A0A093H4Y7_STRCA Loading...

Serine/threonine-protein kinase H1

AlphaFold DB , UniProt , Accession A0A093H4Y7, Species STRCA (Struthio camelus australis), Gene n/a, Length 420 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	42.9	Very low	36.7	Very low	43 Å²	43	81.7 Å²	81.7	21%	0.212	50%	0.502	C	S	.	.				0	11.4	0	-91.6	-53.7	-149.3	0	0	112.6	I100 V108 A121 E175 L221	M1-I100 HydrophobicContact CG-CD1 4.45Å; M1-V108 HydrophobicContact CE-CG1 4.31Å; M1-V108 HydrophobicContact SD-CG1 4.45Å; M1-A121 HydrophobicContact CE-CB 3.7Å; M1-E175 PolarHBondContact N-OE1 2.97Å; M1-L221 HydrophobicContact CB-CD1 4.22Å; M1-L221 HydrophobicContact CG-CD1 3.63Å; M1-L221 HydrophobicContact SD-CD1 3.88Å
2	G	34.7	Very low	36.3	Very low	39 Å²	39	81.8 Å²	81.8	40%	0.402	51%	0.505	S	S	.	.			trans	-82.4	141.5	167.5	0	0	0	0	0	111.5
3	C	38.5	Very low	35.9	Very low	20 Å²	20	81.5 Å²	81.5	14%	0.135	51%	0.505	C	S	.	.			trans	-97	112	170.3	-70.1	0	0	0	0	108.8	R102	C3-R102 PolarHBondContact N-O 2.66Å; C3-R102 VanDerWaalsContact O-O 3.13Å
4	G	35.8	Very low	35.8	Very low	43 Å²	43	90.4 Å²	90.4	44%	0.443	53%	0.533	S	S	.	.			trans	-55.8	147.3	179	0	0	0	0	0	113.2
5	T	34.6	Very low	35.5	Very low	123 Å²	123	94.1 Å²	94.1	76%	0.755	55%	0.549	S	S	*	.	S	Bend	trans	-66.7	158.5	-179.6	43.7	0	0	0	0	112.6	K7	T5-K7 PolarHBondContact O-N 3.34Å
6	S	33.8	Very low	35.4	Very low	95 Å²	95	92.3 Å²	92.3	66%	0.664	54%	0.54	S	S	*	.			trans	-13.8	103.7	-171.1	-60.1	0	0	0	0	117.3	V8	S6-V8 PolarHBondContact O-N 3.41Å
7	K	46.3	Very low	35.1	Very low	44 Å²	44	97.2 Å²	97.2	19%	0.191	56%	0.556	C	S	.	*			trans	-88.9	10.8	-175.6	-46.3	-177	-170.7	179	0	115.2	T5 D214 D235 L238	T5-K7 PolarHBondContact O-N 3.34Å; K7-D214 WeakPolarHBondContact CE-OD2 3.44Å; K7-D214 IonicContact NZ-OD2 2.85Å; K7-D214 PolarHBondContact NZ-OD2 3.44Å; K7-D235 IonicContact NZ-OD2 2.64Å; K7-D235 PolarHBondContact NZ-OD2 3.29Å; K7-L238 HydrophobicContact CB-CD1 3.83Å; K7-L238 HydrophobicContact CD-CD1 3.48Å; K7-L238 VanDerWaalsContact CD-CD1 3.48Å; K7-L238 HydrophobicContact CD-CG 4.01Å; K7-L238 HydrophobicContact CG-CD1 4.32Å
8	V	37.2	Very low	34.7	Very low	116 Å²	116	98.7 Å²	98.7	70%	0.703	56%	0.561	S	S	*	*	B	Isolated β-bridge	trans	-104.8	125	-177.3	-177.4	0	0	0	0	109.6	S6	S6-V8 PolarHBondContact O-N 3.41Å
9	L	37	Very low	34.5	Very low	77 Å²	77	101.1 Å²	101.1	40%	0.403	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-76.3	138.8	169.2	-66.4	171.4	0	0	0	109	E11	L9-E11 PolarHBondContact O-N 2.72Å
10	P	29.2	Very low	34.3	Very low	120 Å²	120	104.1 Å²	104.1	78%	0.779	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-62.7	135.9	-174.2	25.4	-34.6	0	0	0	112
11	E	33.8	Very low	34.1	Very low	179 Å²	179	105.3 Å²	105.3	84%	0.836	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-64.5	149.9	174.8	-65.3	-166	142.8	0	0	111.7	L9	L9-E11 PolarHBondContact O-N 2.72Å
12	P	32.6	Very low	33.5	Very low	82 Å²	82	112.9 Å²	112.9	53%	0.532	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-70.3	159.5	171.3	32.1	-35.3	0	0	0	111.4
13	P	30.6	Very low	33.3	Very low	78 Å²	78	119 Å²	119	51%	0.506	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-55.9	153	166.6	-22.2	34	0	0	0	111.8	D15	P13-D15 PolarHBondContact O-N 3.42Å; P13-D15 VanDerWaalsContact O-N 3.11Å
14	K	33.8	Very low	32.9	Very low	206 Å²	206	124.5 Å²	124.5	90%	0.896	68%	0.676	S	S	*	*	S	Bend	trans	-64.6	-15.8	-175.9	-67.4	-174.7	175.4	-176.4	0	114	V16	K14-V16 PolarHBondContact O-N 2.78Å; K14-V16 VanDerWaalsContact O-N 3.12Å
15	D	31.9	Very low	32.5	Very low	146 Å²	146	128.4 Å²	128.4	78%	0.781	68%	0.683	S	S	*	*			trans	-85.7	26.7	-171.6	-34.2	-57.4	0	0	0	113.4	P13	P13-D15 PolarHBondContact O-N 3.42Å; P13-D15 VanDerWaalsContact O-N 3.11Å
16	V	33.2	Very low	32.2	Very low	65 Å²	65	128.6 Å²	128.6	39%	0.394	69%	0.686	S	S	.	*			trans	-127.6	63.1	-179.9	-166.9	0	0	0	0	110.3	K14 L18	K14-V16 PolarHBondContact O-N 2.78Å; K14-V16 VanDerWaalsContact O-N 3.12Å; V16-L18 HydrophobicContact CG1-CD1 4.26Å; V16-L18 HydrophobicContact CG1-CG 4.21Å; V16-L18 PolarHBondContact O-N 3.44Å
17	Q	30.5	Very low	31.7	Very low	176 Å²	176	133.9 Å²	133.9	82%	0.822	69%	0.692	S	S	*	*			trans	-71.5	112.9	163.6	-167	163.5	-4.3	0	0	107.9
18	L	29.1	Very low	30.9	Very low	124 Å²	124	138.3 Å²	138.3	65%	0.649	72%	0.724	S	S	*	*			trans	-102.3	105.3	176.4	-86.5	163.1	0	0	0	108.2	V16 L20	V16-L18 HydrophobicContact CG1-CD1 4.26Å; V16-L18 HydrophobicContact CG1-CG 4.21Å; V16-L18 PolarHBondContact O-N 3.44Å; L18-L20 PolarHBondContact O-N 3.26Å
19	D	29.8	Very low	30.3	Very low	144 Å²	144	136.3 Å²	136.3	77%	0.77	73%	0.726	S	S	*	*			trans	-61	124.3	177.9	-73.3	-43.6	0	0	0	111.3
20	L	31.1	Very low	29.8	Very low	161 Å²	161	140.9 Å²	140.9	84%	0.843	75%	0.745	S	S	*	*			trans	-136.3	59.5	-178	-82.3	171.9	0	0	0	110.2	L18	L18-L20 PolarHBondContact O-N 3.26Å
21	V	30	Very low	29.7	Very low	131 Å²	131	141.3 Å²	141.3	79%	0.794	74%	0.741	S	S	*	*			trans	-128.9	109.3	169.4	-177.2	0	0	0	0	108.9
22	K	31.1	Very low	29.4	Very low	201 Å²	201	140.1 Å²	140.1	87%	0.874	74%	0.74	S	S	*	*			trans	-73.6	138.3	153.7	-84.1	-171.4	173.2	-175.4	0	107.2	V24	K22-V24 PolarHBondContact O-N 3.23Å
23	K	29.6	Very low	29.1	Very low	168 Å²	168	141.9 Å²	141.9	73%	0.73	74%	0.744	S	S	*	*			trans	-48	130.3	177.4	-79	-174.6	163.7	-163.4	0	111.8	E25	K23-E25 HydrophobicContact CD-CG 4.31Å; K23-E25 WeakPolarHBondContact CD-OE1 3.48Å; K23-E25 WeakPolarHBondContact CE-OE1 3.45Å; K23-E25 IonicContact NZ-OE1 2.6Å; K23-E25 PolarHBondContact NZ-OE1 3.06Å
24	V	29.2	Very low	28.9	Very low	136 Å²	136	148.3 Å²	148.3	82%	0.824	76%	0.759	S	S	*	*			trans	-120.2	124.1	142.4	179.6	0	0	0	0	104.6	K22	K22-V24 PolarHBondContact O-N 3.23Å
25	E	27.8	Very low	28.6	Very low	125 Å²	125	146 Å²	146	58%	0.584	75%	0.75	S	S	*	*			trans	-90.2	136	-178.4	-62.9	-173	165.5	0	0	110.5	K23	K23-E25 HydrophobicContact CD-CG 4.31Å; K23-E25 WeakPolarHBondContact CD-OE1 3.48Å; K23-E25 WeakPolarHBondContact CE-OE1 3.45Å; K23-E25 IonicContact NZ-OE1 2.6Å; K23-E25 PolarHBondContact NZ-OE1 3.06Å
26	P	28.5	Very low	28.4	Very low	126 Å²	126	147 Å²	147	82%	0.818	75%	0.749	S	S	*	*			trans	-126.5	162.6	131	33.6	-24.1	0	0	0	111.8
27	Y	23.6	Very low	28.2	Very low	206 Å²	206	152.7 Å²	152.7	81%	0.808	77%	0.769	S	S	*	*			trans	-106.8	160.8	-166.9	-136.8	-102.9	0	0	0	112.8
28	T	28.9	Very low	28	Very low	138 Å²	138	150.7 Å²	150.7	85%	0.847	76%	0.762	S	S	*	*			trans	70.2	147.9	173.5	72.2	0	0	0	0	117.8
29	G	24.3	Very low	27.9	Very low	73 Å²	73	155 Å²	155	75%	0.753	78%	0.776	S	S	*	*			trans	174.9	-30.5	175.3	0	0	0	0	0	122
30	H	27.8	Very low	27.8	Very low	173 Å²	173	151.9 Å²	151.9	80%	0.801	78%	0.778	S	S	*	*			trans	59.5	145.9	174.3	-99.3	-78	0	0	0	122.1
31	N	26.3	Very low	27.5	Very low	129 Å²	129	151.8 Å²	151.8	69%	0.69	78%	0.778	S	S	*	*			trans	55.8	105.8	156.7	-60.1	-1	0	0	0	119.6
32	D	28.1	Very low	27.4	Very low	154 Å²	154	151.6 Å²	151.6	82%	0.824	78%	0.781	S	S	*	*				75.7	160.1	69.4	-164.5	25.9	0	0	0	115
33	I	25.9	Very low	27.2	Very low	119 Å²	119	145.4 Å²	145.4	61%	0.61	78%	0.775	S	S	*	*			trans	116.3	123.6	162.5	-61.8	167.2	0	0	0	117.9
34	Y	27.3	Very low	27.1	Very low	213 Å²	213	142.3 Å²	142.3	84%	0.835	78%	0.781	S	S	*	*			trans	58.1	134.2	173.4	-54.9	-49.7	0	0	0	119.9
35	K	26.3	Very low	27	Very low	159 Å²	159	142.7 Å²	142.7	69%	0.691	78%	0.783	S	S	*	*			cis	109.8	119.2	7.6	-78.8	-172.4	160	179	0	118.3
36	H	28.7	Very low	27.1	Very low	165 Å²	165	143.8 Å²	143.8	76%	0.764	79%	0.791	S	S	*	*			trans	90.9	157.4	136.6	-69.6	-31.3	0	0	0	123.7
37	F	27.2	Very low	27	Very low	186 Å²	186	147.3 Å²	147.3	82%	0.816	79%	0.793	S	S	*	*			trans	75.6	122.8	174.2	-55.5	-77.1	0	0	0	117.8
38	I	27.6	Very low	27.2	Very low	134 Å²	134	142.2 Å²	142.2	69%	0.687	79%	0.794	S	S	*	*			cis	107.7	112.8	8.5	-59.7	-179.9	0	0	0	116.5
39	K	27	Very low	27	Very low	213 Å²	213	139.5 Å²	139.5	93%	0.926	79%	0.793	S	S	*	*			trans	63.4	143	155.6	-77.2	177.3	175.9	-175.4	0	122.2
40	G	26.4	Very low	27.1	Very low	79 Å²	79	141.8 Å²	141.8	81%	0.814	80%	0.798	S	S	*	*			trans	177.6	129.6	162.3	0	0	0	0	0	108.7
41	D	25.8	Very low	27.4	Very low	160 Å²	160	139.5 Å²	139.5	86%	0.856	80%	0.798	S	S	*	*			trans	-143.1	-174.8	-169.3	-160.2	-4.2	0	0	0	111.2
42	C	27.8	Very low	27.5	Very low	126 Å²	126	138.5 Å²	138.5	85%	0.851	80%	0.802	S	S	*	*			trans	84.4	149.4	-176.8	-57.1	0	0	0	0	115.9
43	G	26.8	Very low	28.2	Very low	72 Å²	72	136.7 Å²	136.7	74%	0.742	80%	0.798	S	S	*	*			cis	169	83.7	-5.9	0	0	0	0	0	116.7
44	A	26.9	Very low	29	Very low	103 Å²	103	136.5 Å²	136.5	85%	0.851	81%	0.805	S	S	*	*			trans	52	170	140.3	0	0	0	0	0	125.1
45	V	28.8	Very low	29.1	Very low	143 Å²	143	138 Å²	138	87%	0.867	81%	0.809	S	S	*	*			trans	110.7	149.7	159.2	-172.7	0	0	0	0	117.4
46	I	28.1	Very low	29.1	Very low	148 Å²	148	138.2 Å²	138.2	76%	0.759	82%	0.818	S	S	*	*			trans	-140.3	144.1	-153.9	-60.4	162.5	0	0	0	111.5
47	K	28.3	Very low	29.1	Very low	200 Å²	200	136.4 Å²	136.4	87%	0.87	82%	0.818	S	S	*	*			trans	167.5	143.1	139.1	-90.5	158.2	-176.3	-177.8	0	109.2
48	A	25.9	Very low	29.1	Very low	100 Å²	100	134.3 Å²	134.3	83%	0.826	82%	0.816	S	S	*	*			cis	110.8	118.4	13.4	0	0	0	0	0	113.3
49	G	26.5	Very low	29.7	Very low	80 Å²	80	133.3 Å²	133.3	83%	0.825	82%	0.818	S	S	*	*			trans	172.1	135.4	175.4	0	0	0	0	0	114.8
50	S	25.5	Very low	29.7	Very low	121 Å²	121	133.1 Å²	133.1	85%	0.846	81%	0.813	S	S	*	*			trans	-140.8	175.4	176	-53.9	0	0	0	0	107.4
51	P	34.2	Very low	30.4	Very low	125 Å²	125	135.1 Å²	135.1	81%	0.812	81%	0.812	S	S	*	*			cis	-145.1	-148.3	21.9	44.3	-21	0	0	0	116.2
52	S	28.8	Very low	30.4	Very low	109 Å²	109	130.6 Å²	130.6	76%	0.762	80%	0.802	S	S	*	*			trans	-133.4	-163.3	176.7	-34.9	0	0	0	0	109
53	P	42.3	Very low	30.4	Very low	115 Å²	115	131.8 Å²	131.8	75%	0.747	80%	0.801	S	S	*	*			cis	-114.7	-130.2	-1.7	47.1	-30.6	0	0	0	110
54	P	43.3	Very low	30.5	Very low	116 Å²	116	136.4 Å²	136.4	75%	0.753	80%	0.802	S	S	*	*			cis	-93.6	-165	-16.7	6.1	19.2	0	0	0	112.3
55	R	28.1	Very low	30.4	Very low	243 Å²	243	138.7 Å²	138.7	92%	0.917	80%	0.799	S	S	*	*			cis	91.3	124.6	5.6	-74.7	-166.7	175	-164.4	-0.6	121.6
56	D	26.9	Very low	30.6	Very low	164 Å²	164	138 Å²	138	88%	0.877	80%	0.798	S	S	*	*			trans	-158.4	174.7	157.5	-115.3	-37.1	0	0	0	112.6
57	T	28.1	Very low	30.5	Very low	127 Å²	127	137 Å²	137	78%	0.779	80%	0.799	S	S	*	*			trans	-146.8	136.5	-158.1	59.4	0	0	0	0	121
58	N	28.4	Very low	30.7	Very low	143 Å²	143	136.8 Å²	136.8	77%	0.765	80%	0.8	S	S	*	*			trans	61.4	177.3	150.2	-116.6	17.5	0	0	0	119
59	P	40.6	Very low	30.9	Very low	113 Å²	113	138.1 Å²	138.1	73%	0.734	80%	0.798	S	S	*	*			cis	-131.9	-162.7	-0.8	42.3	-22.4	0	0	0	117.3
60	Y	27.3	Very low	31.1	Very low	208 Å²	208	141.9 Å²	141.9	82%	0.816	80%	0.8	S	S	*	*			trans	-77.9	-177.5	-177	-79	-81.8	0	0	0	116.1
61	P	40.2	Very low	31.3	Very low	122 Å²	122	144.4 Å²	144.4	79%	0.792	80%	0.798	S	S	*	*			cis	-129.3	-168.7	8	43.8	-26.6	0	0	0	115
62	G	26.3	Very low	31.2	Very low	64 Å²	64	144.6 Å²	144.6	66%	0.66	80%	0.799	S	S	*	*			cis	120.4	120.8	-9.1	0	0	0	0	0	116.1
63	N	26.9	Very low	31.4	Very low	152 Å²	152	147.3 Å²	147.3	81%	0.813	80%	0.8	S	S	*	*			trans	-161.6	149	170.3	-126.3	1.2	0	0	0	116.3
64	H	28.7	Very low	30.9	Very low	169 Å²	169	146.7 Å²	146.7	78%	0.782	80%	0.796	S	S	*	*			trans	6	151.8	171.4	-64	-72.8	0	0	0	126.5
65	L	25.7	Very low	30.6	Very low	150 Å²	150	153.4 Å²	153.4	79%	0.785	81%	0.806	S	S	*	*			trans	-91.1	174.7	169.9	-61	86.3	0	0	0	112.6
66	P	32.1	Very low	30.8	Very low	130 Å²	130	150.3 Å²	150.3	84%	0.844	80%	0.799	S	S	*	*				-130.3	164.7	100.9	15.9	3.5	0	0	0	115.4
67	T	26	Very low	31.1	Very low	125 Å²	125	149.7 Å²	149.7	77%	0.767	80%	0.796	S	S	*	*			trans	-69.6	144.1	-179.3	41.4	0	0	0	0	114.5
68	H	32.1	Very low	31.3	Very low	196 Å²	196	153.6 Å²	153.6	91%	0.907	80%	0.802	S	S	*	*			trans	-135.9	156.8	155.4	-125.7	-98.8	0	0	0	111
69	V	31.8	Very low	31.9	Very low	128 Å²	128	152.8 Å²	152.8	78%	0.776	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-86.3	126.7	-161.9	-174.9	0	0	0	0	112.8	Q71	V69-Q71 PolarHBondContact O-N 2.77Å
70	D	29.6	Very low	31.8	Very low	160 Å²	160	151.8 Å²	151.8	86%	0.856	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-66.8	117.3	173.6	-119.3	-23.5	0	0	0	111.1
71	Q	29	Very low	32.7	Very low	173 Å²	173	150.4 Å²	150.4	81%	0.808	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-99.6	132.5	167.9	-69.1	-165.7	15.1	0	0	110.3	V69 E73	V69-Q71 PolarHBondContact O-N 2.77Å; Q71-E73 PolarHBondContact O-N 2.72Å; Q71-E73 VanDerWaalsContact O-N 3.12Å
72	P	32.6	Very low	33.1	Very low	130 Å²	130	147.9 Å²	147.9	84%	0.844	78%	0.777	S	S	*	*			trans	-76.6	103.3	-175.9	29.8	-34.4	0	0	0	112.2
73	E	33	Very low	34.1	Very low	166 Å²	166	155.5 Å²	155.5	78%	0.776	79%	0.786	S	S	*	*			trans	-55	149	175	-88.5	-147.7	148.7	0	0	113.8	Q71	Q71-E73 PolarHBondContact O-N 2.72Å; Q71-E73 VanDerWaalsContact O-N 3.12Å
74	P	32.5	Very low	35.6	Very low	101 Å²	101	149.6 Å²	149.6	66%	0.656	76%	0.757	S	S	*	*			trans	-66.7	137.1	-172.9	25.9	-34.5	0	0	0	113.6	K76	P74-K76 VanDerWaalsContact C-N 3.27Å; P74-K76 PolarHBondContact O-N 3.24Å
75	R	35.8	Very low	37.9	Very low	258 Å²	258	150.6 Å²	150.6	97%	0.974	76%	0.76	S	S	*	*	S	Bend	trans	-67.8	56.5	-171.9	-59.7	176.2	176.2	172.9	-1.4	115.7
76	K	33.3	Very low	40.9	Very low	177 Å²	177	144.6 Å²	144.6	77%	0.77	73%	0.727	S	S	*	*			trans	-106.6	-20.3	-178.9	-73	-176.6	175.8	176.2	0	115.8	P74 K78	P74-K76 VanDerWaalsContact C-N 3.27Å; P74-K76 PolarHBondContact O-N 3.24Å; K76-K78 PolarHBondContact O-N 3.4Å
77	N	32.3	Very low	43.8	Very low	152 Å²	152	139.3 Å²	139.3	81%	0.813	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	20.3	-168.8	-73.5	-20.9	0	0	0	117.2
78	K	32.5	Very low	47	Very low	209 Å²	209	138 Å²	138	91%	0.909	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	3.9	178.4	-84	-171.7	175.2	179.9	0	116.3	K76 A80	K76-K78 PolarHBondContact O-N 3.4Å; K78-A80 VanDerWaalsContact C-N 3.35Å; K78-A80 PolarHBondContact O-N 3.35Å; K78-A80 VanDerWaalsContact O-N 3.13Å
79	V	40.6	Very low	50	Low	126 Å²	126	134.5 Å²	134.5	76%	0.764	66%	0.664	S	S	*	*			trans	-85.1	77.4	169.3	-171.4	0	0	0	0	109.8	K81	V79-K81 PolarHBondContact O-N 3.12Å; V79-K81 VanDerWaalsContact O-N 3.09Å
80	A	40.2	Very low	53	Low	92 Å²	92	128.4 Å²	128.4	76%	0.76	63%	0.627	S	S	*	*			trans	-59.9	113.2	179.1	0	0	0	0	0	111.1	K78 Y82	K78-A80 VanDerWaalsContact C-N 3.35Å; K78-A80 PolarHBondContact O-N 3.35Å; K78-A80 VanDerWaalsContact O-N 3.13Å; A80-Y82 PolarHBondContact O-N 3.11Å
