312 PolarHBondContact O-NZ 2.83Å; E271-K312 WeakPolarHBondContact OE1-CE 3.27Å; E271-K312 IonicContact OE1-NZ 3.69Å; E271-K312 PolarHBondContact OE1-NZ 3.12Å; D308-K312 WeakPolarHBondContact O-CB 3.42Å; D308-K312 PolarHBondContact O-N 3.32Å; K310-K312 VanDerWaalsContact C-N 3.29Å; K310-K312 PolarHBondContact O-N 3.3Å
313	Y	66.4	Low	68.5	Low	19 Å²	19	65.4 Å²	65.4	8%	0.075	35%	0.347	C	S	.	.	H	α-helix	trans	-115.4	-6.7	-169.7	-52.4	-38	0	0	0	114.8	L268 V275 A278 V309 K310 G315 L321	L268-Y313 HydrophobicContact CD2-CE2 3.8Å; L268-Y313 WeakPolarHBondContact CD2-OH 3.41Å; V275-Y313 HydrophobicContact CB-CD1 4.01Å; V275-Y313 HydrophobicContact CB-CE1 3.86Å; V275-Y313 HydrophobicContact CG1-CD1 3.43Å; V275-Y313 VanDerWaalsContact CG1-CD1 3.43Å; V275-Y313 HydrophobicContact CG1-CD2 4.35Å; V275-Y313 HydrophobicContact CG1-CE1 3.65Å; V275-Y313 HydrophobicContact CG1-CG 3.84Å; V275-Y313 HydrophobicContact CG2-CD1 3.67Å; V275-Y313 HydrophobicContact CG2-CE1 3.62Å; A278-Y313 HydrophobicContact CB-CE2 4.23Å; A278-Y313 WeakPolarHBondContact CB-OH 3.41Å; V309-Y313 HydrophobicContact CG1-CD2 3.95Å; V309-Y313 HydrophobicContact CG1-CE2 4.27Å; V309-Y313 WeakPolarHBondContact O-CD2 3.42Å; V309-Y313 PolarHBondContact O-N 3.18Å; K310-Y313 PolarHBondContact O-N 3.4Å; Y313-G315 PolarHBondContact O-N 3Å; Y313-L321 HydrophobicContact CD2-CD2 4.11Å; Y313-L321 HydrophobicContact CE2-CD2 4.46Å
314	F	58.3	Low	66.9	Low	57 Å²	57	64.3 Å²	64.3	25%	0.25	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	84.3	179.2	-60.4	-27.2	0	0	0	115.6	K310 Q317 D318 T322	K310-F314 VanDerWaalsContact CA-CD2 3.46Å; K310-F314 HydrophobicContact CB-CD2 3.67Å; K310-F314 HydrophobicContact CB-CE2 3.93Å; K310-F314 HydrophobicContact CG-CD2 3.7Å; K310-F314 HydrophobicContact CG-CE2 3.5Å; K310-F314 VanDerWaalsContact O-CB 3.25Å; K310-F314 WeakPolarHBondContact O-CB 3.33Å; K310-F314 WeakPolarHBondContact O-CG 3.39Å; K310-F314 PolarHBondContact O-N 3.35Å; F314-Q317 VanDerWaalsContact CE1-C 3.42Å; F314-Q317 HydrophobicContact CE1-CB 4.44Å; F314-Q317 WeakPolarHBondContact CE1-O 2.95Å; F314-D318 HydrophobicContact CD1-CB 3.64Å; F314-D318 HydrophobicContact CD2-CB 4.26Å; F314-D318 VanDerWaalsContact CD2-CG 3.48Å; F314-D318 WeakPolarHBondContact CD2-OD1 3.41Å; F314-D318 HydrophobicContact CE1-CB 3.64Å; F314-D318 HydrophobicContact CE2-CB 4.14Å; F314-D318 WeakPolarHBondContact CE2-OD1 3.43Å; F314-D318 VanDerWaalsContact CE2-OD2 3.23Å; F314-D318 WeakPolarHBondContact CE2-OD2 3.41Å; F314-D318 HydrophobicContact CG-CB 4.04Å; F314-D318 WeakPolarHBondContact CG-OD1 3.48Å; F314-D318 HydrophobicContact CZ-CB 3.87Å; F314-D318 WeakPolarHBondContact CZ-OD2 3.45Å; F314-T322 WeakPolarHBondContact CE2-OG1 3.48Å; F314-T322 WeakPolarHBondContact CZ-OG1 3.27Å