81	K	45	Very low	56.2	Low	178 Å²	178	123.5 Å²	123.5	77%	0.774	60%	0.603	S	S	*	*			trans	-66.3	97.8	-166.3	-160.1	166.5	-171.2	167.7	0	111.8	V79 R83	V79-K81 PolarHBondContact O-N 3.12Å; V79-K81 VanDerWaalsContact O-N 3.09Å; K81-R83 PolarHBondContact O-N 3.38Å
82	Y	48.5	Very low	59.4	Low	69 Å²	69	118.3 Å²	118.3	27%	0.271	59%	0.59	S	S	.	*			trans	-65.8	87.9	-171.7	-173	-97.7	0	0	0	113.1	A80 A84 F86 L99 R107 V109	A80-Y82 PolarHBondContact O-N 3.11Å; Y82-A84 VanDerWaalsContact C-N 3.32Å; Y82-A84 HydrophobicContact CD1-CB 4.14Å; Y82-A84 HydrophobicContact CE1-CB 3.6Å; Y82-A84 PolarHBondContact O-N 3.18Å; Y82-A84 VanDerWaalsContact O-N 3.12Å; Y82-F86 HydrophobicContact CD1-CE2 4.24Å; Y82-F86 HydrophobicContact CE1-CE2 4.15Å; Y82-F86 HydrophobicContact CE1-CZ 4.44Å; Y82-L99 HydrophobicContact CE2-CB 4.35Å; Y82-L99 HydrophobicContact CE2-CD1 4.24Å; Y82-L99 HydrophobicContact CE2-CD2 4.21Å; Y82-R107 WeakPolarHBondContact OH-CD 3.5Å; Y82-R107 PolarHBondContact OH-NH1 2.81Å; Y82-V109 HydrophobicContact CE1-CG1 4.28Å
83	R	48.3	Very low	62.5	Low	225 Å²	225	116.1 Å²	116.1	85%	0.849	57%	0.567	S	S	*	*			trans	-86.3	57.9	-178.8	-80.1	178.8	159.4	159.7	-7.6	113.6	K81	K81-R83 PolarHBondContact O-N 3.38Å
84	A	58	Low	65.5	Low	27 Å²	27	108.6 Å²	108.6	22%	0.223	53%	0.531	C	S	.	.			trans	-73.8	131.5	148.9	0	0	0	0	0	107.8	Y82 F86	Y82-A84 VanDerWaalsContact C-N 3.32Å; Y82-A84 HydrophobicContact CD1-CB 4.14Å; Y82-A84 HydrophobicContact CE1-CB 3.6Å; Y82-A84 PolarHBondContact O-N 3.18Å; Y82-A84 VanDerWaalsContact O-N 3.12Å; A84-F86 HydrophobicContact CB-CD2 4.26Å; A84-F86 HydrophobicContact CB-CE2 3.97Å; A84-F86 WeakPolarHBondContact O-CD2 3.41Å; A84-F86 PolarHBondContact O-N 2.89Å; A84-F86 VanDerWaalsContact O-N 3.11Å
85	K	77.5	Confident	68.6	Low	190 Å²	190	106.2 Å²	106.2	83%	0.826	51%	0.513	S	S	*	.			trans	-70.5	104.8	165.4	-73.4	-172.4	178.5	-177.4	0	107.7	R163	K85-R163 PolarHBondContact O-NH1 2.76Å
86	F	88.9	Confident	71.4	Confident	24 Å²	24	96.2 Å²	96.2	11%	0.105	48%	0.479	C	S	.	.			trans	-77.2	159.9	166.8	-77.6	-100.5	0	0	0	109.8	Y82 A84 V90 T91 I96 V109 M124 Y165	Y82-F86 HydrophobicContact CD1-CE2 4.24Å; Y82-F86 HydrophobicContact CE1-CE2 4.15Å; Y82-F86 HydrophobicContact CE1-CZ 4.44Å; A84-F86 HydrophobicContact CB-CD2 4.26Å; A84-F86 HydrophobicContact CB-CE2 3.97Å; A84-F86 WeakPolarHBondContact O-CD2 3.41Å; A84-F86 PolarHBondContact O-N 2.89Å; A84-F86 VanDerWaalsContact O-N 3.11Å; F86-V90 HydrophobicContact CD1-CG1 4.18Å; F86-T91 HydrophobicContact CB-CG2 3.56Å; F86-T91 HydrophobicContact CG-CG2 4.47Å; F86-I96 HydrophobicContact CD1-CD1 3.92Å; F86-I96 HydrophobicContact CD1-CG1 4.35Å; F86-I96 HydrophobicContact CD2-CG1 4.08Å; F86-I96 HydrophobicContact CE1-CD1 3.9Å; F86-I96 HydrophobicContact CE1-CG1 4.42Å; F86-I96 HydrophobicContact CE2-CG1 4.16Å; F86-I96 HydrophobicContact CE2-CG2 3.84Å; F86-I96 HydrophobicContact CG-CD1 4.26Å; F86-I96 HydrophobicContact CG-CG1 4.2Å; F86-I96 HydrophobicContact CZ-CD1 4.23Å; F86-I96 HydrophobicContact CZ-CG1 4.34Å; F86-I96 HydrophobicContact CZ-CG2 3.89Å; F86-V109 HydrophobicContact CE1-CG2 3.89Å; F86-V109 HydrophobicContact CZ-CG1 4.02Å; F86-V109 HydrophobicContact CZ-CG2 3.77Å; F86-M124 HydrophobicContact CD1-CE 3.83Å; F86-M124 HydrophobicContact CE1-CE 3.32Å; F86-M124 HydrophobicContact CE2-CE 4.16Å; F86-M124 HydrophobicContact CG-CE 4.43Å; F86-M124 HydrophobicContact CZ-CE 3.49Å; F86-M124 VanDerWaalsContact CZ-CE 3.49Å; F86-Y165 AromaticContact CD1-CD1 4Å; F86-Y165 HydrophobicContact CD1-CD1 4Å; F86-Y165 AromaticContact CD1-CE1 3.7Å; F86-Y165 HydrophobicContact CD1-CE1 3.7Å; F86-Y165 HydrophobicContact CE1-CD1 4.38Å; F86-Y165 HydrophobicContact CE1-CE1 4.31Å; F86-Y165 HydrophobicContact CG-CE1 4.41Å
87	D	92.3	Very high	74.4	Confident	19 Å²	19	91.9 Å²	91.9	10%	0.102	46%	0.46	C	S	.	.			trans	-64.2	137.9	173.7	-176.4	-75.1	0	0	0	111.3	R89 V90 T91 T160 Y165	D87-R89 PolarHBondContact O-N 2.95Å; D87-R89 WeakPolarHBondContact OD1-CA 3.27Å; D87-R89 WeakPolarHBondContact OD1-CB 3.5Å; D87-R89 WeakPolarHBondContact OD1-CG 3.49Å; D87-R89 IonicContact OD1-CZ 3.19Å; D87-R89 PolarHBondContact OD1-N 2.87Å; D87-R89 IonicContact OD1-NE 3.69Å; D87-R89 PolarHBondContact OD1-NE 3.3Å; D87-R89 IonicContact OD1-NH2 2.72Å; D87-R89 IonicContact OD2-CZ 2.66Å; D87-R89 IonicContact OD2-NE 3.48Å; D87-R89 PolarHBondContact OD2-NE 3.38Å; D87-R89 IonicContact OD2-NH2 2.77Å; D87-R89 PolarHBondContact OD2-NH2 3.32Å; D87-V90 HydrophobicContact CB-CG2 4.04Å; D87-V90 WeakPolarHBondContact O-CB 3.29Å; D87-V90 PolarHBondContact O-N 2.71Å; D87-T91 PolarHBondContact O-N 3.48Å; D87-T160 HydrophobicContact CB-CG2 4.32Å; D87-T160 WeakPolarHBondContact OD2-CG2 3.24Å; D87-Y165 HydrophobicContact CB-CE2 3.94Å; D87-Y165 PolarHBondContact N-OH 3.2Å
88	P	93.4	Very high	77.2	Confident	97 Å²	97	86.9 Å²	86.9	63%	0.63	44%	0.44	S	S	*	.	H	α-helix	trans	-55.2	-32.4	179.6	-28.3	36.4	0	0	0	114.8	V90 T91 A92	P88-V90 VanDerWaalsContact C-N 3.35Å; P88-T91 WeakPolarHBondContact CA-OG1 3.4Å; P88-T91 PolarHBondContact O-N 3.49Å; P88-T91 PolarHBondContact O-OG1 2.92Å; P88-A92 VanDerWaalsContact O-CB 3.26Å; P88-A92 WeakPolarHBondContact O-CB 3.29Å; P88-A92 PolarHBondContact O-N 2.96Å
89	R	95.3	Very high	80.1	Confident	123 Å²	123	79.5 Å²	79.5	46%	0.464	41%	0.41	S	S	.	.	H	α-helix	trans	-68.5	-35.3	177.4	-57.7	166.3	-70.2	169.3	-0.7	111.3	D87 F158 E159	D87-R89 PolarHBondContact O-N 2.95Å; D87-R89 WeakPolarHBondContact OD1-CA 3.27Å; D87-R89 WeakPolarHBondContact OD1-CB 3.5Å; D87-R89 WeakPolarHBondContact OD1-CG 3.49Å; D87-R89 IonicContact OD1-CZ 3.19Å; D87-R89 PolarHBondContact OD1-N 2.87Å; D87-R89 IonicContact OD1-NE 3.69Å; D87-R89 PolarHBondContact OD1-NE 3.3Å; D87-R89 IonicContact OD1-NH2 2.72Å; D87-R89 IonicContact OD2-CZ 2.66Å; D87-R89 IonicContact OD2-NE 3.48Å; D87-R89 PolarHBondContact OD2-NE 3.38Å; D87-R89 IonicContact OD2-NH2 2.77Å; D87-R89 PolarHBondContact OD2-NH2 3.32Å; R89-F158 HydrophobicContact CB-CD1 3.76Å; R89-F158 HydrophobicContact CB-CE1 3.89Å; R89-E159 PolarHBondContact NH1-O 3.36Å; R89-E159 PolarHBondContact NH2-O 3.11Å
90	V	95.4	Very high	82.4	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-68.1	-50.7	172.8	179.7	0	0	0	0	109.8	F86 D87 P88 A92 K93 Y94 I96 I122 F158 Y165	F86-V90 HydrophobicContact CD1-CG1 4.18Å; D87-V90 HydrophobicContact CB-CG2 4.04Å; D87-V90 WeakPolarHBondContact O-CB 3.29Å; D87-V90 PolarHBondContact O-N 2.71Å; P88-V90 VanDerWaalsContact C-N 3.35Å; V90-A92 PolarHBondContact O-N 3.49Å; V90-K93 PolarHBondContact O-N 3.22Å; V90-Y94 WeakPolarHBondContact O-CB 3.31Å; V90-Y94 PolarHBondContact O-N 2.9Å; V90-I96 HydrophobicContact CG1-CD1 4.29Å; V90-I122 HydrophobicContact CG1-CD1 3.59Å; V90-F158 HydrophobicContact CG2-CB 3.78Å; V90-F158 HydrophobicContact CG2-CD1 4.02Å; V90-F158 HydrophobicContact CG2-CD2 3.61Å; V90-F158 HydrophobicContact CG2-CE1 4.49Å; V90-F158 HydrophobicContact CG2-CE2 4.13Å; V90-F158 HydrophobicContact CG2-CG 3.54Å; V90-Y165 HydrophobicContact CG2-CD1 4.12Å; V90-Y165 HydrophobicContact CG2-CD2 4.34Å; V90-Y165 HydrophobicContact CG2-CG 3.98Å
91	T	95.4	Very high	84.6	Confident	58 Å²	58	72.4 Å²	72.4	36%	0.356	36%	0.356	S	S	.	.	H	α-helix	trans	-73.9	-12.6	-178.7	60.1	0	0	0	0	113.8	F86 D87 P88 K114	F86-T91 HydrophobicContact CB-CG2 3.56Å; F86-T91 HydrophobicContact CG-CG2 4.47Å; D87-T91 PolarHBondContact O-N 3.48Å; P88-T91 WeakPolarHBondContact CA-OG1 3.4Å; P88-T91 PolarHBondContact O-N 3.49Å; P88-T91 PolarHBondContact O-OG1 2.92Å; T91-K114 WeakPolarHBondContact O-CE 3.19Å; T91-K114 PolarHBondContact O-NZ 3.05Å
92	A	96.2	Very high	86.6	Confident	63 Å²	63	71.5 Å²	71.5	52%	0.521	35%	0.348	S	S	.	.	H	α-helix	trans	-66.8	-53.1	167.9	0	0	0	0	0	110.2	P88 V90 K114	P88-A92 VanDerWaalsContact O-CB 3.26Å; P88-A92 WeakPolarHBondContact O-CB 3.29Å; P88-A92 PolarHBondContact O-N 2.96Å; V90-A92 PolarHBondContact O-N 3.49Å; A92-K114 WeakPolarHBondContact O-CD 3.37Å; A92-K114 WeakPolarHBondContact O-CE 3.36Å; A92-K114 PolarHBondContact O-NZ 2.91Å
93	K	97.6	Very high	88	Confident	84 Å²	84	69.2 Å²	69.2	37%	0.365	35%	0.345	S	S	.	.	H	α-helix	trans	-81.9	-30.5	-177.8	-62.1	-162.6	-162.2	175.3	0	115.3	V90 H113 K114 E156 F158	V90-K93 PolarHBondContact O-N 3.22Å; K93-H113 PolarHBondContact O-CD2 2.88Å; K93-K114 WeakPolarHBondContact O-CB 3.45Å; K93-K114 WeakPolarHBondContact O-CG 3.44Å; K93-K114 PolarHBondContact O-N 2.99Å; K93-E156 WeakPolarHBondContact CD-OE1 3.42Å; K93-E156 IonicContact NZ-OE1 3.31Å; K93-E156 PolarHBondContact NZ-OE1 3.09Å; K93-E156 IonicContact NZ-OE2 3.52Å; K93-E156 PolarHBondContact NZ-OE2 3.35Å; K93-F158 HydrophobicContact CD-CZ 4.08Å
94	Y	97.5	Very high	89.4	Confident	8 Å²	8	61.4 Å²	61.4	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	135.1	-167.4	-67.6	-79.4	0	0	0	114	V90 V111 E112 H113 Y120 I122 E156 F158 V167	V90-Y94 WeakPolarHBondContact O-CB 3.31Å; V90-Y94 PolarHBondContact O-N 2.9Å; Y94-V111 HydrophobicContact CD1-CB 4.25Å; Y94-V111 HydrophobicContact CD1-CG2 3.52Å; Y94-V111 HydrophobicContact CE1-CG2 4.16Å; Y94-V111 HydrophobicContact CG-CG2 4.1Å; Y94-E112 WeakPolarHBondContact CA-O 3.17Å; Y94-H113 HydrophobicContact CD1-CB 4.14Å; Y94-H113 HydrophobicContact CE1-CB 3.73Å; Y94-H113 AromaticContact CE1-CD2 3.94Å; Y94-Y120 AromaticContact CE1-CD2 3.77Å; Y94-Y120 HydrophobicContact CE1-CD2 3.77Å; Y94-Y120 HydrophobicContact CE1-CE2 4.29Å; Y94-I122 HydrophobicContact CD2-CD1 4.33Å; Y94-I122 HydrophobicContact CG-CD1 4.35Å; Y94-E156 WeakPolarHBondContact CE2-OE1 3.29Å; Y94-E156 PolarHBondContact OH-OE1 3.28Å; Y94-F158 HydrophobicContact CD2-CE2 4.43Å; Y94-F158 HydrophobicContact CE2-CE2 4.03Å; Y94-F158 HydrophobicContact CE2-CZ 4.17Å; Y94-V167 HydrophobicContact CE1-CG1 4.16Å; Y94-V167 HydrophobicContact CE2-CG1 4.49Å; Y94-V167 HydrophobicContact CE2-CG2 3.95Å
95	D	96.4	Very high	90.6	Very high	51 Å²	51	63.5 Å²	63.5	27%	0.273	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	111.9	164.6	-72.5	-19.9	0	0	0	109.3	K97 V111 E112 K114	D95-K97 HydrophobicContact CB-CD 4.16Å; D95-K97 PolarHBondContact O-N 3.06Å; D95-K97 IonicContact OD2-NZ 3.05Å; D95-K97 PolarHBondContact OD2-NZ 3.26Å; D95-V111 VanDerWaalsContact O-CA 3.28Å; D95-V111 WeakPolarHBondContact O-CA 3.49Å; D95-E112 HydrophobicContact CB-CB 4.42Å; D95-E112 PolarHBondContact N-O 2.88Å; D95-E112 PolarHBondContact O-N 3.11Å; D95-K114 WeakPolarHBondContact OD1-CE 3.38Å; D95-K114 WeakPolarHBondContact OD1-CG 3.41Å
96	I	95.3	Very high	91.1	Very high	48 Å²	48	55.2 Å²	55.2	25%	0.246	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	118.5	174.7	-47.9	-56	0	0	0	109	F86 V90 V109 V111	F86-I96 HydrophobicContact CD1-CD1 3.92Å; F86-I96 HydrophobicContact CD1-CG1 4.35Å; F86-I96 HydrophobicContact CD2-CG1 4.08Å; F86-I96 HydrophobicContact CE1-CD1 3.9Å; F86-I96 HydrophobicContact CE1-CG1 4.42Å; F86-I96 HydrophobicContact CE2-CG1 4.16Å; F86-I96 HydrophobicContact CE2-CG2 3.84Å; F86-I96 HydrophobicContact CG-CD1 4.26Å; F86-I96 HydrophobicContact CG-CG1 4.2Å; F86-I96 HydrophobicContact CZ-CD1 4.23Å; F86-I96 HydrophobicContact CZ-CG1 4.34Å; F86-I96 HydrophobicContact CZ-CG2 3.89Å; V90-I96 HydrophobicContact CG1-CD1 4.29Å; I96-V109 HydrophobicContact CG2-CB 4.38Å; I96-V109 HydrophobicContact CG2-CG2 4.32Å; I96-V111 HydrophobicContact CD1-CB 4.5Å; I96-V111 HydrophobicContact CD1-CG1 3.59Å
97	K	94.8	Very high	91.2	Very high	86 Å²	86	58.6 Å²	58.6	37%	0.374	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-64.9	-175.7	-50.5	-63.4	-175.1	174.8	0	112.4	D95 R110 E112	D95-K97 HydrophobicContact CB-CD 4.16Å; D95-K97 PolarHBondContact O-N 3.06Å; D95-K97 IonicContact OD2-NZ 3.05Å; D95-K97 PolarHBondContact OD2-NZ 3.26Å; K97-R110 PolarHBondContact N-O 3.18Å; K97-E112 HydrophobicContact CD-CB 4.48Å; K97-E112 WeakPolarHBondContact CE-OE1 3.21Å; K97-E112 WeakPolarHBondContact CE-OE2 3.08Å; K97-E112 HydrophobicContact CG-CB 4.43Å; K97-E112 IonicContact NZ-OE1 3.63Å; K97-E112 PolarHBondContact NZ-OE1 3.35Å; K97-E112 IonicContact NZ-OE2 3.09Å; K97-E112 PolarHBondContact NZ-OE2 3.13Å
98	A	93.1	Very high	91.2	Very high	47 Å²	47	57.9 Å²	57.9	39%	0.388	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	150.7	-170	0	0	0	0	0	112.9	V109 R110	A98-V109 CarbonylContact O-C 3.53Å; A98-V109 VanDerWaalsContact O-CA 3.24Å; A98-V109 WeakPolarHBondContact O-CA 3.48Å; A98-V109 WeakPolarHBondContact O-CB 3.05Å; A98-R110 PolarHBondContact N-O 3.04Å; A98-R110 PolarHBondContact O-N 2.78Å
99	L	92.1	Very high	91.3	Very high	54 Å²	54	53.3 Å²	53.3	28%	0.283	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	126.1	169.6	-177.2	79.8	0	0	0	110	Y82 G101 R102 R107 V108 V109	Y82-L99 HydrophobicContact CE2-CB 4.35Å; Y82-L99 HydrophobicContact CE2-CD1 4.24Å; Y82-L99 HydrophobicContact CE2-CD2 4.21Å; L99-G101 WeakPolarHBondContact CD1-O 3.32Å; L99-R102 HydrophobicContact CD2-CG 3.94Å; L99-R107 HydrophobicContact CD1-CB 4.41Å; L99-V108 WeakPolarHBondContact CD1-O 3.36Å; L99-V109 HydrophobicContact CD1-CG1 3.95Å
100	I	89.6	Confident	91.3	Very high	61 Å²	61	52.6 Å²	52.6	31%	0.313	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-8.3	-178.8	65.4	175.3	0	0	0	113.9	M1 V108 R110 A121 L170	M1-I100 HydrophobicContact CG-CD1 4.45Å; I100-V108 HydrophobicContact CD1-CG1 3.89Å; I100-V108 HydrophobicContact CG1-CB 4.03Å; I100-V108 HydrophobicContact CG1-CG1 3.71Å; I100-V108 WeakPolarHBondContact CG1-O 3.33Å; I100-V108 PolarHBondContact N-O 3.38Å; I100-R110 HydrophobicContact CD1-CB 4.32Å; I100-R110 HydrophobicContact CG2-CB 3.83Å; I100-A121 HydrophobicContact CD1-CB 4.35Å; I100-L170 HydrophobicContact CD1-CD1 3.58Å
101	G	86	Confident	91.4	Very high	8 Å²	8	52.6 Å²	52.6	8%	0.082	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	153.7	176.2	0	0	0	0	0	113.7	L99 V108	L99-G101 WeakPolarHBondContact CD1-O 3.32Å; G101-V108 PolarHBondContact N-O 2.87Å; G101-V108 PolarHBondContact O-N 2.73Å
102	R	86.6	Confident	91.5	Very high	160 Å²	160	51.7 Å²	51.7	60%	0.604	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	151.2	167.6	-62.5	-174	-176.2	176.9	6.6	108.8	C3 L99	C3-R102 PolarHBondContact N-O 2.66Å; C3-R102 VanDerWaalsContact O-O 3.13Å; L99-R102 HydrophobicContact CD2-CG 3.94Å
103	G	78.8	Confident	91.6	Very high	21 Å²	21	50.7 Å²	50.7	22%	0.216	25%	0.248	C	C	.	.			trans	-139.4	-171.9	163.9	0	0	0	0	0	109.9	F105 S106	G103-F105 PolarHBondContact O-N 2.82Å; G103-S106 PolarHBondContact N-O 2.83Å
104	S	77.6	Confident	91.6	Very high	61 Å²	61	50.5 Å²	50.5	43%	0.427	25%	0.247	S	C	.	.	S	Bend	trans	-59.9	-43.1	-176.4	-54.2	0	0	0	0	113.6