315	G	51.9	Low	65.4	Low	78 Å²	78	59.8 Å²	59.8	80%	0.804	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn		-115.3	-14.5	124.9	0	0	0	0	0	115.9	Y313	Y313-G315 PolarHBondContact O-N 3Å
316	K	51.6	Low	63.7	Low	199 Å²	199	64 Å²	64	87%	0.865	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.6	0.6	-165.6	-75.4	-167	176.5	179.1	0	120.1
317	Q	45.9	Very low	62.1	Low	97 Å²	97	67.1 Å²	67.1	45%	0.453	36%	0.363	S	S	.	.			trans	-125.9	28.9	-172.1	-66.7	-170.4	-20.1	0	0	115	F314 N319	F314-Q317 VanDerWaalsContact CE1-C 3.42Å; F314-Q317 HydrophobicContact CE1-CB 4.44Å; F314-Q317 WeakPolarHBondContact CE1-O 2.95Å; Q317-N319 PolarHBondContact O-N 2.82Å
318	D	48.4	Very low	60.2	Low	94 Å²	94	69.9 Å²	69.9	50%	0.503	37%	0.373	S	S	.	.			trans	-84.9	81.3	-159.9	-154.8	153	0	0	0	114.4	F314	F314-D318 HydrophobicContact CD1-CB 3.64Å; F314-D318 HydrophobicContact CD2-CB 4.26Å; F314-D318 VanDerWaalsContact CD2-CG 3.48Å; F314-D318 WeakPolarHBondContact CD2-OD1 3.41Å; F314-D318 HydrophobicContact CE1-CB 3.64Å; F314-D318 HydrophobicContact CE2-CB 4.14Å; F314-D318 WeakPolarHBondContact CE2-OD1 3.43Å; F314-D318 VanDerWaalsContact CE2-OD2 3.23Å; F314-D318 WeakPolarHBondContact CE2-OD2 3.41Å; F314-D318 HydrophobicContact CG-CB 4.04Å; F314-D318 WeakPolarHBondContact CG-OD1 3.48Å; F314-D318 HydrophobicContact CZ-CB 3.87Å; F314-D318 WeakPolarHBondContact CZ-OD2 3.45Å
319	N	54.8	Low	57.8	Low	111 Å²	111	76.7 Å²	76.7	59%	0.594	41%	0.405	S	S	*	.	S	Bend	trans	-165.5	-63.5	157.8	-101.1	-63.6	0	0	0	112.8	Q317 L321 N323	Q317-N319 PolarHBondContact O-N 2.82Å; N319-L321 PolarHBondContact O-N 2.67Å; N319-N323 VanDerWaalsContact O-CB 3.32Å; N319-N323 WeakPolarHBondContact O-CB 3.13Å; N319-N323 PolarHBondContact O-N 3.1Å; N319-N323 PolarHBondContact O-ND2 3.14Å; N319-N323 VanDerWaalsContact O-ND2 3.15Å
320	A	56.4	Low	55.5	Low	83 Å²	83	82.3 Å²	82.3	69%	0.686	44%	0.439	S	S	*	.	H	α-helix	trans	-64.3	-47.8	-161.2	0	0	0	0	0	114.4	L324	A320-L324 PolarHBondContact O-N 3.47Å
321	L	53.8	Low	53.1	Low	16 Å²	16	85.9 Å²	85.9	8%	0.084	47%	0.465	C	S	.	.	