105	F	81.8	Confident	91.6	Very high	70 Å²	70	54.2 Å²	54.2	31%	0.307	28%	0.279	S	S	.	.	S	Bend	trans	-122.4	6.3	-178.4	-51.7	-67.4	0	0	0	112.9	G103 I125 E126 Y129 E131	G103-F105 PolarHBondContact O-N 2.82Å; F105-I125 WeakPolarHBondContact O-CA 3.33Å; F105-E126 PolarHBondContact O-N 3.5Å; F105-Y129 AromaticContact CD1-CD2 3.85Å; F105-Y129 HydrophobicContact CD1-CD2 3.85Å; F105-Y129 HydrophobicContact CE1-CD2 4.06Å; F105-Y129 HydrophobicContact CE1-CG 4.39Å; F105-E131 HydrophobicContact CD2-CB 4.37Å; F105-E131 HydrophobicContact CE2-CB 3.69Å; F105-E131 HydrophobicContact CZ-CB 4.03Å
106	S	88.1	Confident	91.6	Very high	17 Å²	17	56.1 Å²	56.1	12%	0.119	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.4	-168.8	64	0	0	0	0	113.2	G103 M124	G103-S106 PolarHBondContact N-O 2.83Å; S106-M124 CarbonylContact C-O 3.59Å; S106-M124 WeakPolarHBondContact CA-O 3.46Å
107	R	91	Very high	91.7	Very high	94 Å²	94	59.4 Å²	59.4	36%	0.355	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	128.9	178.3	-69.6	171.1	171.9	-151.3	5.8	109	Y82 L99 M124	Y82-R107 WeakPolarHBondContact OH-CD 3.5Å; Y82-R107 PolarHBondContact OH-NH1 2.81Å; L99-R107 HydrophobicContact CD1-CB 4.41Å; R107-M124 PolarHBondContact N-O 3.07Å; R107-M124 PolarHBondContact O-N 3.16Å
108	V	93.1	Very high	91.8	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.024	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.6	179	-165.4	0	0	0	0	109	M1 L99 I100 G101 A121 I122 K123	M1-V108 HydrophobicContact CE-CG1 4.31Å; M1-V108 HydrophobicContact SD-CG1 4.45Å; L99-V108 WeakPolarHBondContact CD1-O 3.36Å; I100-V108 HydrophobicContact CD1-CG1 3.89Å; I100-V108 HydrophobicContact CG1-CB 4.03Å; I100-V108 HydrophobicContact CG1-CG1 3.71Å; I100-V108 WeakPolarHBondContact CG1-O 3.33Å; I100-V108 PolarHBondContact N-O 3.38Å; G101-V108 PolarHBondContact N-O 2.87Å; G101-V108 PolarHBondContact O-N 2.73Å; V108-A121 HydrophobicContact CG1-CB 4.11Å; V108-I122 WeakPolarHBondContact CA-O 3.45Å; V108-K123 HydrophobicContact CG2-CG 4.24Å
109	V	95.3	Very high	92	Very high	1 Å²	1	59 Å²	59	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141	174.4	-67	0	0	0	0	111.1	Y82 F86 I96 A98 L99 V111 A121 I122	Y82-V109 HydrophobicContact CE1-CG1 4.28Å; F86-V109 HydrophobicContact CE1-CG2 3.89Å; F86-V109 HydrophobicContact CZ-CG1 4.02Å; F86-V109 HydrophobicContact CZ-CG2 3.77Å; I96-V109 HydrophobicContact CG2-CB 4.38Å; I96-V109 HydrophobicContact CG2-CG2 4.32Å; A98-V109 CarbonylContact O-C 3.53Å; A98-V109 VanDerWaalsContact O-CA 3.24Å; A98-V109 WeakPolarHBondContact O-CA 3.48Å; A98-V109 WeakPolarHBondContact O-CB 3.05Å; L99-V109 HydrophobicContact CD1-CG1 3.95Å; V109-V111 HydrophobicContact CG2-CG1 3.79Å; V109-A121 CarbonylContact O-C 3.59Å; V109-A121 WeakPolarHBondContact O-CA 3.43Å; V109-I122 HydrophobicContact CG2-CB 3.92Å; V109-I122 PolarHBondContact N-O 3.39Å; V109-I122 PolarHBondContact O-N 3.35Å
110	R	96.2	Very high	92.2	Very high	109 Å²	109	58.6 Å²	58.6	41%	0.411	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	130.8	162	175.2	175.7	174.9	-175.2	-2.8	108.5	K97 A98 I100 L170	K97-R110 PolarHBondContact N-O 3.18Å; A98-R110 PolarHBondContact N-O 3.04Å; A98-R110 PolarHBondContact O-N 2.78Å; I100-R110 HydrophobicContact CD1-CB 4.32Å; I100-R110 HydrophobicContact CG2-CB 3.83Å; R110-L170 HydrophobicContact CB-CD1 4.43Å; R110-L170 HydrophobicContact CG-CD1 4.45Å; R110-L170 HydrophobicContact CG-CD2 3.87Å
111	V	97.1	Very high	92.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	174.7	174.8	-50.2	0	0	0	0	110.5	Y94 D95 I96 V109 P119 Y120 I122	Y94-V111 HydrophobicContact CD1-CB 4.25Å; Y94-V111 HydrophobicContact CD1-CG2 3.52Å; Y94-V111 HydrophobicContact CE1-CG2 4.16Å; Y94-V111 HydrophobicContact CG-CG2 4.1Å; D95-V111 VanDerWaalsContact O-CA 3.28Å; D95-V111 WeakPolarHBondContact O-CA 3.49Å; I96-V111 HydrophobicContact CD1-CB 4.5Å; I96-V111 HydrophobicContact CD1-CG1 3.59Å; V109-V111 HydrophobicContact CG2-CG1 3.79Å; V111-P119 WeakPolarHBondContact O-CA 3.46Å; V111-Y120 PolarHBondContact N-O 3.46Å; V111-Y120 PolarHBondContact O-N 2.84Å; V111-I122 HydrophobicContact CB-CD1 4.43Å; V111-I122 HydrophobicContact CB-CG1 4.41Å; V111-I122 HydrophobicContact CG1-CB 4.32Å; V111-I122 HydrophobicContact CG1-CD1 3.77Å; V111-I122 HydrophobicContact CG1-CG1 3.74Å; V111-I122 HydrophobicContact CG2-CD1 4Å; V111-I122 HydrophobicContact CG2-CG1 3.76Å
112	E	97.6	Very high	93.1	Very high	39 Å²	39	55.3 Å²	55.3	18%	0.182	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	131.7	175.8	-169.2	-179.1	92.7	0	0	108.2	Y94 D95 K97 K114 K117 Q118	Y94-E112 WeakPolarHBondContact CA-O 3.17Å; D95-E112 HydrophobicContact CB-CB 4.42Å; D95-E112 PolarHBondContact N-O 2.88Å; D95-E112 PolarHBondContact O-N 3.11Å; K97-E112 HydrophobicContact CD-CB 4.48Å; K97-E112 WeakPolarHBondContact CE-OE1 3.21Å; K97-E112 WeakPolarHBondContact CE-OE2 3.08Å; K97-E112 HydrophobicContact CG-CB 4.43Å; K97-E112 IonicContact NZ-OE1 3.63Å; K97-E112 PolarHBondContact NZ-OE1 3.35Å; K97-E112 IonicContact NZ-OE2 3.09Å; K97-E112 PolarHBondContact NZ-OE2 3.13Å; E112-K114 PolarHBondContact O-N 3.13Å; E112-K117 HydrophobicContact CG-CB 4.49Å; E112-K117 WeakPolarHBondContact CG-O 3.48Å; E112-Q118 WeakPolarHBondContact CA-O 3.45Å
113	H	97.9	Very high	93.5	Very high	42 Å²	42	48.3 Å²	48.3	19%	0.194	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.6	177.2	-178	-121.4	0	0	0	109.7	K93 Y94 A115 T116 K117 Q118 Y120	K93-H113 PolarHBondContact O-CD2 2.88Å; Y94-H113 HydrophobicContact CD1-CB 4.14Å; Y94-H113 HydrophobicContact CE1-CB 3.73Å; Y94-H113 AromaticContact CE1-CD2 3.94Å; H113-A115 VanDerWaalsContact C-N 3.33Å; H113-A115 PolarHBondContact O-N 3.32Å; H113-T116 PolarHBondContact ND1-OG1 3.29Å; H113-T116 PolarHBondContact O-N 3.18Å; H113-K117 VanDerWaalsContact O-CA 3.25Å; H113-K117 WeakPolarHBondContact O-CA 3.27Å; H113-K117 PolarHBondContact O-N 3.46Å; H113-Q118 PolarHBondContact N-O 3.4Å; H113-Y120 HydrophobicContact CB-CD2 4.19Å; H113-Y120 HydrophobicContact CB-CE2 3.88Å
114	K	97.6	Very high	94.2	Very high	79 Å²	79	47.6 Å²	47.6	34%	0.343	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-39.5	-165.9	-76.3	-172.1	-166.7	164.9	0	114.3	T91 A92 K93 D95 E112 K117	T91-K114 WeakPolarHBondContact O-CE 3.19Å; T91-K114 PolarHBondContact O-NZ 3.05Å; A92-K114 WeakPolarHBondContact O-CD 3.37Å; A92-K114 WeakPolarHBondContact O-CE 3.36Å; A92-K114 PolarHBondContact O-NZ 2.91Å; K93-K114 WeakPolarHBondContact O-CB 3.45Å; K93-K114 WeakPolarHBondContact O-CG 3.44Å; K93-K114 PolarHBondContact O-N 2.99Å; D95-K114 WeakPolarHBondContact OD1-CE 3.38Å; D95-K114 WeakPolarHBondContact OD1-CG 3.41Å; E112-K114 PolarHBondContact O-N 3.13Å; K114-K117 VanDerWaalsContact O-CE 3.31Å; K114-K117 WeakPolarHBondContact O-CE 3.48Å; K114-K117 PolarHBondContact O-NZ 3.21Å
115	A	97.1	Very high	94.9	Very high	86 Å²	86	44.8 Å²	44.8	71%	0.711	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-46.2	-176.3	0	0	0	0	0	112.5	H113	H113-A115 VanDerWaalsContact C-N 3.33Å; H113-A115 PolarHBondContact O-N 3.32Å
116	T	97.4	Very high	95.3	Very high	91 Å²	91	43.5 Å²	43.5	56%	0.558	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-7.3	-173.9	60.9	0	0	0	0	114.3	H113 Q118	H113-T116 PolarHBondContact ND1-OG1 3.29Å; H113-T116 PolarHBondContact O-N 3.18Å; T116-Q118 PolarHBondContact O-N 3.27Å
117	K	97.1	Very high	95.4	Very high	118 Å²	118	43.2 Å²	43.2	51%	0.513	22%	0.215	S	C	.	.			trans	55.5	11.6	-171.7	-54.4	-51.3	-173.6	-165.7	0	115.5	E112 H113 K114	E112-K117 HydrophobicContact CG-CB 4.49Å; E112-K117 WeakPolarHBondContact CG-O 3.48Å; H113-K117 VanDerWaalsContact O-CA 3.25Å; H113-K117 WeakPolarHBondContact O-CA 3.27Å; H113-K117 PolarHBondContact O-N 3.46Å; K114-K117 VanDerWaalsContact O-CE 3.31Å; K114-K117 WeakPolarHBondContact O-CE 3.48Å; K114-K117 PolarHBondContact O-NZ 3.21Å
118	Q	96.4	Very high	95.3	Very high	79 Å²	79	43 Å²	43	37%	0.369	22%	0.217	S	C	.	.			trans	-66.6	127.8	177.9	-174.6	63.6	17.1	0	0	110.5	E112 H113 T116 Y120	E112-Q118 WeakPolarHBondContact CA-O 3.45Å; H113-Q118 PolarHBondContact N-O 3.4Å; T116-Q118 PolarHBondContact O-N 3.27Å; Q118-Y120 HydrophobicContact CB-CD2 4.46Å; Q118-Y120 HydrophobicContact CB-CE2 3.7Å; Q118-Y120 HydrophobicContact CG-CD2 4.32Å; Q118-Y120 HydrophobicContact CG-CE1 4.13Å; Q118-Y120 HydrophobicContact CG-CE2 3.58Å; Q118-Y120 VanDerWaalsContact CG-CZ 3.48Å; Q118-Y120 WeakPolarHBondContact CG-OH 3.46Å; Q118-Y120 VanDerWaalsContact O-CD2 3.27Å; Q118-Y120 WeakPolarHBondContact O-CD2 3.41Å
119	P	96.8	Very high	95	Very high	46 Å²	46	48 Å²	48	30%	0.299	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	140.4	178.2	32.1	-35.8	0	0	0	112	V111 L170	V111-P119 WeakPolarHBondContact O-CA 3.46Å; P119-L170 HydrophobicContact CB-CD2 3.89Å
120	Y	97.6	Very high	94.4	Very high	44 Å²	44	56.5 Å²	56.5	17%	0.173	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	167.4	180	-66.2	-76.4	0	0	0	111.4	Y94 V111 H113 Q118 I155 V167 M168	Y94-Y120 AromaticContact CE1-CD2 3.77Å; Y94-Y120 HydrophobicContact CE1-CD2 3.77Å; Y94-Y120 HydrophobicContact CE1-CE2 4.29Å; V111-Y120 PolarHBondContact N-O 3.46Å; V111-Y120 PolarHBondContact O-N 2.84Å; H113-Y120 HydrophobicContact CB-CD2 4.19Å; H113-Y120 HydrophobicContact CB-CE2 3.88Å; Q118-Y120 HydrophobicContact CB-CD2 4.46Å; Q118-Y120 HydrophobicContact CB-CE2 3.7Å; Q118-Y120 HydrophobicContact CG-CD2 4.32Å; Q118-Y120 HydrophobicContact CG-CE1 4.13Å; Q118-Y120 HydrophobicContact CG-CE2 3.58Å; Q118-Y120 VanDerWaalsContact CG-CZ 3.48Å; Q118-Y120 WeakPolarHBondContact CG-OH 3.46Å; Q118-Y120 VanDerWaalsContact O-CD2 3.27Å; Q118-Y120 WeakPolarHBondContact O-CD2 3.41Å; Y120-I155 HydrophobicContact CD1-CG1 3.89Å; Y120-I155 HydrophobicContact CE1-CB 4.49Å; Y120-I155 HydrophobicContact CE1-CD1 4.02Å; Y120-I155 HydrophobicContact CE1-CG1 3.71Å; Y120-I155 HydrophobicContact CE1-CG2 4.18Å; Y120-V167 HydrophobicContact CD1-CG1 4.36Å; Y120-V167 HydrophobicContact CG-CG1 4.07Å; Y120-M168 WeakPolarHBondContact CB-O 3.48Å; Y120-M168 WeakPolarHBondContact CD1-O 3.34Å
121	A	97.1	Very high	93.7	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.008	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	145	163.7	0	0	0	0	0	110	M1 I100 V108 V109 V167 M168 L170	M1-A121 HydrophobicContact CE-CB 3.7Å; I100-A121 HydrophobicContact CD1-CB 4.35Å; V108-A121 HydrophobicContact CG1-CB 4.11Å; V109-A121 CarbonylContact O-C 3.59Å; V109-A121 WeakPolarHBondContact O-CA 3.43Å; A121-V167 CarbonylContact O-C 3.4Å; A121-V167 WeakPolarHBondContact O-CA 3.47Å; A121-M168 PolarHBondContact N-O 3Å; A121-M168 PolarHBondContact O-N 3.4Å; A121-L170 HydrophobicContact CB-CD1 3.93Å
122	I	96.9	Very high	93	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	115.8	162.8	-59	-171.8	0	0	0	109.1	V90 Y94 V108 V109 V111 Y165 M166 V167	V90-I122 HydrophobicContact CG1-CD1 3.59Å; Y94-I122 HydrophobicContact CD2-CD1 4.33Å; Y94-I122 HydrophobicContact CG-CD1 4.35Å; V108-I122 WeakPolarHBondContact CA-O 3.45Å; V109-I122 HydrophobicContact CG2-CB 3.92Å; V109-I122 PolarHBondContact N-O 3.39Å; V109-I122 PolarHBondContact O-N 3.35Å; V111-I122 HydrophobicContact CB-CD1 4.43Å; V111-I122 HydrophobicContact CB-CG1 4.41Å; V111-I122 HydrophobicContact CG1-CB 4.32Å; V111-I122 HydrophobicContact CG1-CD1 3.77Å; V111-I122 HydrophobicContact CG1-CG1 3.74Å; V111-I122 HydrophobicContact CG2-CD1 4Å; V111-I122 HydrophobicContact CG2-CG1 3.76Å; I122-Y165 HydrophobicContact CG2-CD1 4.32Å; I122-M166 CarbonylContact C-O 3.6Å; I122-M166 VanDerWaalsContact CA-O 3.27Å; I122-M166 WeakPolarHBondContact CA-O 3.48Å; I122-V167 HydrophobicContact CD1-CG2 4.08Å; I122-V167 HydrophobicContact CG1-CG1 4.48Å; I122-V167 HydrophobicContact CG1-CG2 4.08Å
123	K	94.9	Very high	92.4	Very high	12 Å²	12	60.3 Å²	60.3	5%	0.052	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	103.7	167.6	-167.1	-179.3	-158	-171.4	0	108	V108 I125 E139 M166 M168 D235	V108-K123 HydrophobicContact CG2-CG 4.24Å; K123-I125 HydrophobicContact CD-CD1 4.41Å; K123-I125 HydrophobicContact CG-CG1 4.33Å; K123-E139 WeakPolarHBondContact CE-OE2 3.39Å; K123-E139 IonicContact NZ-OE1 2.68Å; K123-E139 PolarHBondContact NZ-OE1 2.86Å; K123-E139 IonicContact NZ-OE2 2.8Å; K123-E139 PolarHBondContact NZ-OE2 2.91Å; K123-M166 HydrophobicContact CB-CB 4.36Å; K123-M166 PolarHBondContact N-O 2.78Å; K123-M166 PolarHBondContact O-N 2.79Å; K123-M168 HydrophobicContact CB-SD 4.03Å; K123-M168 HydrophobicContact CD-SD 4.48Å; K123-D235 IonicContact NZ-OD1 3.96Å; K123-D235 PolarHBondContact NZ-OD1 2.86Å
124	M	93.8	Very high	91.7	Very high	7 Å²	7	62.6 Å²	62.6	3%	0.034	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133	171.2	-170.8	-166.3	-46.6	0	0	108.9	F86 S106 R107 V164 Y165	F86-M124 HydrophobicContact CD1-CE 3.83Å; F86-M124 HydrophobicContact CE1-CE 3.32Å; F86-M124 HydrophobicContact CE2-CE 4.16Å; F86-M124 HydrophobicContact CG-CE 4.43Å; F86-M124 HydrophobicContact CZ-CE 3.49Å; F86-M124 VanDerWaalsContact CZ-CE 3.49Å; S106-M124 CarbonylContact C-O 3.59Å; S106-M124 WeakPolarHBondContact CA-O 3.46Å; R107-M124 PolarHBondContact N-O 3.07Å; R107-M124 PolarHBondContact O-N 3.16Å; M124-V164 CarbonylContact C-O 3.58Å; M124-V164 VanDerWaalsContact CA-O 3.31Å; M124-V164 WeakPolarHBondContact CA-O 3.42Å; M124-Y165 HydrophobicContact CB-CD1 4.27Å; M124-Y165 HydrophobicContact CE-CD1 4.2Å; M124-Y165 HydrophobicContact CE-CE1 3.74Å; M124-Y165 HydrophobicContact CG-CD1 3.87Å; M124-Y165 HydrophobicContact CG-CE1 3.83Å; M124-Y165 HydrophobicContact SD-CE1 3.98Å
125	I	91.7	Very high	90.9	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.8	174.6	-51.9	-172.3	0	0	0	109.3	F105 K123 G132 C136 R163 V164 M166	F105-I125 WeakPolarHBondContact O-CA 3.33Å; K123-I125 HydrophobicContact CD-CD1 4.41Å; K123-I125 HydrophobicContact CG-CG1 4.33Å; I125-G132 WeakPolarHBondContact CG2-O 3.43Å; I125-C136 HydrophobicContact CD1-CB 4.17Å; I125-C136 HydrophobicContact CG2-CB 4.24Å; I125-R163 VanDerWaalsContact O-CA 3.27Å; I125-R163 WeakPolarHBondContact O-CA 3.39Å; I125-V164 PolarHBondContact N-O 2.92Å; I125-V164 PolarHBondContact O-N 2.9Å; I125-M166 HydrophobicContact CD1-CE 3.64Å; I125-M166 HydrophobicContact CG1-CE 4.39Å
126	E	90.8	Very high	90.5	Very high	42 Å²	42	57.5 Å²	57.5	20%	0.196	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	106.1	175.1	-63.2	-173.1	-175.2	0	0	110.7	F105 K128 D162	F105-E126 PolarHBondContact O-N 3.5Å; E126-K128 HydrophobicContact CB-CG 4.31Å; E126-K128 WeakPolarHBondContact OE2-CE 3.47Å; E126-K128 IonicContact OE2-NZ 2.73Å; E126-K128 PolarHBondContact OE2-NZ 3.35Å; E126-D162 CarbonylContact C-O 3.53Å; E126-D162 WeakPolarHBondContact CA-O 3.48Å