H	α-helix	trans	-73.4	-37.6	-176.1	-169.9	76.5	0	0	0	112.5	Q279 L282 V309 Y313 N319 N323 L324 L325	Q279-L321 HydrophobicContact CB-CD1 4.32Å; Q279-L321 HydrophobicContact CG-CD1 4.35Å; Q279-L321 HydrophobicContact CG-CD2 3.78Å; L282-L321 HydrophobicContact CB-CD1 3.99Å; L282-L321 HydrophobicContact CD1-CD1 3.89Å; L282-L321 HydrophobicContact CD1-CD2 3.99Å; L282-L321 HydrophobicContact CD1-CG 4.15Å; V309-L321 HydrophobicContact CG1-CD2 3.41Å; V309-L321 VanDerWaalsContact CG1-CD2 3.41Å; V309-L321 HydrophobicContact CG1-CG 4.14Å; Y313-L321 HydrophobicContact CD2-CD2 4.11Å; Y313-L321 HydrophobicContact CE2-CD2 4.46Å; N319-L321 PolarHBondContact O-N 2.67Å; L321-N323 VanDerWaalsContact C-N 3.33Å; L321-L324 HydrophobicContact CD1-CD2 4.44Å; L321-L324 VanDerWaalsContact O-CB 3.22Å; L321-L324 WeakPolarHBondContact O-CB 3.28Å; L321-L324 PolarHBondContact O-N 3.1Å; L321-L325 PolarHBondContact O-N 2.63Å
322	T	54	Low	50.5	Low	2 Å²	2	85 Å²	85	1%	0.012	47%	0.471	C	S	.	.	H	α-helix	trans	-72	-31.2	176.9	-61.1	0	0	0	0	111.4	K310 F314 L324 L325 K326	K310-T322 HydrophobicContact CD-CG2 4.35Å; K310-T322 HydrophobicContact CG-CG2 4.13Å; F314-T322 WeakPolarHBondContact CE2-OG1 3.48Å; F314-T322 WeakPolarHBondContact CZ-OG1 3.27Å; T322-L324 VanDerWaalsContact C-N 3.29Å; T322-L324 PolarHBondContact O-N 3.21Å; T322-L325 PolarHBondContact O-N 2.58Å; T322-K326 HydrophobicContact CG2-CD 3.9Å; T322-K326 HydrophobicContact CG2-CG 4.17Å; T322-K326 WeakPolarHBondContact O-CB 3.12Å; T322-K326 VanDerWaalsContact O-CG 3.32Å; T322-K326 WeakPolarHBondContact O-CG 3.43Å; T322-K326 PolarHBondContact O-N 2.94Å
323	N	57.7	Low	48.4	Very low	87 Å²	87	87 Å²	87	47%	0.465	49%	0.489	S	S	.	.	H	α-helix	trans	-68.5	-28	170.3	-67.7	-17.1	0	0	0	112.6	N319 L321 L325	N319-N323 VanDerWaalsContact O-CB 3.32Å; N319-N323 WeakPolarHBondContact O-CB 3.13Å; N319-N323 PolarHBondContact O-N 3.1Å; N319-N323 PolarHBondContact O-ND2 3.14Å; N319-N323 VanDerWaalsContact O-ND2 3.15Å; L321-N323 VanDerWaalsContact C-N 3.33Å; N323-L325 VanDerWaalsContact C-N 3.28Å
324	L	58.4	Low	46.8	Very low	31 Å²	31	100.2 Å²	100.2	16%	0.162	54%	0.54	C	S	.	.	H	α-helix	trans	-68.1	-27	171	-162.4	74.8	0	0	0	112.6	I283 L290 A320 L321 T322	I283-L324 HydrophobicContact CG1-CD2 4.11Å; L290-L324 HydrophobicContact CD2-CD2 4.27Å; L290-L324 HydrophobicContact CD2-CG 4.27Å; A320-L324 PolarHBondContact O-N 3.47Å; L321-L324 HydrophobicContact CD1-CD2 4.44Å; L321-L324 VanDerWaalsContact O-CB 3.22Å; L321-L324 WeakPolarHBondContact O-CB 3.28Å; L321-L324 PolarHBondContact O-N 3.1Å; T322-L324 VanDerWaalsContact C-N 3.29Å; T322-L324 PolarHBondContact O-N 3.21Å