127	T	90.5	Very high	90	Very high	11 Å²	11	58.9 Å²	58.9	7%	0.067	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-0.2	-173.5	53.7	0	0	0	0	114.6	Y129 R133 C136 D162 R163 V164	T127-Y129 PolarHBondContact O-N 3.46Å; T127-R133 PolarHBondContact O-NE 3.39Å; T127-R133 PolarHBondContact O-NH2 2.89Å; T127-C136 HydrophobicContact CG2-CB 3.96Å; T127-D162 PolarHBondContact N-O 3.41Å; T127-D162 PolarHBondContact OG1-O 2.94Å; T127-R163 PolarHBondContact OG1-N 2.95Å; T127-V164 HydrophobicContact CG2-CB 4.41Å; T127-V164 HydrophobicContact CG2-CG2 3.97Å
128	K	87.9	Confident	89.4	Confident	91 Å²	91	54.6 Å²	54.6	40%	0.396	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-28	164.6	49.9	157.4	173.1	164.1	0	113.6	E126 D162	E126-K128 HydrophobicContact CB-CG 4.31Å; E126-K128 WeakPolarHBondContact OE2-CE 3.47Å; E126-K128 IonicContact OE2-NZ 2.73Å; E126-K128 PolarHBondContact OE2-NZ 3.35Å; K128-D162 HydrophobicContact CB-CB 4.21Å; K128-D162 HydrophobicContact CG-CB 4.48Å
129	Y	86.5	Confident	89.1	Confident	108 Å²	108	50.9 Å²	50.9	42%	0.424	23%	0.23	S	C	.	.	S	Bend	trans	-94.8	141.8	173.5	-57.1	-59.5	0	0	0	109.8	F105 T127 E131 G132 R133	F105-Y129 AromaticContact CD1-CD2 3.85Å; F105-Y129 HydrophobicContact CD1-CD2 3.85Å; F105-Y129 HydrophobicContact CE1-CD2 4.06Å; F105-Y129 HydrophobicContact CE1-CG 4.39Å; T127-Y129 PolarHBondContact O-N 3.46Å; Y129-E131 VanDerWaalsContact C-N 3.33Å; Y129-E131 PolarHBondContact O-N 3.5Å; Y129-G132 PolarHBondContact O-N 2.91Å; Y129-R133 PolarHBondContact O-N 3.4Å
130	R	84.1	Confident	88.8	Confident	180 Å²	180	49.1 Å²	49.1	68%	0.679	22%	0.218	S	C	*	.	H	α-helix	trans	-59.9	-44.7	-176.3	178.3	177.9	168.2	-172.1	-10.2	111.5	G132 R133 E134	R130-G132 VanDerWaalsContact C-N 3.33Å; R130-G132 PolarHBondContact O-N 3.18Å; R130-R133 WeakPolarHBondContact O-CB 3.39Å; R130-R133 PolarHBondContact O-N 3.4Å; R130-R133 VanDerWaalsContact O-N 3.13Å; R130-E134 HydrophobicContact CG-CG 4.41Å; R130-E134 IonicContact CZ-OE1 3.89Å; R130-E134 IonicContact NE-OE1 3.55Å; R130-E134 PolarHBondContact NE-OE1 3.36Å; R130-E134 IonicContact NH2-OE1 2.87Å; R130-E134 PolarHBondContact NH2-OE1 3.18Å; R130-E134 WeakPolarHBondContact O-CG 3.5Å; R130-E134 PolarHBondContact O-N 3.02Å
131	E	80.9	Confident	88.5	Confident	105 Å²	105	49.7 Å²	49.7	49%	0.491	23%	0.228	S	C	.	.	H	α-helix	trans	-65	-37.9	180	-53.1	91.6	146.7	0	0	111.5	F105 Y129 R133 V135	F105-E131 HydrophobicContact CD2-CB 4.37Å; F105-E131 HydrophobicContact CE2-CB 3.69Å; F105-E131 HydrophobicContact CZ-CB 4.03Å; Y129-E131 VanDerWaalsContact C-N 3.33Å; Y129-E131 PolarHBondContact O-N 3.5Å; E131-R133 VanDerWaalsContact C-N 3.33Å; E131-V135 WeakPolarHBondContact O-CB 3.23Å; E131-V135 VanDerWaalsContact O-CG2 3.26Å; E131-V135 WeakPolarHBondContact O-CG2 3.33Å; E131-V135 PolarHBondContact O-N 3.18Å; E131-V135 VanDerWaalsContact O-N 3.13Å
132	G	81.5	Confident	88.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.2	-35.5	173.6	0	0	0	0	0	112.4	I125 Y129 R130 C136	I125-G132 WeakPolarHBondContact CG2-O 3.43Å; Y129-G132 PolarHBondContact O-N 2.91Å; R130-G132 VanDerWaalsContact C-N 3.33Å; R130-G132 PolarHBondContact O-N 3.18Å; G132-C136 WeakPolarHBondContact O-CB 3.5Å; G132-C136 PolarHBondContact O-N 2.8Å; G132-C136 VanDerWaalsContact O-N 3.11Å
133	R	85.7	Confident	88	Confident	123 Å²	123	49.7 Å²	49.7	46%	0.464	23%	0.228	S	C	.	.	H	α-helix	trans	-70.4	-50.5	175.2	-167.8	-177.1	-54.7	175.9	2.9	112.4	T127 Y129 R130 E131 V135 C136 E137	T127-R133 PolarHBondContact O-NE 3.39Å; T127-R133 PolarHBondContact O-NH2 2.89Å; Y129-R133 PolarHBondContact O-N 3.4Å; R130-R133 WeakPolarHBondContact O-CB 3.39Å; R130-R133 PolarHBondContact O-N 3.4Å; R130-R133 VanDerWaalsContact O-N 3.13Å; E131-R133 VanDerWaalsContact C-N 3.33Å; R133-V135 VanDerWaalsContact C-N 3.31Å; R133-V135 PolarHBondContact O-N 3.02Å; R133-C136 WeakPolarHBondContact O-CA 3.25Å; R133-C136 WeakPolarHBondContact O-CB 3.28Å; R133-C136 PolarHBondContact O-N 2.65Å; R133-E137 WeakPolarHBondContact CD-OE1 3.26Å; R133-E137 HydrophobicContact CG-CG 4.35Å; R133-E137 VanDerWaalsContact CG-OE1 3.24Å; R133-E137 WeakPolarHBondContact CG-OE1 3.34Å; R133-E137 WeakPolarHBondContact O-CG 3.32Å; R133-E137 PolarHBondContact O-N 2.85Å
134	E	84.3	Confident	88	Confident	90 Å²	90	56.3 Å²	56.3	42%	0.421	25%	0.253	S	S	.	.	H	α-helix	trans	-59.2	-40.8	179.2	-72.1	175.5	171.3	0	0	112	R130 S138	R130-E134 HydrophobicContact CG-CG 4.41Å; R130-E134 IonicContact CZ-OE1 3.89Å; R130-E134 IonicContact NE-OE1 3.55Å; R130-E134 PolarHBondContact NE-OE1 3.36Å; R130-E134 IonicContact NH2-OE1 2.87Å; R130-E134 PolarHBondContact NH2-OE1 3.18Å; R130-E134 WeakPolarHBondContact O-CG 3.5Å; R130-E134 PolarHBondContact O-N 3.02Å; E134-S138 VanDerWaalsContact O-CB 3.32Å; E134-S138 WeakPolarHBondContact O-CB 3.33Å; E134-S138 PolarHBondContact O-N 3.2Å
135	V	80.9	Confident	87.9	Confident	53 Å²	53	61.6 Å²	61.6	32%	0.321	27%	0.272	S	S	.	.	H	α-helix	trans	-64.4	-42.9	172.9	168.4	0	0	0	0	111.6	E131 R133 E139	E131-V135 WeakPolarHBondContact O-CB 3.23Å; E131-V135 VanDerWaalsContact O-CG2 3.26Å; E131-V135 WeakPolarHBondContact O-CG2 3.33Å; E131-V135 PolarHBondContact O-N 3.18Å; E131-V135 VanDerWaalsContact O-N 3.13Å; R133-V135 VanDerWaalsContact C-N 3.31Å; R133-V135 PolarHBondContact O-N 3.02Å; V135-E139 VanDerWaalsContact O-CB 3.31Å; V135-E139 WeakPolarHBondContact O-CB 3.31Å; V135-E139 PolarHBondContact O-N 3.28Å
136	C	87.6	Confident	88.1	Confident	4 Å²	4	61.6 Å²	61.6	3%	0.027	27%	0.272	C	S	.	.	H	α-helix	trans	-66.1	-44.9	179.9	-175.2	0	0	0	0	112.6	I125 T127 G132 R133 E139 L140 V164 M166	I125-C136 HydrophobicContact CD1-CB 4.17Å; I125-C136 HydrophobicContact CG2-CB 4.24Å; T127-C136 HydrophobicContact CG2-CB 3.96Å; G132-C136 WeakPolarHBondContact O-CB 3.5Å; G132-C136 PolarHBondContact O-N 2.8Å; G132-C136 VanDerWaalsContact O-N 3.11Å; R133-C136 WeakPolarHBondContact O-CA 3.25Å; R133-C136 WeakPolarHBondContact O-CB 3.28Å; R133-C136 PolarHBondContact O-N 2.65Å; C136-E139 PolarHBondContact O-N 3.21Å; C136-L140 WeakPolarHBondContact O-CB 3.4Å; C136-L140 WeakPolarHBondContact O-CG 3.29Å; C136-L140 PolarHBondContact O-N 2.86Å; C136-V164 VanDerWaalsContact SG-CB 3.52Å; C136-M166 HydrophobicContact CB-CE 4.36Å; C136-M166 WeakPolarHBondContact SG-CE 3.45Å
137	E	87.3	Confident	88.3	Confident	121 Å²	121	69 Å²	69	57%	0.565	30%	0.298	S	S	*	.	H	α-helix	trans	-63	-45.6	177	-73.1	174.7	-166.7	0	0	111.2	R133 S141	R133-E137 WeakPolarHBondContact CD-OE1 3.26Å; R133-E137 HydrophobicContact CG-CG 4.35Å; R133-E137 VanDerWaalsContact CG-OE1 3.24Å; R133-E137 WeakPolarHBondContact CG-OE1 3.34Å; R133-E137 WeakPolarHBondContact O-CG 3.32Å; R133-E137 PolarHBondContact O-N 2.85Å; E137-S141 VanDerWaalsContact O-CB 3.29Å; E137-S141 WeakPolarHBondContact O-CB 3.26Å; E137-S141 PolarHBondContact O-N 3.29Å
138	S	83.6	Confident	88.6	Confident	28 Å²	28	70.8 Å²	70.8	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-51.9	175.7	-173.4	0	0	0	0	111.6	E134 L140 S141 V142 A239	E134-S138 VanDerWaalsContact O-CB 3.32Å; E134-S138 WeakPolarHBondContact O-CB 3.33Å; E134-S138 PolarHBondContact O-N 3.2Å; S138-L140 PolarHBondContact O-N 2.85Å; S138-S141 PolarHBondContact O-N 3.31Å; S138-S141 PolarHBondContact O-OG 2.8Å; S138-V142 PolarHBondContact O-N 3.42Å; S138-A239 PolarHBondContact OG-O 3.2Å
139	E	89.7	Confident	89	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-43.4	-178.6	-179.2	159.2	-142.1	0	0	112.3	K123 V135 C136 S141 V142 L143 M166 F236	K123-E139 WeakPolarHBondContact CE-OE2 3.39Å; K123-E139 IonicContact NZ-OE1 2.68Å; K123-E139 PolarHBondContact NZ-OE1 2.86Å; K123-E139 IonicContact NZ-OE2 2.8Å; K123-E139 PolarHBondContact NZ-OE2 2.91Å; V135-E139 VanDerWaalsContact O-CB 3.31Å; V135-E139 WeakPolarHBondContact O-CB 3.31Å; V135-E139 PolarHBondContact O-N 3.28Å; C136-E139 PolarHBondContact O-N 3.21Å; E139-S141 PolarHBondContact O-N 2.88Å; E139-V142 PolarHBondContact O-N 2.68Å; E139-L143 HydrophobicContact CG-CD1 3.55Å; E139-L143 HydrophobicContact CG-CG 4.09Å; E139-L143 VanDerWaalsContact O-CB 3.25Å; E139-L143 WeakPolarHBondContact O-CB 3.45Å; E139-L143 WeakPolarHBondContact O-CG 3.41Å; E139-L143 PolarHBondContact O-N 2.99Å; E139-M166 HydrophobicContact CB-CE 4.44Å; E139-M166 HydrophobicContact CG-CE 4.35Å; E139-M166 HydrophobicContact CG-SD 4.07Å; E139-F236 HydrophobicContact CG-CB 4.25Å
140	L	91.7	Very high	89.6	Confident	9 Å²	9	65.6 Å²	65.6	5%	0.047	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-37	174.2	-75.9	179	0	0	0	113.1	C136 S138 V142 L143 R144 L154 V157 V164 M166	C136-L140 WeakPolarHBondContact O-CB 3.4Å; C136-L140 WeakPolarHBondContact O-CG 3.29Å; C136-L140 PolarHBondContact O-N 2.86Å; S138-L140 PolarHBondContact O-N 2.85Å; L140-V142 PolarHBondContact O-N 3.07Å; L140-L143 PolarHBondContact O-N 2.89Å; L140-R144 VanDerWaalsContact O-CB 3.31Å; L140-R144 WeakPolarHBondContact O-CB 3.31Å; L140-R144 VanDerWaalsContact O-CG 3.29Å; L140-R144 WeakPolarHBondContact O-CG 3.45Å; L140-R144 PolarHBondContact O-N 2.77Å; L140-L154 HydrophobicContact CD2-CD2 4.16Å; L140-V157 HydrophobicContact CD2-CG1 4.38Å; L140-V157 HydrophobicContact CD2-CG2 3.72Å; L140-V164 HydrophobicContact CD1-CG1 4.23Å; L140-M166 HydrophobicContact CD1-CE 4.47Å; L140-M166 HydrophobicContact CD2-CE 4Å; L140-M166 HydrophobicContact CD2-CG 4.03Å; L140-M166 HydrophobicContact CD2-SD 3.86Å; L140-M166 HydrophobicContact CG-CE 3.77Å; L140-M166 HydrophobicContact CG-SD 4.26Å
141	S	90.2	Very high	90.2	Very high	55 Å²	55	57.1 Å²	57.1	39%	0.385	26%	0.261	S	S	.	.	H	α-helix	trans	-61.6	-32.2	180	79.4	0	0	0	0	112.3	E137 S138 E139 R145	E137-S141 VanDerWaalsContact O-CB 3.29Å; E137-S141 WeakPolarHBondContact O-CB 3.26Å; E137-S141 PolarHBondContact O-N 3.29Å; S138-S141 PolarHBondContact O-N 3.31Å; S138-S141 PolarHBondContact O-OG 2.8Å; E139-S141 PolarHBondContact O-N 2.88Å; S141-R145 VanDerWaalsContact O-CD 3.27Å; S141-R145 WeakPolarHBondContact O-CD 2.82Å; S141-R145 WeakPolarHBondContact O-CG 3.39Å
142	V	91.3	Very high	90.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-85.2	-52.8	174.5	172.8	0	0	0	0	111	S138 E139 L140 R144 R145 V146 L205 I210 F236 A239	S138-V142 PolarHBondContact O-N 3.42Å; E139-V142 PolarHBondContact O-N 2.68Å; L140-V142 PolarHBondContact O-N 3.07Å; V142-R144 VanDerWaalsContact C-N 3.26Å; V142-R144 PolarHBondContact O-N 2.91Å; V142-R145 WeakPolarHBondContact O-CA 3.34Å; V142-R145 PolarHBondContact O-N 2.91Å; V142-V146 HydrophobicContact CG1-CG1 3.92Å; V142-V146 PolarHBondContact O-N 3.03Å; V142-L205 HydrophobicContact CG1-CD2 4.42Å; V142-I210 HydrophobicContact CG1-CD1 4.12Å; V142-I210 HydrophobicContact CG1-CG2 3.98Å; V142-I210 HydrophobicContact CG2-CD1 4.38Å; V142-I210 HydrophobicContact CG2-CG2 3.72Å; V142-F236 HydrophobicContact CB-CB 4.36Å; V142-F236 HydrophobicContact CB-CD1 4.42Å; V142-F236 HydrophobicContact CB-CG 4.45Å; V142-F236 HydrophobicContact CG1-CB 4.26Å; V142-F236 HydrophobicContact CG1-CD1 3.52Å; V142-F236 HydrophobicContact CG1-CD2 4.46Å; V142-F236 HydrophobicContact CG1-CE1 3.89Å; V142-F236 HydrophobicContact CG1-CG 3.83Å; V142-A239 HydrophobicContact CG2-CB 3.88Å
143	L	93.8	Very high	91.6	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-61	-29	-174	-77.7	-177.2	0	0	0	114.1	E139 L140 R145 V146 I152 L154 M166 M168 F236	E139-L143 HydrophobicContact CG-CD1 3.55Å; E139-L143 HydrophobicContact CG-CG 4.09Å; E139-L143 VanDerWaalsContact O-CB 3.25Å; E139-L143 WeakPolarHBondContact O-CB 3.45Å; E139-L143 WeakPolarHBondContact O-CG 3.41Å; E139-L143 PolarHBondContact O-N 2.99Å; L140-L143 PolarHBondContact O-N 2.89Å; L143-R145 VanDerWaalsContact C-N 3.29Å; L143-V146 HydrophobicContact CD2-CG2 4.38Å; L143-I152 HydrophobicContact CD2-CG2 4.29Å; L143-L154 HydrophobicContact CB-CB 3.93Å; L143-L154 HydrophobicContact CB-CD2 3.9Å; L143-L154 HydrophobicContact CB-CG 4.42Å; L143-L154 HydrophobicContact CD1-CB 4.48Å; L143-L154 HydrophobicContact CD1-CD1 4.46Å; L143-M166 HydrophobicContact CD1-SD 4.12Å; L143-M168 HydrophobicContact CD1-CE 3.65Å; L143-M168 HydrophobicContact CD1-SD 4.31Å; L143-M168 HydrophobicContact CD2-CE 4.2Å; L143-F236 HydrophobicContact CD2-CD2 3.63Å; L143-F236 HydrophobicContact CD2-CE2 3.94Å; L143-F236 HydrophobicContact CG-CD2 4.22Å
144	R	94.1	Very high	92.1	Very high	152 Å²	152	49.3 Å²	49.3	57%	0.574	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-18.3	173.3	-71.3	172.8	170.7	159.8	-2.7	113.6	L140 V142 L154	L140-R144 VanDerWaalsContact O-CB 3.31Å; L140-R144 WeakPolarHBondContact O-CB 3.31Å; L140-R144 VanDerWaalsContact O-CG 3.29Å; L140-R144 WeakPolarHBondContact O-CG 3.45Å; L140-R144 PolarHBondContact O-N 2.77Å; V142-R144 VanDerWaalsContact C-N 3.26Å; V142-R144 PolarHBondContact O-N 2.91Å; R144-L154 HydrophobicContact CG-CD2 3.92Å
145	R	92.8	Very high	92.7	Very high	118 Å²	118	48.5 Å²	48.5	45%	0.445	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-19	-175.2	-71.6	176.6	55.6	-167	-9.7	114.4	S141 V142 L143 L208	S141-R145 VanDerWaalsContact O-CD 3.27Å; S141-R145 WeakPolarHBondContact O-CD 2.82Å; S141-R145 WeakPolarHBondContact O-CG 3.39Å; V142-R145 WeakPolarHBondContact O-CA 3.34Å; V142-R145 PolarHBondContact O-N 2.91Å; L143-R145 VanDerWaalsContact C-N 3.29Å; R145-L208 PolarHBondContact NH2-O 3.38Å
146	V	94.4	Very high	93.5	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	22%	0.224	C	C	.	.			trans	-97.8	137.6	-175	-61.8	0	0	0	0	112.4	V142 L143 I151 Q153 Y204 L205 L208 I210	V142-V146 HydrophobicContact CG1-CG1 3.92Å; V142-V146 PolarHBondContact O-N 3.03Å; L143-V146 HydrophobicContact CD2-CG2 4.38Å; V146-I151 HydrophobicContact CB-CG2 4.27Å; V146-I151 HydrophobicContact CG2-CG2 3.78Å; V146-Q153 PolarHBondContact O-NE2 3Å; V146-Q153 PolarHBondContact O-OE1 3Å; V146-Y204 HydrophobicContact CB-CE1 3.95Å; V146-Y204 HydrophobicContact CG1-CE1 4.08Å; V146-L205 HydrophobicContact CG1-CD2 3.83Å; V146-L208 HydrophobicContact CG1-CD1 4.12Å; V146-I210 HydrophobicContact CG1-CD1 3.99Å
147	R	95.4	Very high	93.9	Very high	198 Å²	198	50 Å²	50	75%	0.747	23%	0.234	S	C	*	.			trans	-146.3	98.8	170.4	-63.2	-174	179.7	170.4	0.3	108.8	Y204	R147-Y204 PolarHBondContact N-OH 3.05Å; R147-Y204 PolarHBondContact O-OH 2.94Å
148	H	97.4	Very high	94.4	Very high	48 Å²	48	45 Å²	45	22%	0.222	21%	0.21	C	C	.	.			trans	-152.7	143.4	-178.5	-173.8	-99.8	0	0	0	110.1	N150 I151 Y204	H148-N150 VanDerWaalsContact C-N 3.26Å; H148-N150 PolarHBondContact CE1-OD1 3.05Å; H148-N150 PolarHBondContact ND1-N 2.89Å; H148-N150 PolarHBondContact O-N 3.32Å; H148-I151 HydrophobicContact CB-CB 4.21Å; H148-I151 HydrophobicContact CB-CD1 3.87Å; H148-I151 HydrophobicContact CB-CG1 4.06Å; H148-I151 PolarHBondContact O-N 2.64Å; H148-I151 VanDerWaalsContact O-O 3.1Å; H148-Y204 HydrophobicContact CB-CD1 3.75Å; H148-Y204 HydrophobicContact CB-CD2 4.21Å; H148-Y204 HydrophobicContact CB-CE1 3.93Å; H148-Y204 HydrophobicContact CB-CE2 4.38Å; H148-Y204 HydrophobicContact CB-CG 3.89Å; H148-Y204 AromaticContact CD2-CD2 3.9Å; H148-Y204 AromaticContact CD2-CG 3.9Å; H148-Y204 AromaticContact CG-CG 3.95Å
149	T	96.4	Very high	94.9	Very high	82 Å²	82	49 Å²	49	50%	0.503	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-36.9	-173.3	-169.6	0	0	0	0	113	I151 K230	T149-I151 VanDerWaalsContact C-N 3.32Å; T149-I151 PolarHBondContact O-N 3.42Å; T149-K230 WeakPolarHBondContact O-CD 3.41Å; T149-K230 PolarHBondContact O-NZ 3.01Å
150	N	97.6	Very high	95	Very high	9 Å²	9	51 Å²	51	5%	0.048	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	20.8	178.2	-51.7	106.4	0	0	0	114.7	H148 M197 I231 M232 I233	H148-N150 VanDerWaalsContact C-N 3.26Å; H148-N150 PolarHBondContact CE1-OD1 3.05Å; H148-N150 PolarHBondContact ND1-N 2.89Å; H148-N150 PolarHBondContact O-N 3.32Å; N150-M197 WeakPolarHBondContact CB-O 3.39Å; N150-M197 WeakPolarHBondContact ND2-CB 3.2Å; N150-M197 PolarHBondContact OD1-O 3.27Å; N150-I231 WeakPolarHBondContact CA-O 3.43Å; N150-I231 WeakPolarHBondContact CB-O 3.44Å; N150-I231 PolarHBondContact ND2-O 3.24Å; N150-M232 WeakPolarHBondContact O-CA 3.44Å; N150-I233 PolarHBondContact O-N 2.8Å
151	I	97.3	Very high	94.9	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-128.1	138.2	174.3	-64.8	177.5	0	0	0	108.1	V146 H148 T149 Q153 Y204 L205 F236	V146-I151 HydrophobicContact CB-CG2 4.27Å; V146-I151 HydrophobicContact CG2-CG2 3.78Å; H148-I151 HydrophobicContact CB-CB 4.21Å; H148-I151 HydrophobicContact CB-CD1 3.87Å; H148-I151 HydrophobicContact CB-CG1 4.06Å; H148-I151 PolarHBondContact O-N 2.64Å; H148-I151 VanDerWaalsContact O-O 3.1Å; T149-I151 VanDerWaalsContact C-N 3.32Å; T149-I151 PolarHBondContact O-N 3.42Å; I151-Q153 PolarHBondContact O-N 3.05Å; I151-Y204 HydrophobicContact CD1-CD1 3.55Å; I151-Y204 HydrophobicContact CD1-CE1 4.09Å; I151-L205 HydrophobicContact CD1-CD1 4.24Å; I151-L205 HydrophobicContact CD1-CD2 3.88Å; I151-L205 HydrophobicContact CD1-CG 3.73Å; I151-F236 HydrophobicContact CG2-CE2 3.75Å; I151-F236 HydrophobicContact CG2-CZ 3.62Å
152	I	96.1	Very high	94.9	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-64.4	119.5	178.7	-163.6	77.6	0	0	0	111.4	L143 M168 E169 M232 I233 T234 F236	L143-I152 HydrophobicContact CD2-CG2 4.29Å; I152-M168 HydrophobicContact CB-CE 4.39Å; I152-M168 HydrophobicContact CG1-CB 4.46Å; I152-M168 HydrophobicContact CG1-CE 3.96Å; I152-M168 HydrophobicContact CG2-CE 3.55Å; I152-E169 HydrophobicContact CD1-CB 3.54Å; I152-E169 HydrophobicContact CG1-CB 4.16Å; I152-M232 HydrophobicContact CD1-CE 3.47Å; I152-M232 VanDerWaalsContact CD1-CE 3.47Å; I152-M232 HydrophobicContact CD1-SD 3.94Å; I152-I233 WeakPolarHBondContact CG2-O 3.17Å; I152-I233 PolarHBondContact N-O 3.27Å; I152-I233 VanDerWaalsContact N-O 3.09Å; I152-T234 HydrophobicContact CB-CG2 4.02Å; I152-T234 HydrophobicContact CD1-CG2 4.49Å; I152-T234 HydrophobicContact CG1-CG2 4.49Å; I152-T234 HydrophobicContact CG2-CG2 4.15Å; I152-F236 HydrophobicContact CG2-CE2 4.22Å
153	Q	95.9	Very high	95	Very high	45 Å²	45	63.9 Å²	63.9	21%	0.21	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-79.4	131	-177.5	-170.9	57.2	66.9	0	0	111.7	V146 I151 I155 M168 E169	V146-Q153 PolarHBondContact O-NE2 3Å; V146-Q153 PolarHBondContact O-OE1 3Å; I151-Q153 PolarHBondContact O-N 3.05Å; Q153-I155 HydrophobicContact CB-CD1 4.42Å; Q153-I155 HydrophobicContact CG-CD1 4.13Å; Q153-M168 CarbonylContact O-C 3.54Å; Q153-M168 VanDerWaalsContact O-CA 3.29Å; Q153-M168 WeakPolarHBondContact O-CA 3.36Å; Q153-E169 HydrophobicContact CB-CG 4.07Å; Q153-E169 WeakPolarHBondContact CB-OE2 3.39Å; Q153-E169 PolarHBondContact N-OE2 3.2Å; Q153-E169 PolarHBondContact O-N 2.98Å
154	L	97	Very high	95	Very high	19 Å²	19	63.9 Å²	63.9	10%	0.099	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	131.2	163.4	179.3	73.7	0	0	0	109.6	L140 L143 R144 V157 M166 V167 M168	L140-L154 HydrophobicContact CD2-CD2 4.16Å; L143-L154 HydrophobicContact CB-CB 3.93Å; L143-L154 HydrophobicContact CB-CD2 3.9Å; L143-L154 HydrophobicContact CB-CG 4.42Å; L143-L154 HydrophobicContact CD1-CB 4.48Å; L143-L154 HydrophobicContact CD1-CD1 4.46Å; R144-L154 HydrophobicContact CG-CD2 3.92Å; L154-V157 HydrophobicContact CD1-CG2 3.97Å; L154-V157 HydrophobicContact CD2-CG2 3.88Å; L154-V157 HydrophobicContact CG-CG2 4.29Å; L154-M166 HydrophobicContact CD1-CB 3.79Å; L154-M166 HydrophobicContact CD1-CG 4.44Å; L154-V167 WeakPolarHBondContact CD1-O 3.41Å; L154-M168 HydrophobicContact CD1-CG 4.22Å
155	I	96.8	Very high	95.1	Very high	73 Å²	73	56.9 Å²	56.9	37%	0.374	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-57.3	-174	-50.1	-60.1	0	0	0	110.4	Y120 Q153 V167	Y120-I155 HydrophobicContact CD1-CG1 3.89Å; Y120-I155 HydrophobicContact CE1-CB 4.49Å; Y120-I155 HydrophobicContact CE1-CD1 4.02Å; Y120-I155 HydrophobicContact CE1-CG1 3.71Å; Y120-I155 HydrophobicContact CE1-CG2 4.18Å; Q153-I155 HydrophobicContact CB-CD1 4.42Å; Q153-I155 HydrophobicContact CG-CD1 4.13Å; I155-V167 HydrophobicContact CB-CB 4.29Å; I155-V167 HydrophobicContact CB-CG1 4.16Å; I155-V167 WeakPolarHBondContact CB-O 3.4Å; I155-V167 PolarHBondContact N-O 3.23Å
156	E	96.4	Very high	95.3	Very high	49 Å²	49	51.2 Å²	51.2	23%	0.229	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	170.7	172.1	70.2	171.1	140.7	0	0	111.8	K93 Y94 F158 V167	K93-E156 WeakPolarHBondContact CD-OE1 3.42Å; K93-E156 IonicContact NZ-OE1 3.31Å; K93-E156 PolarHBondContact NZ-OE1 3.09Å; K93-E156 IonicContact NZ-OE2 3.52Å; K93-E156 PolarHBondContact NZ-OE2 3.35Å; Y94-E156 WeakPolarHBondContact CE2-OE1 3.29Å; Y94-E156 PolarHBondContact OH-OE1 3.28Å; E156-F158 VanDerWaalsContact CD-CZ 3.46Å; E156-F158 HydrophobicContact CG-CE2 3.77Å; E156-F158 HydrophobicContact CG-CZ 4.25Å; E156-F158 WeakPolarHBondContact OE1-CZ 3.37Å; E156-F158 WeakPolarHBondContact OE2-CZ 3.48Å; E156-V167 HydrophobicContact CG-CB 3.96Å; E156-V167 HydrophobicContact CG-CG2 3.62Å; E156-V167 PolarHBondContact O-N 2.68Å
157	V	97.3	Very high	95.5	Very high	40 Å²	40	51.2 Å²	51.2	24%	0.242	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	132.8	-178.3	-177.4	0	0	0	0	109.5	L140 L154 V164 Y165	L140-V157 HydrophobicContact CD2-CG1 4.38Å; L140-V157 HydrophobicContact CD2-CG2 3.72Å; L154-V157 HydrophobicContact CD1-CG2 3.97Å; L154-V157 HydrophobicContact CD2-CG2 3.88Å; L154-V157 HydrophobicContact CG-CG2 4.29Å; V157-V164 HydrophobicContact CG1-CG1 3.78Å; V157-Y165 WeakPolarHBondContact CA-O 3.49Å
158	F	96.5	Very high	95.5	Very high	16 Å²	16	42.2 Å²	42.2	7%	0.07	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.4	165.5	-53	-102.4	0	0	0	109.2	R89 V90 K93 Y94 E156 Y165 V167	R89-F158 HydrophobicContact CB-CD1 3.76Å; R89-F158 HydrophobicContact CB-CE1 3.89Å; V90-F158 HydrophobicContact CG2-CB 3.78Å; V90-F158 HydrophobicContact CG2-CD1 4.02Å; V90-F158 HydrophobicContact CG2-CD2 3.61Å; V90-F158 HydrophobicContact CG2-CE1 4.49Å; V90-F158 HydrophobicContact CG2-CE2 4.13Å; V90-F158 HydrophobicContact CG2-CG 3.54Å; K93-F158 HydrophobicContact CD-CZ 4.08Å; Y94-F158 HydrophobicContact CD2-CE2 4.43Å; Y94-F158 HydrophobicContact CE2-CE2 4.03Å; Y94-F158 HydrophobicContact CE2-CZ 4.17Å; E156-F158 VanDerWaalsContact CD-CZ 3.46Å; E156-F158 HydrophobicContact CG-CE2 3.77Å; E156-F158 HydrophobicContact CG-CZ 4.25Å; E156-F158 WeakPolarHBondContact OE1-CZ 3.37Å; E156-F158 WeakPolarHBondContact OE2-CZ 3.48Å; F158-Y165 HydrophobicContact CB-CD2 4.31Å; F158-Y165 PolarHBondContact N-O 2.88Å; F158-Y165 PolarHBondContact O-N 3.43Å; F158-V167 HydrophobicContact CD2-CG2 4.22Å; F158-V167 HydrophobicContact CE2-CG2 3.8Å
159	E	94.4	Very high	95.5	Very high	112 Å²	112	41.5 Å²	41.5	52%	0.523	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.7	-173.6	-175.9	156.4	-163	0	0	110.7	R89 V164	R89-E159 PolarHBondContact NH1-O 3.36Å; R89-E159 PolarHBondContact NH2-O 3.11Å; E159-V164 HydrophobicContact CB-CG2 4.44Å; E159-V164 HydrophobicContact CG-CG2 3.97Å
160	T	91.6	Very high	95.5	Very high	43 Å²	43	38.1 Å²	38.1	26%	0.264	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	166.1	172	73.7	0	0	0	0	109.3	D87 D162 R163 Y165	D87-T160 HydrophobicContact CB-CG2 4.32Å; D87-T160 WeakPolarHBondContact OD2-CG2 3.24Å; T160-D162 PolarHBondContact O-N 3.43Å; T160-R163 PolarHBondContact N-O 2.94Å; T160-R163 PolarHBondContact O-N 3.22Å; T160-R163 PolarHBondContact OG1-N 3.31Å; T160-R163 PolarHBondContact OG1-O 2.97Å; T160-Y165 HydrophobicContact CG2-CE2 4.21Å
161	Q	89.3	Confident	95.3	Very high	179 Å²	179	38.3 Å²	38.3	84%	0.836	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.5	-40.1	179.5	-175	172.4	1	0	0	114.7
162	D	91	Very high	95.1	Very high	82 Å²	82	41.7 Å²	41.7	44%	0.439	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-3.7	-176.2	-61.6	-48	0	0	0	114.8	E126 T127 K128 T160	E126-D162 CarbonylContact C-O 3.53Å; E126-D162 WeakPolarHBondContact CA-O 3.48Å; T127-D162 PolarHBondContact N-O 3.41Å; T127-D162 PolarHBondContact OG1-O 2.94Å; K128-D162 HydrophobicContact CB-CB 4.21Å; K128-D162 HydrophobicContact CG-CB 4.48Å; T160-D162 PolarHBondContact O-N 3.43Å
163	R	92.4	Very high	94.9	Very high	73 Å²	73	42.2 Å²	42.2	28%	0.275	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	145.7	-173.3	-61.7	-175.6	-173.3	150.6	6.2	114.4	K85 I125 T127 T160 Y165	K85-R163 PolarHBondContact O-NH1 2.76Å; I125-R163 VanDerWaalsContact O-CA 3.27Å; I125-R163 WeakPolarHBondContact O-CA 3.39Å; T127-R163 PolarHBondContact OG1-N 2.95Å; T160-R163 PolarHBondContact N-O 2.94Å; T160-R163 PolarHBondContact O-N 3.22Å; T160-R163 PolarHBondContact OG1-N 3.31Å; T160-R163 PolarHBondContact OG1-O 2.97Å; R163-Y165 HydrophobicContact CB-CE2 3.87Å; R163-Y165 PolarHBondContact NH1-OH 3.49Å
164	V	95.1	Very high	94.6	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141.3	165	172.6	0	0	0	0	109.8	M124 I125 T127 C136 L140 V157 E159 M166	M124-V164 CarbonylContact C-O 3.58Å; M124-V164 VanDerWaalsContact CA-O 3.31Å; M124-V164 WeakPolarHBondContact CA-O 3.42Å; I125-V164 PolarHBondContact N-O 2.92Å; I125-V164 PolarHBondContact O-N 2.9Å; T127-V164 HydrophobicContact CG2-CB 4.41Å; T127-V164 HydrophobicContact CG2-CG2 3.97Å; C136-V164 VanDerWaalsContact SG-CB 3.52Å; L140-V164 HydrophobicContact CD1-CG1 4.23Å; V157-V164 HydrophobicContact CG1-CG1 3.78Å; E159-V164 HydrophobicContact CB-CG2 4.44Å; E159-V164 HydrophobicContact CG-CG2 3.97Å; V164-M166 HydrophobicContact CG1-CE 4.16Å; V164-M166 HydrophobicContact CG1-CG 3.98Å
165	Y	96.3	Very high	94.4	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.016	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	104.5	177	-53.7	-107.4	0	0	0	108.3	F86 D87 V90 I122 M124 V157 F158 T160 R163	F86-Y165 AromaticContact CD1-CD1 4Å; F86-Y165 HydrophobicContact CD1-CD1 4Å; F86-Y165 AromaticContact CD1-CE1 3.7Å; F86-Y165 HydrophobicContact CD1-CE1 3.7Å; F86-Y165 HydrophobicContact CE1-CD1 4.38Å; F86-Y165 HydrophobicContact CE1-CE1 4.31Å; F86-Y165 HydrophobicContact CG-CE1 4.41Å; D87-Y165 HydrophobicContact CB-CE2 3.94Å; D87-Y165 PolarHBondContact N-OH 3.2Å; V90-Y165 HydrophobicContact CG2-CD1 4.12Å; V90-Y165 HydrophobicContact CG2-CD2 4.34Å; V90-Y165 HydrophobicContact CG2-CG 3.98Å; I122-Y165 HydrophobicContact CG2-CD1 4.32Å; M124-Y165 HydrophobicContact CB-CD1 4.27Å; M124-Y165 HydrophobicContact CE-CD1 4.2Å; M124-Y165 HydrophobicContact CE-CE1 3.74Å; M124-Y165 HydrophobicContact CG-CD1 3.87Å; M124-Y165 HydrophobicContact CG-CE1 3.83Å; M124-Y165 HydrophobicContact SD-CE1 3.98Å; V157-Y165 WeakPolarHBondContact CA-O 3.49Å; F158-Y165 HydrophobicContact CB-CD2 4.31Å; F158-Y165 PolarHBondContact N-O 2.88Å; F158-Y165 PolarHBondContact O-N 3.43Å; T160-Y165 HydrophobicContact CG2-CE2 4.21Å; R163-Y165 HydrophobicContact CB-CE2 3.87Å; R163-Y165 PolarHBondContact NH1-OH 3.49Å
166	M	96.7	Very high	94	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.5	177.7	-52.6	-177.2	-161.1	0	0	109.4	I122 K123 I125 C136 E139 L140 L143 L154 V164 M168	I122-M166 CarbonylContact C-O 3.6Å; I122-M166 VanDerWaalsContact CA-O 3.27Å; I122-M166 WeakPolarHBondContact CA-O 3.48Å; K123-M166 HydrophobicContact CB-CB 4.36Å; K123-M166 PolarHBondContact N-O 2.78Å; K123-M166 PolarHBondContact O-N 2.79Å; I125-M166 HydrophobicContact CD1-CE 3.64Å; I125-M166 HydrophobicContact CG1-CE 4.39Å; C136-M166 HydrophobicContact CB-CE 4.36Å; C136-M166 WeakPolarHBondContact SG-CE 3.45Å; E139-M166 HydrophobicContact CB-CE 4.44Å; E139-M166 HydrophobicContact CG-CE 4.35Å; E139-M166 HydrophobicContact CG-SD 4.07Å; L140-M166 HydrophobicContact CD1-CE 4.47Å; L140-M166 HydrophobicContact CD2-CE 4Å; L140-M166 HydrophobicContact CD2-CG 4.03Å; L140-M166 HydrophobicContact CD2-SD 3.86Å; L140-M166 HydrophobicContact CG-CE 3.77Å; L140-M166 HydrophobicContact CG-SD 4.26Å; L143-M166 HydrophobicContact CD1-SD 4.12Å; L154-M166 HydrophobicContact CD1-CB 3.79Å; L154-M166 HydrophobicContact CD1-CG 4.44Å; V164-M166 HydrophobicContact CG1-CE 4.16Å; V164-M166 HydrophobicContact CG1-CG 3.98Å; M166-M168 HydrophobicContact CB-CG 4.25Å; M166-M168 HydrophobicContact CB-SD 4.28Å
167	V	97.6	Very high	93.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.6	171.5	-170.3	0	0	0	0	108.7	Y94 Y120 A121 I122 L154 I155 E156 F158	Y94-V167 HydrophobicContact CE1-CG1 4.16Å; Y94-V167 HydrophobicContact CE2-CG1 4.49Å; Y94-V167 HydrophobicContact CE2-CG2 3.95Å; Y120-V167 HydrophobicContact CD1-CG1 4.36Å; Y120-V167 HydrophobicContact CG-CG1 4.07Å; A121-V167 CarbonylContact O-C 3.4Å; A121-V167 WeakPolarHBondContact O-CA 3.47Å; I122-V167 HydrophobicContact CD1-CG2 4.08Å; I122-V167 HydrophobicContact CG1-CG1 4.48Å; I122-V167 HydrophobicContact CG1-CG2 4.08Å; L154-V167 WeakPolarHBondContact CD1-O 3.41Å; I155-V167 HydrophobicContact CB-CB 4.29Å; I155-V167 HydrophobicContact CB-CG1 4.16Å; I155-V167 WeakPolarHBondContact CB-O 3.4Å; I155-V167 PolarHBondContact N-O 3.23Å; E156-V167 HydrophobicContact CG-CB 3.96Å; E156-V167 HydrophobicContact CG-CG2 3.62Å; E156-V167 PolarHBondContact O-N 2.68Å; F158-V167 HydrophobicContact CD2-CG2 4.22Å; F158-V167 HydrophobicContact CE2-CG2 3.8Å