325	L	59.6	Low	46.2	Very low	17 Å²	17	102.4 Å²	102.4	9%	0.089	56%	0.555	C	S	.	*	H	α-helix	trans	-100.6	-16.2	-177.1	-66.8	168.9	0	0	0	113.9	L282 L290 L305 V309 L321 T322 N323	L282-L325 HydrophobicContact CD1-CD1 4.46Å; L282-L325 HydrophobicContact CD2-CD2 4.29Å; L290-L325 HydrophobicContact CD1-CD2 4.07Å; L290-L325 HydrophobicContact CD2-CD2 3.92Å; L290-L325 HydrophobicContact CG-CD2 4.18Å; L305-L325 HydrophobicContact CD2-CD2 4.21Å; L305-L325 HydrophobicContact CG-CD2 4.37Å; V309-L325 HydrophobicContact CB-CD1 3.91Å; V309-L325 HydrophobicContact CG1-CD1 3.78Å; V309-L325 HydrophobicContact CG2-CD1 3.89Å; L321-L325 PolarHBondContact O-N 2.63Å; T322-L325 PolarHBondContact O-N 2.58Å; N323-L325 VanDerWaalsContact C-N 3.28Å
326	K	53.2	Low	46	Very low	91 Å²	91	103.6 Å²	103.6	40%	0.396	54%	0.542	S	S	.	.	S	Bend	trans	-89.1	-7.4	176.8	-79.5	178.8	173.3	176.2	0	113.7	T322 E328 E329	T322-K326 HydrophobicContact CG2-CD 3.9Å; T322-K326 HydrophobicContact CG2-CG 4.17Å; T322-K326 WeakPolarHBondContact O-CB 3.12Å; T322-K326 VanDerWaalsContact O-CG 3.32Å; T322-K326 WeakPolarHBondContact O-CG 3.43Å; T322-K326 PolarHBondContact O-N 2.94Å; K326-E328 PolarHBondContact O-N 3.26Å; K326-E329 PolarHBondContact O-N 3.38Å
327	S	49.7	Very low	45.6	Very low	74 Å²	74	98.3 Å²	98.3	52%	0.517	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	52.8	-170	65.1	0	0	0	0	114.1
328	E	45.7	Very low	45.6	Very low	125 Å²	125	98.4 Å²	98.4	58%	0.584	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-168.3	24	149.1	-108.7	164	-145.9	0	0	114.6	K326 T330	K326-E328 PolarHBondContact O-N 3.26Å; E328-T330 PolarHBondContact O-N 3.38Å
329	E	36.1	Very low	45.5	Very low	152 Å²	152	98.7 Å²	98.7	71%	0.71	53%	0.53	S	S	*	.			trans	-68.8	63.1	161.6	-74.6	177.7	-168.2	0	0	110.9	K326	K326-E329 PolarHBondContact O-N 3.38Å
330	T	31.8	Very low	44.8	Very low	117 Å²	117	97.9 Å²	97.9	72%	0.718	53%	0.525	S	S	*	.			trans	-118.2	99.7	169.9	-43.1	0	0	0	0	108.8	E328 V332	E328-T330 PolarHBondContact O-N 3.38Å; T330-V332 PolarHBondContact O-N 2.84Å
331	T	26.9	Very low	44	Very low	122 Å²	122	98.9 Å²	98.9	75%	0.748	51%	0.514	S	S	*	.			trans	-29.3	114.3	175.3	3	0	0	0	0	114.3	V333	T331-V333 VanDerWaalsContact C-N 3.33Å; T331-V333 PolarHBondContact O-N 2.95Å
332	V	26.8	Very low	43.3	Very low	137 Å²	137	105.3 Å²	105.3	83%	0.83	55%	0.547	S	S	*	.			trans	-71.4	96	155	-177.2	0	0	0	0	106.9	T330	T330-V332 PolarHBondContact O-N 2.84Å
333	V	28.2	Very low	42.4	Very low	119 Å²	119	113.9 Å²	113.9	72%	0.721	59%	0.592	S	S	*	*			trans	-77.5	132.7	162.3	-175	0	0	0	0	107	T331	T331-V333 VanDerWaalsContact C-N 3.33Å; T331-V333 PolarHBondContact O-N 2.95Å
334	Y	34.2	Very low	41	Very low	295 Å²	295	116.4 Å²	116.4	100%	1.157	60%	0.603	S	S	*	*			trans	-57.7	0	178.5	-73.5	-80.6	0	0	0	113.5

Retrieved 334 of 334 residues in 559.1 ms (Link to these results)

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