168	M	97.4	Very high	93.2	Very high	10 Å²	10	41 Å²	41	5%	0.049	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	160.5	-171.2	-56.7	174.7	73.4	0	0	110.9	Y120 A121 K123 L143 I152 Q153 L154 M166	Y120-M168 WeakPolarHBondContact CB-O 3.48Å; Y120-M168 WeakPolarHBondContact CD1-O 3.34Å; A121-M168 PolarHBondContact N-O 3Å; A121-M168 PolarHBondContact O-N 3.4Å; K123-M168 HydrophobicContact CB-SD 4.03Å; K123-M168 HydrophobicContact CD-SD 4.48Å; L143-M168 HydrophobicContact CD1-CE 3.65Å; L143-M168 HydrophobicContact CD1-SD 4.31Å; L143-M168 HydrophobicContact CD2-CE 4.2Å; I152-M168 HydrophobicContact CB-CE 4.39Å; I152-M168 HydrophobicContact CG1-CB 4.46Å; I152-M168 HydrophobicContact CG1-CE 3.96Å; I152-M168 HydrophobicContact CG2-CE 3.55Å; Q153-M168 CarbonylContact O-C 3.54Å; Q153-M168 VanDerWaalsContact O-CA 3.29Å; Q153-M168 WeakPolarHBondContact O-CA 3.36Å; L154-M168 HydrophobicContact CD1-CG 4.22Å; M166-M168 HydrophobicContact CB-CG 4.25Å; M166-M168 HydrophobicContact CB-SD 4.28Å
169	E	96.5	Very high	92.7	Very high	32 Å²	32	42 Å²	42	15%	0.15	22%	0.22	C	C	.	.			trans	-46.1	148.1	163.8	-91.2	177.8	127	0	0	111.5	I152 Q153 K230	I152-E169 HydrophobicContact CD1-CB 3.54Å; I152-E169 HydrophobicContact CG1-CB 4.16Å; Q153-E169 HydrophobicContact CB-CG 4.07Å; Q153-E169 WeakPolarHBondContact CB-OE2 3.39Å; Q153-E169 PolarHBondContact N-OE2 3.2Å; Q153-E169 PolarHBondContact O-N 2.98Å; E169-K230 IonicContact OE1-NZ 2.79Å; E169-K230 PolarHBondContact OE1-NZ 2.95Å; E169-K230 IonicContact OE2-NZ 3.23Å
170	L	95.9	Very high	92.3	Very high	12 Å²	12	36.8 Å²	36.8	6%	0.063	20%	0.195	C	C	.	.			trans	-101.3	103.6	177.5	-174.6	67.8	0	0	0	111.3	I100 R110 P119 A121 T172	I100-L170 HydrophobicContact CD1-CD1 3.58Å; R110-L170 HydrophobicContact CB-CD1 4.43Å; R110-L170 HydrophobicContact CG-CD1 4.45Å; R110-L170 HydrophobicContact CG-CD2 3.87Å; P119-L170 HydrophobicContact CB-CD2 3.89Å; A121-L170 HydrophobicContact CB-CD1 3.93Å; L170-T172 HydrophobicContact CD2-CG2 3.64Å; L170-T172 HydrophobicContact CG-CG2 3.63Å; L170-T172 PolarHBondContact O-N 3.38Å
171	A	94.2	Very high	92.1	Very high	12 Å²	12	37.2 Å²	37.2	10%	0.099	20%	0.196	C	C	.	.			trans	-70.8	120.3	165.4	0	0	0	0	0	110.7	L221 M232	A171-L221 HydrophobicContact CB-CB 3.76Å; A171-L221 HydrophobicContact CB-CD1 3.77Å; A171-L221 HydrophobicContact CB-CG 4.44Å; A171-M232 HydrophobicContact CB-CE 3.6Å
172	T	93.3	Very high	91.9	Very high	73 Å²	73	32.7 Å²	32.7	45%	0.448	19%	0.189	S	C	.	.			trans	-123.3	-7.4	-179.8	61.1	0	0	0	0	114.1	L170 G174 Y223 H224	L170-T172 HydrophobicContact CD2-CG2 3.64Å; L170-T172 HydrophobicContact CG-CG2 3.63Å; L170-T172 PolarHBondContact O-N 3.38Å; T172-G174 VanDerWaalsContact C-N 3.31Å; T172-G174 PolarHBondContact O-N 3.38Å; T172-Y223 PolarHBondContact N-O 3.45Å; T172-Y223 PolarHBondContact OG1-O 3.35Å; T172-H224 WeakPolarHBondContact OG1-CA 3.28Å
173	G	90.6	Very high	91.3	Very high	11 Å²	11	33.1 Å²	33.1	11%	0.113	19%	0.187	C	C	.	.	S	Bend	trans	-82.8	4.5	-174.2	0	0	0	0	0	116.5	Y222 H224	G173-Y222 WeakPolarHBondContact CA-O 3.25Å; G173-Y222 PolarHBondContact N-O 3.48Å; G173-H224 VanDerWaalsContact CA-O 3.31Å; G173-H224 WeakPolarHBondContact CA-O 3.36Å
174	G	90.9	Very high	90.6	Very high	35 Å²	35	31.8 Å²	31.8	36%	0.361	20%	0.196	S	C	.	.			trans	88	176.2	-177	0	0	0	0	0	114.3	T172 Y222	T172-G174 VanDerWaalsContact C-N 3.31Å; T172-G174 PolarHBondContact O-N 3.38Å; G174-Y222 PolarHBondContact O-N 3Å
175	E	91.6	Very high	90.2	Very high	50 Å²	50	34.3 Å²	34.3	23%	0.234	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-82.6	156.4	173.6	-42.6	-155.3	155.6	0	0	109.7	M1 F177 D178 R179 E218 L221	M1-E175 PolarHBondContact N-OE1 2.97Å; E175-F177 VanDerWaalsContact C-N 3.35Å; E175-F177 PolarHBondContact O-N 3.3Å; E175-D178 PolarHBondContact O-N 3.25Å; E175-R179 PolarHBondContact O-N 2.78Å; E175-E218 WeakPolarHBondContact OE2-CA 3.47Å; E175-L221 HydrophobicContact CB-CD2 4.06Å; E175-L221 HydrophobicContact CG-CD2 3.7Å
176	L	90.1	Very high	89.8	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-51.8	-48.2	-168.2	172.6	56.2	0	0	0	113.7	I180 V194 L220 Y222 I231 I282 L286	L176-I180 HydrophobicContact CD1-CD1 4.44Å; L176-I180 WeakPolarHBondContact O-CG1 3.48Å; L176-V194 HydrophobicContact CD1-CB 4.48Å; L176-V194 HydrophobicContact CD1-CG1 3.6Å; L176-V194 HydrophobicContact CD1-CG2 4.03Å; L176-V194 HydrophobicContact CD2-CG1 3.96Å; L176-V194 HydrophobicContact CG-CG1 4.46Å; L176-L220 HydrophobicContact CB-CB 4.19Å; L176-L220 HydrophobicContact CD2-CB 4.4Å; L176-L220 HydrophobicContact CD2-CD1 3.92Å; L176-L220 PolarHBondContact N-O 2.88Å; L176-Y222 HydrophobicContact CD1-CE2 3.87Å; L176-I231 HydrophobicContact CD1-CD1 4.09Å; L176-I282 HydrophobicContact CD2-CG2 4.35Å; L176-L286 HydrophobicContact CD1-CD1 4.32Å; L176-L286 HydrophobicContact CD2-CD1 4.26Å; L176-L286 HydrophobicContact CG-CD1 4.41Å
177	F	88.2	Confident	89.6	Confident	20 Å²	20	35.7 Å²	35.7	9%	0.088	22%	0.222	C	C	.	.	H	α-helix	trans	-80	-29.4	-174.9	-64.5	-18.2	0	0	0	113.9	E175 R179 I180 I181 P217 I285 L286 L371	E175-F177 VanDerWaalsContact C-N 3.35Å; E175-F177 PolarHBondContact O-N 3.3Å; F177-R179 VanDerWaalsContact C-N 3.29Å; F177-R179 PolarHBondContact O-N 2.85Å; F177-I180 HydrophobicContact CD1-CD1 3.96Å; F177-I180 PolarHBondContact O-N 3.24Å; F177-I180 VanDerWaalsContact O-N 3.09Å; F177-I181 WeakPolarHBondContact O-CG1 3.47Å; F177-I181 PolarHBondContact O-N 3.22Å; F177-I181 VanDerWaalsContact O-N 3.08Å; F177-P217 HydrophobicContact CD2-CB 3.72Å; F177-P217 HydrophobicContact CD2-CG 3.83Å; F177-P217 HydrophobicContact CE1-CB 4.49Å; F177-P217 HydrophobicContact CE1-CG 4.38Å; F177-P217 HydrophobicContact CE2-CB 3.59Å; F177-P217 HydrophobicContact CE2-CG 3.16Å; F177-P217 HydrophobicContact CG-CB 4.25Å; F177-P217 HydrophobicContact CZ-CB 3.99Å; F177-P217 HydrophobicContact CZ-CG 3.48Å; F177-P217 VanDerWaalsContact CZ-CG 3.48Å; F177-I285 HydrophobicContact CD2-CG2 4.25Å; F177-I285 HydrophobicContact CE1-CG2 4.39Å; F177-I285 HydrophobicContact CE2-CB 4.01Å; F177-I285 HydrophobicContact CE2-CD1 4.31Å; F177-I285 HydrophobicContact CE2-CG2 3.35Å; F177-I285 HydrophobicContact CZ-CB 3.69Å; F177-I285 HydrophobicContact CZ-CD1 4.36Å; F177-I285 HydrophobicContact CZ-CG2 3.47Å; F177-I285 VanDerWaalsContact CZ-CG2 3.47Å; F177-L286 HydrophobicContact CE1-CD1 4.07Å; F177-L371 HydrophobicContact CB-CD1 4.12Å; F177-L371 HydrophobicContact CB-CD2 4.3Å; F177-L371 HydrophobicContact CD2-CD2 3.79Å; F177-L371 HydrophobicContact CE2-CD2 4.3Å; F177-L371 HydrophobicContact CG-CD1 4.43Å; F177-L371 HydrophobicContact CG-CD2 4.09Å
178	D	87.6	Confident	89.4	Confident	97 Å²	97	35.7 Å²	35.7	52%	0.519	22%	0.222	S	C	.	.	H	α-helix	trans	-59.7	-42.8	174.4	-67.7	-19.5	0	0	0	110.8	E175 I180 I181 A182	E175-D178 PolarHBondContact O-N 3.25Å; D178-I180 VanDerWaalsContact C-N 3.33Å; D178-I180 PolarHBondContact O-N 3.38Å; D178-I181 PolarHBondContact O-N 2.9Å; D178-A182 PolarHBondContact O-N 3.22Å; D178-A182 VanDerWaalsContact O-N 3.1Å
179	R	86.7	Confident	89	Confident	36 Å²	36	41.2 Å²	41.2	14%	0.136	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-40.3	174.8	-175.5	-172.4	-78.1	-141	-23.2	111.6	E175 F177 A182 K183 Y222 H224 P225 G226	E175-R179 PolarHBondContact O-N 2.78Å; F177-R179 VanDerWaalsContact C-N 3.29Å; F177-R179 PolarHBondContact O-N 2.85Å; R179-A182 CarbonylContact O-C 3.53Å; R179-A182 PolarHBondContact O-N 3.03Å; R179-K183 WeakPolarHBondContact O-CB 3.49Å; R179-K183 PolarHBondContact O-N 2.99Å; R179-Y222 HydrophobicContact CB-CD2 3.97Å; R179-Y222 HydrophobicContact CB-CE2 3.72Å; R179-Y222 VanDerWaalsContact CD-CZ 3.49Å; R179-Y222 HydrophobicContact CG-CD2 4.44Å; R179-Y222 HydrophobicContact CG-CE2 4.12Å; R179-Y222 VanDerWaalsContact CZ-CD1 3.44Å; R179-Y222 VanDerWaalsContact NE-CD2 3.32Å; R179-Y222 VanDerWaalsContact NE-CG 3.34Å; R179-H224 PolarHBondContact NH2-O 2.91Å; R179-P225 PolarHBondContact NH2-O 2.87Å; R179-G226 VanDerWaalsContact CZ-O 3.26Å; R179-G226 PolarHBondContact NH1-O 2.82Å; R179-G226 PolarHBondContact NH2-O 3.09Å
180	I	86.3	Confident	88.8	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-48.1	-179.3	-64.6	175.1	0	0	0	110	L176 F177 D178 A182 K183 F186 L286 H364 I367	L176-I180 HydrophobicContact CD1-CD1 4.44Å; L176-I180 WeakPolarHBondContact O-CG1 3.48Å; F177-I180 HydrophobicContact CD1-CD1 3.96Å; F177-I180 PolarHBondContact O-N 3.24Å; F177-I180 VanDerWaalsContact O-N 3.09Å; D178-I180 VanDerWaalsContact C-N 3.33Å; D178-I180 PolarHBondContact O-N 3.38Å; I180-A182 VanDerWaalsContact C-N 3.26Å; I180-A182 PolarHBondContact O-N 3.23Å; I180-K183 PolarHBondContact O-N 3.42Å; I180-K183 VanDerWaalsContact O-N 3.13Å; I180-F186 HydrophobicContact CB-CD2 4.45Å; I180-F186 HydrophobicContact CD1-CD2 4.28Å; I180-F186 HydrophobicContact CD1-CE1 4.33Å; I180-F186 HydrophobicContact CD1-CE2 3.71Å; I180-F186 HydrophobicContact CD1-CZ 3.74Å; I180-F186 HydrophobicContact CG1-CD2 3.92Å; I180-F186 HydrophobicContact CG1-CE2 3.67Å; I180-F186 HydrophobicContact CG1-CZ 4.24Å; I180-F186 HydrophobicContact CG2-CB 4.25Å; I180-F186 HydrophobicContact CG2-CD1 4.4Å; I180-F186 HydrophobicContact CG2-CD2 3.94Å; I180-F186 HydrophobicContact CG2-CE2 4.42Å; I180-F186 HydrophobicContact CG2-CG 3.93Å; I180-L286 HydrophobicContact CD1-CD1 3.38Å; I180-H364 PolarHBondContact O-CD2 3.09Å; I180-H364 PolarHBondContact O-NE2 3.19Å; I180-I367 HydrophobicContact CG2-CG2 4.03Å
181	I	86.1	Confident	88.7	Confident	52 Å²	52	40.3 Å²	40.3	27%	0.267	24%	0.239	S	C	.	.	H	α-helix	trans	-54.8	-45.5	175.5	-63	166.8	0	0	0	110.2	F177 D178 K183 H364 L371 L372	F177-I181 WeakPolarHBondContact O-CG1 3.47Å; F177-I181 PolarHBondContact O-N 3.22Å; F177-I181 VanDerWaalsContact O-N 3.08Å; D178-I181 PolarHBondContact O-N 2.9Å; I181-K183 PolarHBondContact O-N 2.85Å; I181-H364 PolarHBondContact O-CE1 2.88Å; I181-H364 PolarHBondContact O-NE2 3.11Å; I181-L371 HydrophobicContact CD1-CB 4.01Å; I181-L371 HydrophobicContact CD1-CD1 4.32Å; I181-L371 HydrophobicContact CG1-CB 4.26Å; I181-L371 HydrophobicContact CG1-CD1 3.95Å; I181-L372 HydrophobicContact CD1-CD2 4.26Å; I181-L372 HydrophobicContact CD1-CG 4.39Å; I181-L372 HydrophobicContact CG2-CD1 4.41Å; I181-L372 HydrophobicContact CG2-CD2 4.38Å; I181-L372 HydrophobicContact CG2-CG 4.47Å
182	A	84.8	Confident	88.6	Confident	85 Å²	85	39.8 Å²	39.8	70%	0.702	24%	0.235	S	C	*	.	H	α-helix	trans	-70.9	-20.8	-179.7	0	0	0	0	0	115.7	D178 R179 I180 G184	D178-A182 PolarHBondContact O-N 3.22Å; D178-A182 VanDerWaalsContact O-N 3.1Å; R179-A182 CarbonylContact O-C 3.53Å; R179-A182 PolarHBondContact O-N 3.03Å; I180-A182 VanDerWaalsContact C-N 3.26Å; I180-A182 PolarHBondContact O-N 3.23Å; A182-G184 PolarHBondContact O-N 2.9Å
183	K	78.2	Confident	88.6	Confident	90 Å²	90	42.9 Å²	42.9	39%	0.391	24%	0.238	S	C	.	.	H	α-helix	trans	-74.8	-20.5	-167.8	-164.9	174.1	177.4	-177.6	0	115	R179 I180 I181 S185 D190	R179-K183 WeakPolarHBondContact O-CB 3.49Å; R179-K183 PolarHBondContact O-N 2.99Å; I180-K183 PolarHBondContact O-N 3.42Å; I180-K183 VanDerWaalsContact O-N 3.13Å; I181-K183 PolarHBondContact O-N 2.85Å; K183-S185 WeakPolarHBondContact CD-O 3.42Å; K183-S185 WeakPolarHBondContact CG-O 3.27Å; K183-S185 PolarHBondContact O-N 3.38Å; K183-D190 IonicContact NZ-OD1 2.61Å; K183-D190 PolarHBondContact NZ-OD1 3.22Å
184	G	79.2	Confident	88.8	Confident	46 Å²	46	42.6 Å²	42.6	47%	0.474	23%	0.234	S	C	.	.	S	Bend	trans	70.8	-22.8	-176.4	0	0	0	0	0	115.6	A182 N362 H364	A182-G184 PolarHBondContact O-N 2.9Å; G184-N362 PolarHBondContact O-ND2 2.84Å; G184-H364 VanDerWaalsContact C-CG 3.49Å; G184-H364 PolarHBondContact N-NE2 2.86Å
185	S	85.3	Confident	89	Confident	54 Å²	54	41 Å²	41	38%	0.378	22%	0.218	S	C	.	.			trans	-137.6	145.9	170.9	62.9	0	0	0	0	112	K183 N362	K183-S185 WeakPolarHBondContact CD-O 3.42Å; K183-S185 WeakPolarHBondContact CG-O 3.27Å; K183-S185 PolarHBondContact O-N 3.38Å; S185-N362 WeakPolarHBondContact CA-OD1 3.44Å
186	F	88.6	Confident	89.2	Confident	3 Å²	3	40.7 Å²	40.7	1%	0.013	22%	0.216	C	C	.	.			trans	-159	132.1	178.7	-162.8	-98	0	0	0	110.2	I180 D190 A191 L286 N362 L363 H364 I367	I180-F186 HydrophobicContact CB-CD2 4.45Å; I180-F186 HydrophobicContact CD1-CD2 4.28Å; I180-F186 HydrophobicContact CD1-CE1 4.33Å; I180-F186 HydrophobicContact CD1-CE2 3.71Å; I180-F186 HydrophobicContact CD1-CZ 3.74Å; I180-F186 HydrophobicContact CG1-CD2 3.92Å; I180-F186 HydrophobicContact CG1-CE2 3.67Å; I180-F186 HydrophobicContact CG1-CZ 4.24Å; I180-F186 HydrophobicContact CG2-CB 4.25Å; I180-F186 HydrophobicContact CG2-CD1 4.4Å; I180-F186 HydrophobicContact CG2-CD2 3.94Å; I180-F186 HydrophobicContact CG2-CE2 4.42Å; I180-F186 HydrophobicContact CG2-CG 3.93Å; F186-D190 HydrophobicContact CD2-CB 3.61Å; F186-D190 HydrophobicContact CE1-CB 4.48Å; F186-D190 HydrophobicContact CE2-CB 3.44Å; F186-D190 VanDerWaalsContact CE2-CB 3.44Å; F186-D190 HydrophobicContact CG-CB 4.22Å; F186-D190 HydrophobicContact CZ-CB 3.91Å; F186-A191 HydrophobicContact CE1-CB 3.92Å; F186-A191 HydrophobicContact CZ-CB 4Å; F186-L286 HydrophobicContact CE1-CD1 4.34Å; F186-L286 HydrophobicContact CE1-CG 4.25Å; F186-L286 VanDerWaalsContact CE1-O 3.28Å; F186-L286 WeakPolarHBondContact CE1-O 3.41Å; F186-L286 HydrophobicContact CZ-CD1 3.77Å; F186-L286 HydrophobicContact CZ-CG 4.01Å; F186-N362 PolarHBondContact N-OD1 2.9Å; F186-N362 PolarHBondContact O-OD1 3.35Å; F186-L363 PolarHBondContact O-N 2.71Å; F186-H364 HydrophobicContact CB-CB 4.11Å; F186-I367 HydrophobicContact CD1-CD1 3.75Å; F186-I367 HydrophobicContact CE1-CD1 4.37Å
187	T	91.7	Very high	89.5	Confident	29 Å²	29	42.8 Å²	42.8	18%	0.178	23%	0.226	C	C	.	.			trans	-131.6	170.2	-174.3	63.6	0	0	0	0	111.1	R189 D190 A191	T187-R189 PolarHBondContact O-N 3.19Å; T187-R189 PolarHBondContact OG1-N 3.47Å; T187-D190 PolarHBondContact N-OD2 2.73Å; T187-D190 WeakPolarHBondContact O-CB 3.43Å; T187-D190 PolarHBondContact O-N 3.24Å; T187-D190 VanDerWaalsContact O-N 3.07Å; T187-D190 PolarHBondContact OG1-N 3.12Å; T187-D190 PolarHBondContact OG1-OD2 3.18Å; T187-A191 PolarHBondContact O-N 2.82Å; T187-A191 VanDerWaalsContact O-N 3.08Å
188	E	93.4	Very high	90	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-55.3	-32.8	169	-75.2	-178.6	-136.3	0	0	112.1	D190 A191 T192 L287 S321 W350 A355 S358	E188-D190 VanDerWaalsContact C-N 3.34Å; E188-D190 PolarHBondContact O-N 2.85Å; E188-A191 WeakPolarHBondContact O-CB 3.14Å; E188-A191 PolarHBondContact O-N 3.21Å; E188-T192 WeakPolarHBondContact O-CG2 3.34Å; E188-T192 PolarHBondContact O-N 2.9Å; E188-T192 PolarHBondContact O-OG1 2.81Å; E188-L287 HydrophobicContact CG-CD2 4.12Å; E188-S321 WeakPolarHBondContact OE1-CB 3.32Å; E188-S321 PolarHBondContact OE1-N 3.45Å; E188-S321 PolarHBondContact OE1-OG 3.36Å; E188-S321 WeakPolarHBondContact OE2-CB 3.46Å; E188-S321 PolarHBondContact OE2-OG 3.25Å; E188-W350 HydrophobicContact CB-CZ2 4.28Å; E188-W350 HydrophobicContact CG-CZ2 4.32Å; E188-W350 PolarHBondContact OE2-NE1 3.29Å; E188-A355 HydrophobicContact CB-CB 3.84Å; E188-S358 WeakPolarHBondContact OE2-CB 3.33Å; E188-S358 PolarHBondContact OE2-OG 3.43Å
189	R	90.5	Very high	90.5	Very high	127 Å²	127	37.4 Å²	37.4	48%	0.479	20%	0.198	S	C	.	.	H	α-helix	trans	-70.3	-27	177.6	-176.5	166.9	-171.5	-154.9	4.4	113.9	T187 T192 R193 M354 A355	T187-R189 PolarHBondContact O-N 3.19Å; T187-R189 PolarHBondContact OG1-N 3.47Å; R189-T192 PolarHBondContact O-OG1 3.46Å; R189-R193 PolarHBondContact O-N 2.88Å; R189-M354 VanDerWaalsContact CG-O 3.28Å; R189-M354 WeakPolarHBondContact CG-O 3.36Å; R189-A355 HydrophobicContact CB-CB 3.98Å
190	D	90.9	Very high	91	Very high	25 Å²	25	37.9 Å²	37.9	13%	0.134	20%	0.204	C	C	.	.	H	α-helix	trans	-73.4	-42.8	168.3	-62.6	-77.8	0	0	0	110.7	K183 F186 T187 E188 R193 V194	K183-D190 IonicContact NZ-OD1 2.61Å; K183-D190 PolarHBondContact NZ-OD1 3.22Å; F186-D190 HydrophobicContact CD2-CB 3.61Å; F186-D190 HydrophobicContact CE1-CB 4.48Å; F186-D190 HydrophobicContact CE2-CB 3.44Å; F186-D190 VanDerWaalsContact CE2-CB 3.44Å; F186-D190 HydrophobicContact CG-CB 4.22Å; F186-D190 HydrophobicContact CZ-CB 3.91Å; T187-D190 PolarHBondContact N-OD2 2.73Å; T187-D190 WeakPolarHBondContact O-CB 3.43Å; T187-D190 PolarHBondContact O-N 3.24Å; T187-D190 VanDerWaalsContact O-N 3.07Å; T187-D190 PolarHBondContact OG1-N 3.12Å; T187-D190 PolarHBondContact OG1-OD2 3.18Å; E188-D190 VanDerWaalsContact C-N 3.34Å; E188-D190 PolarHBondContact O-N 2.85Å; D190-R193 PolarHBondContact O-N 3.42Å; D190-V194 WeakPolarHBondContact O-CG2 3.37Å; D190-V194 PolarHBondContact O-N 3.3Å; D190-V194 VanDerWaalsContact O-N 3.09Å
191	A	93.5	Very high	91.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.9	-47.3	178.5	0	0	0	0	0	112.2	F186 T187 E188 R193 V194 L195 L286 L287 W350	F186-A191 HydrophobicContact CE1-CB 3.92Å; F186-A191 HydrophobicContact CZ-CB 4Å; T187-A191 PolarHBondContact O-N 2.82Å; T187-A191 VanDerWaalsContact O-N 3.08Å; E188-A191 WeakPolarHBondContact O-CB 3.14Å; E188-A191 PolarHBondContact O-N 3.21Å; A191-R193 PolarHBondContact O-N 3.46Å; A191-V194 PolarHBondContact O-N 2.82Å; A191-L195 WeakPolarHBondContact O-CB 3.4Å; A191-L195 WeakPolarHBondContact O-CG 3.38Å; A191-L195 PolarHBondContact O-N 2.69Å; A191-L286 HydrophobicContact CB-CD2 3.78Å; A191-L286 HydrophobicContact CB-CG 3.98Å; A191-L287 HydrophobicContact CB-CD2 3.61Å; A191-L287 HydrophobicContact CB-CG 4.47Å; A191-W350 HydrophobicContact CB-CH2 4.13Å; A191-W350 HydrophobicContact CB-CZ2 4.32Å
192	T	93.8	Very high	92.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-39.6	177.1	56.6	0	0	0	0	111.8	E188 R189 V194 L195 Q196 W350 A355	E188-T192 WeakPolarHBondContact O-CG2 3.34Å; E188-T192 PolarHBondContact O-N 2.9Å; E188-T192 PolarHBondContact O-OG1 2.81Å; R189-T192 PolarHBondContact O-OG1 3.46Å; T192-V194 PolarHBondContact O-N 2.89Å; T192-L195 PolarHBondContact O-N 2.69Å; T192-Q196 WeakPolarHBondContact O-CB 3.49Å; T192-Q196 WeakPolarHBondContact O-CG 3.43Å; T192-Q196 PolarHBondContact O-N 2.99Å; T192-W350 HydrophobicContact CG2-CD2 3.66Å; T192-W350 HydrophobicContact CG2-CE3 3.91Å; T192-W350 HydrophobicContact CG2-CG 4.25Å; T192-W350 HydrophobicContact CG2-CH2 3.95Å; T192-W350 HydrophobicContact CG2-CZ2 3.68Å; T192-W350 HydrophobicContact CG2-CZ3 4.06Å; T192-W350 WeakPolarHBondContact CG2-O 3.42Å; T192-A355 HydrophobicContact CG2-CB 4.27Å
193	R	92.4	Very high	92.8	Very high	139 Å²	139	34.5 Å²	34.5	53%	0.525	17%	0.171	S	C	.	.	H	α-helix	trans	-59.8	-43.7	175.1	-106.5	-179.4	172.7	163.8	-2.9	112.7	R189 D190 A191 M197 M354	R189-R193 PolarHBondContact O-N 2.88Å; D190-R193 PolarHBondContact O-N 3.42Å; A191-R193 PolarHBondContact O-N 3.46Å; R193-M197 PolarHBondContact O-N 3.43Å; R193-M354 HydrophobicContact CG-CE 3.76Å
194	V	94.3	Very high	93.7	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.03	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-49.6	174.2	166	0	0	0	0	110.2	L176 D190 A191 T192 Q196 M197 V198 Y222 I231 L286	L176-V194 HydrophobicContact CD1-CB 4.48Å; L176-V194 HydrophobicContact CD1-CG1 3.6Å; L176-V194 HydrophobicContact CD1-CG2 4.03Å; L176-V194 HydrophobicContact CD2-CG1 3.96Å; L176-V194 HydrophobicContact CG-CG1 4.46Å; D190-V194 WeakPolarHBondContact O-CG2 3.37Å; D190-V194 PolarHBondContact O-N 3.3Å; D190-V194 VanDerWaalsContact O-N 3.09Å; A191-V194 PolarHBondContact O-N 2.82Å; T192-V194 PolarHBondContact O-N 2.89Å; V194-Q196 PolarHBondContact O-N 2.83Å; V194-M197 PolarHBondContact O-N 3.33Å; V194-V198 WeakPolarHBondContact O-CG2 3.38Å; V194-V198 PolarHBondContact O-N 2.71Å; V194-V198 VanDerWaalsContact O-N 3.14Å; V194-Y222 VanDerWaalsContact CG2-OH 3.31Å; V194-Y222 WeakPolarHBondContact CG2-OH 3.31Å; V194-I231 HydrophobicContact CG1-CG1 4.48Å; V194-L286 HydrophobicContact CB-CD2 4.34Å; V194-L286 HydrophobicContact CG1-CD2 4.14Å
195	L	95.9	Very high	94.5	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-68.6	-35.4	-174.6	-69.4	169.1	0	0	0	112.7	A191 T192 M197 V198 L199 S283 L286 F327 W350	A191-L195 WeakPolarHBondContact O-CB 3.4Å; A191-L195 WeakPolarHBondContact O-CG 3.38Å; A191-L195 PolarHBondContact O-N 2.69Å; T192-L195 PolarHBondContact O-N 2.69Å; L195-M197 PolarHBondContact O-N 3.14Å; L195-V198 PolarHBondContact O-N 2.68Å; L195-L199 WeakPolarHBondContact O-CB 3.43Å; L195-L199 WeakPolarHBondContact O-CD1 3.44Å; L195-L199 WeakPolarHBondContact O-CG 3.45Å; L195-L199 PolarHBondContact O-N 2.63Å; L195-S283 WeakPolarHBondContact CD1-OG 3.34Å; L195-S283 WeakPolarHBondContact CD2-OG 3.44Å; L195-L286 HydrophobicContact CD1-CD2 3.79Å; L195-L286 HydrophobicContact CD2-CD2 4.03Å; L195-L286 HydrophobicContact CG-CD2 3.64Å; L195-F327 HydrophobicContact CD1-CE1 4.06Å; L195-W350 HydrophobicContact CD1-CH2 3.76Å; L195-W350 HydrophobicContact CD1-CZ3 3.55Å
196	Q	95.9	Very high	95	Very high	42 Å²	42	29.3 Å²	29.3	20%	0.196	13%	0.128	C	C	.	.	H	α-helix	trans	-53	-53.7	170.5	-76.7	168.7	-16.6	0	0	111.2	T192 V194 V198 L199 D200 V351	T192-Q196 WeakPolarHBondContact O-CB 3.49Å; T192-Q196 WeakPolarHBondContact O-CG 3.43Å; T192-Q196 PolarHBondContact O-N 2.99Å; V194-Q196 PolarHBondContact O-N 2.83Å; Q196-V198 VanDerWaalsContact C-N 3.34Å; Q196-V198 PolarHBondContact O-N 3.31Å; Q196-L199 PolarHBondContact O-N 3.1Å; Q196-D200 PolarHBondContact O-N 2.83Å; Q196-V351 HydrophobicContact CG-CG1 3.56Å; Q196-V351 PolarHBondContact NE2-O 3.29Å
197	M	96.8	Very high	95.3	Very high	45 Å²	45	34.5 Å²	34.5	22%	0.222	16%	0.16	C	C	.	.	H	α-helix	trans	-59.1	-41.6	179	-75.4	-170.1	-71.8	0	0	113.2	N150 R193 V194 L195 G201 K230 I231	N150-M197 WeakPolarHBondContact CB-O 3.39Å; N150-M197 WeakPolarHBondContact ND2-CB 3.2Å; N150-M197 PolarHBondContact OD1-O 3.27Å; R193-M197 PolarHBondContact O-N 3.43Å; V194-M197 PolarHBondContact O-N 3.33Å; L195-M197 PolarHBondContact O-N 3.14Å; M197-G201 PolarHBondContact O-N 3.16Å; M197-K230 HydrophobicContact SD-CB 4.27Å; M197-I231 HydrophobicContact CB-CB 4.31Å; M197-I231 HydrophobicContact CE-CB 4.09Å; M197-I231 HydrophobicContact CE-CG1 3.96Å; M197-I231 HydrophobicContact SD-CB 4.39Å; M197-I231 PolarHBondContact SD-N 3.21Å; M197-I231 VanDerWaalsContact SD-N 3.43Å
198	V	97.9	Very high	95.4	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-70.2	-43.8	177.8	-177.5	0	0	0	0	110.7	V194 L195 Q196 D200 G201 V202 L220 I231 I233 L279	V194-V198 WeakPolarHBondContact O-CG2 3.38Å; V194-V198 PolarHBondContact O-N 2.71Å; V194-V198 VanDerWaalsContact O-N 3.14Å; L195-V198 PolarHBondContact O-N 2.68Å; Q196-V198 VanDerWaalsContact C-N 3.34Å; Q196-V198 PolarHBondContact O-N 3.31Å; V198-D200 PolarHBondContact O-N 3.3Å; V198-G201 PolarHBondContact O-N 3Å; V198-V202 HydrophobicContact CG1-CG2 4.24Å; V198-V202 WeakPolarHBondContact O-CG2 3.31Å; V198-V202 PolarHBondContact O-N 3.46Å; V198-L220 HydrophobicContact CG1-CD1 4.34Å; V198-L220 HydrophobicContact CG1-CD2 4.03Å; V198-L220 HydrophobicContact CG2-CD1 4.01Å; V198-L220 HydrophobicContact CG2-CD2 4.06Å; V198-I231 HydrophobicContact CG2-CG2 3.6Å; V198-I233 HydrophobicContact CG1-CD1 4.37Å; V198-I233 HydrophobicContact CG1-CG1 4.46Å; V198-L279 HydrophobicContact CB-CD2 4.47Å; V198-L279 HydrophobicContact CG1-CD2 3.44Å; V198-L279 VanDerWaalsContact CG1-CD2 3.44Å
199	L	98.1	Very high	95.2	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-62.2	-38.8	178.6	-77.1	168.8	0	0	0	112.6	L195 Q196 V202 K203 M276 L279 F327 A342 A345 L346 V351	L195-L199 WeakPolarHBondContact O-CB 3.43Å; L195-L199 WeakPolarHBondContact O-CD1 3.44Å; L195-L199 WeakPolarHBondContact O-CG 3.45Å; L195-L199 PolarHBondContact O-N 2.63Å; Q196-L199 PolarHBondContact O-N 3.1Å; L199-V202 PolarHBondContact O-N 2.87Å; L199-K203 WeakPolarHBondContact O-CB 3.35Å; L199-K203 PolarHBondContact O-N 3.3Å; L199-M276 HydrophobicContact CD2-CE 3.84Å; L199-L279 HydrophobicContact CD2-CD1 3.69Å; L199-L279 HydrophobicContact CG-CD1 4.49Å; L199-F327 HydrophobicContact CD1-CZ 4.16Å; L199-A342 HydrophobicContact CD2-CB 4.41Å; L199-A345 HydrophobicContact CD1-CB 3.92Å; L199-A345 HydrophobicContact CD2-CB 3.57Å; L199-A345 HydrophobicContact CG-CB 4.41Å; L199-L346 HydrophobicContact CB-CD1 4.25Å; L199-L346 HydrophobicContact CB-CD2 3.65Å; L199-L346 HydrophobicContact CB-CG 3.75Å; L199-L346 HydrophobicContact CD1-CD2 4.21Å; L199-L346 HydrophobicContact CD1-CG 4.27Å; L199-V351 HydrophobicContact CD1-CG1 4.47Å
200	D	97.9	Very high	95.3	Very high	47 Å²	47	30.8 Å²	30.8	25%	0.251	15%	0.153	S	C	.	.	H	α-helix	trans	-65.4	-41.2	175.2	-84.7	-42.2	0	0	0	111.8	Q196 V198 K203 Y204 L346	Q196-D200 PolarHBondContact O-N 2.83Å; V198-D200 PolarHBondContact O-N 3.3Å; D200-K203 WeakPolarHBondContact OD1-CE 3.34Å; D200-K203 IonicContact OD1-NZ 2.76Å; D200-K203 PolarHBondContact OD1-NZ 2.84Å; D200-Y204 WeakPolarHBondContact O-CB 3.4Å; D200-Y204 PolarHBondContact O-N 2.97Å; D200-L346 VanDerWaalsContact OD1-CD1 3.26Å; D200-L346 WeakPolarHBondContact OD1-CD1 3.35Å
201	G	97.9	Very high	95.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63	-43.4	172.1	0	0	0	0	0	113.3	M197 V198 Y204 L205	M197-G201 PolarHBondContact O-N 3.16Å; V198-G201 PolarHBondContact O-N 3Å; G201-Y204 PolarHBondContact O-N 3.12Å; G201-L205 WeakPolarHBondContact O-CG 3.26Å; G201-L205 PolarHBondContact O-N 3.09Å
202	V	97.9	Very high	95.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.7	-42.4	177.9	173	0	0	0	0	111.4	V198 L199 Y204 L205 H206 L215 I233 D275 M276 L279 A342	V198-V202 HydrophobicContact CG1-CG2 4.24Å; V198-V202 WeakPolarHBondContact O-CG2 3.31Å; V198-V202 PolarHBondContact O-N 3.46Å; L199-V202 PolarHBondContact O-N 2.87Å; V202-Y204 VanDerWaalsContact C-N 3.31Å; V202-Y204 PolarHBondContact O-N 3.09Å; V202-L205 PolarHBondContact O-N 3.31Å; V202-H206 WeakPolarHBondContact CG1-CE1 3.42Å; V202-H206 WeakPolarHBondContact CG1-NE2 3.48Å; V202-H206 WeakPolarHBondContact O-CB 3.44Å; V202-H206 PolarHBondContact O-CD2 2.71Å; V202-H206 PolarHBondContact O-N 2.91Å; V202-L215 HydrophobicContact CG2-CD1 3.72Å; V202-L215 HydrophobicContact CG2-CD2 4.47Å; V202-I233 HydrophobicContact CG2-CD1 3.76Å; V202-D275 HydrophobicContact CG1-CB 4.23Å; V202-M276 HydrophobicContact CG1-SD 4.03Å; V202-L279 HydrophobicContact CB-CD1 4.34Å; V202-L279 HydrophobicContact CG1-CD1 4.24Å; V202-L279 HydrophobicContact CG2-CD1 4.15Å; V202-A342 HydrophobicContact CG1-CB 4.26Å
203	K	97.9	Very high	95.2	Very high	67 Å²	67	31.7 Å²	31.7	29%	0.291	16%	0.155	S	C	.	.	H	α-helix	trans	-53.6	-47.8	170.9	177.1	-168.2	70.2	-164.8	0	111.1	L199 D200 H206 T207 A342 L343 L346	L199-K203 WeakPolarHBondContact O-CB 3.35Å; L199-K203 PolarHBondContact O-N 3.3Å; D200-K203 WeakPolarHBondContact OD1-CE 3.34Å; D200-K203 IonicContact OD1-NZ 2.76Å; D200-K203 PolarHBondContact OD1-NZ 2.84Å; K203-H206 PolarHBondContact O-N 3.41Å; K203-T207 WeakPolarHBondContact O-CG2 3.15Å; K203-T207 PolarHBondContact O-N 3.09Å; K203-T207 PolarHBondContact O-OG1 3.04Å; K203-A342 HydrophobicContact CB-CB 3.91Å; K203-L343 HydrophobicContact CD-CD1 4.5Å; K203-L346 HydrophobicContact CB-CD1 4.25Å; K203-L346 HydrophobicContact CD-CD1 3.72Å
204	Y	97.8	Very high	95.1	Very high	55 Å²	55	25.2 Å²	25.2	22%	0.216	13%	0.131	C	C	.	.	H	α-helix	trans	-63.9	-40.6	179	175.3	-86.9	0	0	0	112.8	V146 R147 H148 I151 D200 G201 V202 H206 T207 L208	V146-Y204 HydrophobicContact CB-CE1 3.95Å; V146-Y204 HydrophobicContact CG1-CE1 4.08Å; R147-Y204 PolarHBondContact N-OH 3.05Å; R147-Y204 PolarHBondContact O-OH 2.94Å; H148-Y204 HydrophobicContact CB-CD1 3.75Å; H148-Y204 HydrophobicContact CB-CD2 4.21Å; H148-Y204 HydrophobicContact CB-CE1 3.93Å; H148-Y204 HydrophobicContact CB-CE2 4.38Å; H148-Y204 HydrophobicContact CB-CG 3.89Å; H148-Y204 AromaticContact CD2-CD2 3.9Å; H148-Y204 AromaticContact CD2-CG 3.9Å; H148-Y204 AromaticContact CG-CG 3.95Å; I151-Y204 HydrophobicContact CD1-CD1 3.55Å; I151-Y204 HydrophobicContact CD1-CE1 4.09Å; D200-Y204 WeakPolarHBondContact O-CB 3.4Å; D200-Y204 PolarHBondContact O-N 2.97Å; G201-Y204 PolarHBondContact O-N 3.12Å; V202-Y204 VanDerWaalsContact C-N 3.31Å; V202-Y204 PolarHBondContact O-N 3.09Å; Y204-H206 VanDerWaalsContact C-N 3.34Å; Y204-T207 PolarHBondContact O-OG1 3.13Å; Y204-T207 VanDerWaalsContact O-OG1 3.07Å; Y204-L208 HydrophobicContact CD1-CD1 4.13Å; Y204-L208 HydrophobicContact CE1-CD1 3.46Å; Y204-L208 VanDerWaalsContact CE1-CD1 3.46Å; Y204-L208 HydrophobicContact CE1-CG 4.46Å; Y204-L208 HydrophobicContact CE2-CD1 4.48Å; Y204-L208 WeakPolarHBondContact O-CG 3.44Å; Y204-L208 PolarHBondContact O-N 3.41Å
205	L	96.3	Very high	95.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61.3	-45.5	172.4	-71.1	166.1	0	0	0	111	V142 V146 I151 G201 V202 T207 L208 G209 I210 I233 F236	V142-L205 HydrophobicContact CG1-CD2 4.42Å; V146-L205 HydrophobicContact CG1-CD2 3.83Å; I151-L205 HydrophobicContact CD1-CD1 4.24Å; I151-L205 HydrophobicContact CD1-CD2 3.88Å; I151-L205 HydrophobicContact CD1-CG 3.73Å; G201-L205 WeakPolarHBondContact O-CG 3.26Å; G201-L205 PolarHBondContact O-N 3.09Å; V202-L205 PolarHBondContact O-N 3.31Å; L205-T207 PolarHBondContact O-N 2.86Å; L205-L208 PolarHBondContact O-N 3.25Å; L205-L208 VanDerWaalsContact O-N 3.16Å; L205-G209 PolarHBondContact O-N 3.39Å; L205-I210 CarbonylContact C-O 3.27Å; L205-I210 VanDerWaalsContact C-O 3.27Å; L205-I210 HydrophobicContact CB-CB 4.34Å; L205-I210 HydrophobicContact CD2-CB 4.2Å; L205-I210 HydrophobicContact CD2-CG2 3.98Å; L205-I210 WeakPolarHBondContact O-CA 3.42Å; L205-I210 WeakPolarHBondContact O-CB 3.45Å; L205-I210 PolarHBondContact O-N 3.36Å; L205-I210 VanDerWaalsContact O-O 3.13Å; L205-I233 HydrophobicContact CD1-CD1 4.44Å; L205-F236 HydrophobicContact CD1-CE1 3.78Å; L205-F236 HydrophobicContact CD1-CZ 4.25Å; L205-F236 HydrophobicContact CD2-CE1 3.62Å; L205-F236 HydrophobicContact CD2-CZ 4.13Å; L205-F236 HydrophobicContact CG-CE1 4.36Å
206	H	95.6	Very high	94.8	Very high	27 Å²	27	25.4 Å²	25.4	13%	0.125	13%	0.131	C	C	.	.	H	α-helix	trans	-66.2	-38.9	-176.5	-69.4	-168.5	0	0	0	112.3	V202 K203 Y204 L208 G209 I210 N272 D275	V202-H206 WeakPolarHBondContact CG1-CE1 3.42Å; V202-H206 WeakPolarHBondContact CG1-NE2 3.48Å; V202-H206 WeakPolarHBondContact O-CB 3.44Å; V202-H206 PolarHBondContact O-CD2 2.71Å; V202-H206 PolarHBondContact O-N 2.91Å; K203-H206 PolarHBondContact O-N 3.41Å; Y204-H206 VanDerWaalsContact C-N 3.34Å; H206-L208 VanDerWaalsContact C-N 3.27Å; H206-L208 PolarHBondContact O-N 3.17Å; H206-G209 PolarHBondContact O-N 3.3Å; H206-I210 PolarHBondContact CD2-O 3.27Å; H206-N272 PolarHBondContact CE1-O 2.91Å; H206-N272 VanDerWaalsContact CE1-O 3.3Å; H206-N272 VanDerWaalsContact CG-ND2 3.33Å; H206-N272 PolarHBondContact ND1-ND2 2.97Å; H206-D275 IonicContact CD2-OD2 3.38Å; H206-D275 IonicContact CE1-OD2 2.73Å; H206-D275 IonicContact NE2-OD2 3.63Å; H206-D275 PolarHBondContact NE2-OD2 3.33Å
207	T	94.9	Very high	94.4	Very high	112 Å²	112	23.7 Å²	23.7	69%	0.687	12%	0.124	S	C	*	.	H	α-helix	trans	-67.4	-25.6	174.4	55.3	0	0	0	0	113.3	K203 Y204 L205 G209	K203-T207 WeakPolarHBondContact O-CG2 3.15Å; K203-T207 PolarHBondContact O-N 3.09Å; K203-T207 PolarHBondContact O-OG1 3.04Å; Y204-T207 PolarHBondContact O-OG1 3.13Å; Y204-T207 VanDerWaalsContact O-OG1 3.07Å; L205-T207 PolarHBondContact O-N 2.86Å; T207-G209 PolarHBondContact O-N 3.14Å
208	L	93	Very high	94	Very high	58 Å²	58	24 Å²	24	30%	0.304	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	1.3	170.8	-66.2	179.6	0	0	0	113.9	R145 V146 Y204 L205 H206 I210	R145-L208 PolarHBondContact NH2-O 3.38Å; V146-L208 HydrophobicContact CG1-CD1 4.12Å; Y204-L208 HydrophobicContact CD1-CD1 4.13Å; Y204-L208 HydrophobicContact CE1-CD1 3.46Å; Y204-L208 VanDerWaalsContact CE1-CD1 3.46Å; Y204-L208 HydrophobicContact CE1-CG 4.46Å; Y204-L208 HydrophobicContact CE2-CD1 4.48Å; Y204-L208 WeakPolarHBondContact O-CG 3.44Å; Y204-L208 PolarHBondContact O-N 3.41Å; L205-L208 PolarHBondContact O-N 3.25Å; L205-L208 VanDerWaalsContact O-N 3.16Å; H206-L208 VanDerWaalsContact C-N 3.27Å; H206-L208 PolarHBondContact O-N 3.17Å; L208-I210 VanDerWaalsContact C-N 3.33Å; L208-I210 HydrophobicContact CB-CD1 3.9Å; L208-I210 HydrophobicContact CB-CG1 3.94Å; L208-I210 HydrophobicContact CD1-CD1 4.24Å
209	G	91.1	Very high	93.8	Very high	19 Å²	19	24.1 Å²	24.1	20%	0.196	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	28.7	-174.6	0	0	0	0	0	113.3	L205 H206 T207 R242	L205-G209 PolarHBondContact O-N 3.39Å; H206-G209 PolarHBondContact O-N 3.3Å; T207-G209 PolarHBondContact O-N 3.14Å; G209-R242 PolarHBondContact O-N 3.29Å
210	I	92.3	Very high	93.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.2	-179	-52.4	177.5	0	0	0	109.1	V142 V146 L205 H206 L208 S240 A241	V142-I210 HydrophobicContact CG1-CD1 4.12Å; V142-I210 HydrophobicContact CG1-CG2 3.98Å; V142-I210 HydrophobicContact CG2-CD1 4.38Å; V142-I210 HydrophobicContact CG2-CG2 3.72Å; V146-I210 HydrophobicContact CG1-CD1 3.99Å; L205-I210 CarbonylContact C-O 3.27Å; L205-I210 VanDerWaalsContact C-O 3.27Å; L205-I210 HydrophobicContact CB-CB 4.34Å; L205-I210 HydrophobicContact CD2-CB 4.2Å; L205-I210 HydrophobicContact CD2-CG2 3.98Å; L205-I210 WeakPolarHBondContact O-CA 3.42Å; L205-I210 WeakPolarHBondContact O-CB 3.45Å; L205-I210 PolarHBondContact O-N 3.36Å; L205-I210 VanDerWaalsContact O-O 3.13Å; H206-I210 PolarHBondContact CD2-O 3.27Å; L208-I210 VanDerWaalsContact C-N 3.33Å; L208-I210 HydrophobicContact CB-CD1 3.9Å; L208-I210 HydrophobicContact CB-CG1 3.94Å; L208-I210 HydrophobicContact CD1-CD1 4.24Å; I210-S240 CarbonylContact C-O 3.57Å; I210-S240 WeakPolarHBondContact CA-O 3.33Å; I210-A241 HydrophobicContact CG1-CB 4.06Å
211	T	92.6	Very high	93.5	Very high	4 Å²	4	22 Å²	22	3%	0.025	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.4	173.3	-53	0	0	0	0	109.1	R213 A239 S240 M250 N272 V274 D275	T211-R213 HydrophobicContact CG2-CG 3.7Å; T211-A239 CarbonylContact O-C 3.55Å; T211-A239 VanDerWaalsContact O-CA 3.28Å; T211-A239 WeakPolarHBondContact O-CA 3.47Å; T211-S240 PolarHBondContact N-O 2.95Å; T211-S240 PolarHBondContact O-N 3.43Å; T211-M250 WeakPolarHBondContact OG1-CE 3.47Å; T211-N272 HydrophobicContact CG2-CB 4.39Å; T211-V274 HydrophobicContact CG2-CG2 3.64Å; T211-D275 WeakPolarHBondContact CA-OD2 3.47Å; T211-D275 WeakPolarHBondContact CG2-OD2 3.37Å
212	H	93.4	Very high	93.4	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.116	C	C	.	.			trans	-79.7	-38.8	-174.1	-168.7	-82.8	0	0	0	112.7	D214 L215 I233 T234 F236 D275	H212-D214 PolarHBondContact CE1-O 3.3Å; H212-D214 VanDerWaalsContact ND1-C 3.27Å; H212-D214 PolarHBondContact ND1-O 2.6Å; H212-D214 PolarHBondContact O-N 2.89Å; H212-L215 HydrophobicContact CB-CD2 4.08Å; H212-L215 HydrophobicContact CB-CG 3.91Å; H212-L215 PolarHBondContact ND1-N 2.88Å; H212-I233 WeakPolarHBondContact NE2-CG2 3.39Å; H212-T234 PolarHBondContact NE2-O 3.46Å; H212-F236 AromaticContact CD2-CD1 3.64Å; H212-F236 AromaticContact CD2-CE1 3.47Å; H212-F236 VanDerWaalsContact CD2-CE1 3.47Å; H212-F236 WeakPolarHBondContact CD2-CE1 3.46Å; H212-D275 WeakPolarHBondContact CB-OD1 3.44Å; H212-D275 PolarHBondContact N-OD1 3.24Å; H212-D275 PolarHBondContact N-OD2 2.82Å
213	R	90.1	Very high	93.2	Very high	39 Å²	39	26.2 Å²	26.2	15%	0.147	13%	0.13	C	C	.	.	S	Bend	trans	61.7	-11.5	176.7	-52.9	-167.6	-66.8	177.8	-5.3	117.2	T211 L238 A239 Y270 V274 D275	T211-R213 HydrophobicContact CG2-CG 3.7Å; R213-L238 VanDerWaalsContact CZ-O 3.26Å; R213-L238 PolarHBondContact NE-O 3.07Å; R213-L238 PolarHBondContact NH2-O 3.16Å; R213-A239 PolarHBondContact NH2-O 3.08Å; R213-Y270 WeakPolarHBondContact CD-OH 3.29Å; R213-Y270 HydrophobicContact CG-CE2 4.31Å; R213-Y270 PolarHBondContact NH1-OH 3.22Å; R213-V274 HydrophobicContact CG-CG2 4.41Å; R213-D275 PolarHBondContact N-OD1 3.37Å
214	D	89.6	Confident	93	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.021	13%	0.129	C	C	.	.			trans	-132.5	42.3	175.7	-164	40.9	0	0	0	111.8	K7 H212 K216 N219 L238	K7-D214 WeakPolarHBondContact CE-OD2 3.44Å; K7-D214 IonicContact NZ-OD2 2.85Å; K7-D214 PolarHBondContact NZ-OD2 3.44Å; H212-D214 PolarHBondContact CE1-O 3.3Å; H212-D214 VanDerWaalsContact ND1-C 3.27Å; H212-D214 PolarHBondContact ND1-O 2.6Å; H212-D214 PolarHBondContact O-N 2.89Å; D214-K216 PolarHBondContact O-N 3.45Å; D214-K216 IonicContact OD1-NZ 3.72Å; D214-K216 PolarHBondContact OD1-NZ 3.39Å; D214-K216 WeakPolarHBondContact OD2-CE 3.27Å; D214-K216 IonicContact OD2-NZ 2.85Å; D214-K216 PolarHBondContact OD2-NZ 3.31Å; D214-N219 PolarHBondContact O-ND2 3.42Å; D214-N219 PolarHBondContact OD2-ND2 2.91Å; D214-L238 HydrophobicContact CB-CB 4.04Å; D214-L238 HydrophobicContact CB-CD1 3.89Å
215	L	94	Very high	92.6	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	15%	0.152	C	C	.	.			trans	-69.3	124.6	172.1	-73.6	177.9	0	0	0	109.9	V202 H212 I233 D275 A278 L279 I282	V202-L215 HydrophobicContact CG2-CD1 3.72Å; V202-L215 HydrophobicContact CG2-CD2 4.47Å; H212-L215 HydrophobicContact CB-CD2 4.08Å; H212-L215 HydrophobicContact CB-CG 3.91Å; H212-L215 PolarHBondContact ND1-N 2.88Å; L215-I233 HydrophobicContact CD2-CG2 3.92Å; L215-D275 HydrophobicContact CD1-CB 3.68Å; L215-A278 HydrophobicContact CB-CB 3.86Å; L215-L279 HydrophobicContact CD1-CD2 4.14Å; L215-L279 HydrophobicContact CD1-CG 4.11Å; L215-I282 HydrophobicContact CB-CD1 4.33Å
216	K	90.3	Very high	92.2	Very high	8 Å²	8	29.3 Å²	29.3	4%	0.035	16%	0.162	C	C	.	.			trans	-164	162.5	178.1	61.3	-174.4	173.7	-138.8	0	110.2	D214 E218 N219 L220 T256 Y259	D214-K216 PolarHBondContact O-N 3.45Å; D214-K216 IonicContact OD1-NZ 3.72Å; D214-K216 PolarHBondContact OD1-NZ 3.39Å; D214-K216 WeakPolarHBondContact OD2-CE 3.27Å; D214-K216 IonicContact OD2-NZ 2.85Å; D214-K216 PolarHBondContact OD2-NZ 3.31Å; K216-E218 VanDerWaalsContact C-N 3.25Å; K216-E218 WeakPolarHBondContact CB-OE2 3.36Å; K216-E218 WeakPolarHBondContact CD-OE2 3.34Å; K216-E218 HydrophobicContact CG-CB 4.35Å; K216-E218 VanDerWaalsContact CG-OE2 3.26Å; K216-E218 WeakPolarHBondContact CG-OE2 3.44Å; K216-E218 PolarHBondContact O-N 3.24Å; K216-N219 HydrophobicContact CG-CB 4.27Å; K216-N219 PolarHBondContact O-N 3.4Å; K216-L220 PolarHBondContact O-N 3.03Å; K216-T256 WeakPolarHBondContact CD-OG1 3.47Å; K216-T256 PolarHBondContact NZ-OG1 3.05Å; K216-Y259 HydrophobicContact CB-CD1 4.4Å; K216-Y259 HydrophobicContact CB-CD2 3.99Å; K216-Y259 HydrophobicContact CB-CE1 4.41Å; K216-Y259 HydrophobicContact CB-CE2 3.96Å; K216-Y259 HydrophobicContact CB-CG 4.22Å
217	P	87.7	Confident	91.7	Very high	7 Å²	7	34.5 Å²	34.5	5%	0.045	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-54.6	-36.8	-176.6	-25.4	34.2	0	0	0	114.3	F177 N219 L220 Y259	F177-P217 HydrophobicContact CD2-CB 3.72Å; F177-P217 HydrophobicContact CD2-CG 3.83Å; F177-P217 HydrophobicContact CE1-CB 4.49Å; F177-P217 HydrophobicContact CE1-CG 4.38Å; F177-P217 HydrophobicContact CE2-CB 3.59Å; F177-P217 HydrophobicContact CE2-CG 3.16Å; F177-P217 HydrophobicContact CG-CB 4.25Å; F177-P217 HydrophobicContact CZ-CB 3.99Å; F177-P217 HydrophobicContact CZ-CG 3.48Å; F177-P217 VanDerWaalsContact CZ-CG 3.48Å; P217-N219 PolarHBondContact O-N 3.26Å; P217-L220 PolarHBondContact O-N 2.87Å; P217-Y259 VanDerWaalsContact CD-CZ 3.5Å; P217-Y259 VanDerWaalsContact CD-OH 3.29Å; P217-Y259 WeakPolarHBondContact CD-OH 3.48Å; P217-Y259 HydrophobicContact CG-CE1 4.26Å
218	E	87.6	Confident	91.4	Very high	52 Å²	52	35.1 Å²	35.1	24%	0.243	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-62	-24.1	178.8	-57.4	93	145.9	0	0	112.7	E175 K216 R378	E175-E218 WeakPolarHBondContact OE2-CA 3.47Å; K216-E218 VanDerWaalsContact C-N 3.25Å; K216-E218 WeakPolarHBondContact CB-OE2 3.36Å; K216-E218 WeakPolarHBondContact CD-OE2 3.34Å; K216-E218 HydrophobicContact CG-CB 4.35Å; K216-E218 VanDerWaalsContact CG-OE2 3.26Å; K216-E218 WeakPolarHBondContact CG-OE2 3.44Å; K216-E218 PolarHBondContact O-N 3.24Å; E218-R378 IonicContact OE1-NH1 3.85Å
219	N	92.8	Very high	91.4	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.016	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-99	-0.4	179.7	-71	-9.4	0	0	0	113	D214 K216 P217 T234	D214-N219 PolarHBondContact O-ND2 3.42Å; D214-N219 PolarHBondContact OD2-ND2 2.91Å; K216-N219 HydrophobicContact CG-CB 4.27Å; K216-N219 PolarHBondContact O-N 3.4Å; P217-N219 PolarHBondContact O-N 3.26Å; N219-T234 WeakPolarHBondContact CA-OG1 3.46Å; N219-T234 WeakPolarHBondContact CB-O 3.49Å; N219-T234 PolarHBondContact O-N 2.94Å; N219-T234 PolarHBondContact O-OG1 3.2Å
220	L	95.8	Very high	91.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	103.5	177.5	-64.3	-178.6	0	0	0	110.2	L176 V198 K216 P217 I231 I233 I282	L176-L220 HydrophobicContact CB-CB 4.19Å; L176-L220 HydrophobicContact CD2-CB 4.4Å; L176-L220 HydrophobicContact CD2-CD1 3.92Å; L176-L220 PolarHBondContact N-O 2.88Å; V198-L220 HydrophobicContact CG1-CD1 4.34Å; V198-L220 HydrophobicContact CG1-CD2 4.03Å; V198-L220 HydrophobicContact CG2-CD1 4.01Å; V198-L220 HydrophobicContact CG2-CD2 4.06Å; K216-L220 PolarHBondContact O-N 3.03Å; P217-L220 PolarHBondContact O-N 2.87Å; L220-I231 HydrophobicContact CD2-CG2 4.47Å; L220-I233 HydrophobicContact CD2-CB 4.49Å; L220-I233 HydrophobicContact CD2-CG1 3.87Å; L220-I282 HydrophobicContact CD1-CD1 4.11Å; L220-I282 HydrophobicContact CD1-CG2 4.24Å
221	L	94.9	Very high	91.7	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.016	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	141.2	-170.5	-52.3	-174.4	0	0	0	112	M1 A171 E175 I231 M232 T234	M1-L221 HydrophobicContact CB-CD1 4.22Å; M1-L221 HydrophobicContact CG-CD1 3.63Å; M1-L221 HydrophobicContact SD-CD1 3.88Å; A171-L221 HydrophobicContact CB-CB 3.76Å; A171-L221 HydrophobicContact CB-CD1 3.77Å; A171-L221 HydrophobicContact CB-CG 4.44Å; E175-L221 HydrophobicContact CB-CD2 4.06Å; E175-L221 HydrophobicContact CG-CD2 3.7Å; L221-I231 CarbonylContact O-C 3.54Å; L221-M232 PolarHBondContact N-O 2.96Å; L221-M232 PolarHBondContact O-N 3.32Å; L221-T234 HydrophobicContact CB-CG2 4.37Å; L221-T234 HydrophobicContact CD1-CG2 3.93Å; L221-T234 HydrophobicContact CG-CG2 4.01Å
222	Y	95.6	Very high	91.9	Very high	14 Å²	14	33.2 Å²	33.2	6%	0.055	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	140.4	169.3	-74.7	-82.2	0	0	0	110.9	G173 G174 L176 R179 V194 S229 K230 I231	G173-Y222 WeakPolarHBondContact CA-O 3.25Å; G173-Y222 PolarHBondContact N-O 3.48Å; G174-Y222 PolarHBondContact O-N 3Å; L176-Y222 HydrophobicContact CD1-CE2 3.87Å; R179-Y222 HydrophobicContact CB-CD2 3.97Å; R179-Y222 HydrophobicContact CB-CE2 3.72Å; R179-Y222 VanDerWaalsContact CD-CZ 3.49Å; R179-Y222 HydrophobicContact CG-CD2 4.44Å; R179-Y222 HydrophobicContact CG-CE2 4.12Å; R179-Y222 VanDerWaalsContact CZ-CD1 3.44Å; R179-Y222 VanDerWaalsContact NE-CD2 3.32Å; R179-Y222 VanDerWaalsContact NE-CG 3.34Å; V194-Y222 VanDerWaalsContact CG2-OH 3.31Å; V194-Y222 WeakPolarHBondContact CG2-OH 3.31Å; Y222-S229 WeakPolarHBondContact CD1-O 3.17Å; Y222-K230 WeakPolarHBondContact CA-O 3.45Å; Y222-I231 HydrophobicContact CD1-CD1 3.66Å; Y222-I231 HydrophobicContact CD1-CG1 3.94Å; Y222-I231 HydrophobicContact CD2-CD1 3.64Å; Y222-I231 HydrophobicContact CE1-CD1 3.59Å; Y222-I231 HydrophobicContact CE1-CG1 3.65Å; Y222-I231 HydrophobicContact CE2-CD1 3.56Å; Y222-I231 HydrophobicContact CE2-CG1 4.46Å; Y222-I231 HydrophobicContact CG-CD1 3.7Å; Y222-I231 HydrophobicContact CG-CG1 4.48Å
223	Y	94.4	Very high	92.1	Very high	76 Å²	76	33.1 Å²	33.1	30%	0.298	18%	0.179	S	C	.	.	S	Bend	trans	-67.1	-49.5	-176.1	177.7	-132.3	0	0	0	113.1	T172 S229 K230 M232	T172-Y223 PolarHBondContact N-O 3.45Å; T172-Y223 PolarHBondContact OG1-O 3.35Å; Y223-S229 PolarHBondContact N-OG 3.24Å; Y223-K230 HydrophobicContact CD1-CD 4.48Å; Y223-K230 HydrophobicContact CD1-CG 4.26Å; Y223-K230 HydrophobicContact CG-CG 4.2Å; Y223-K230 PolarHBondContact N-O 3.27Å; Y223-M232 HydrophobicContact CD2-CE 3.79Å; Y223-M232 HydrophobicContact CD2-SD 4Å; Y223-M232 HydrophobicContact CG-CE 4.32Å; Y223-M232 HydrophobicContact CG-SD 4.33Å
224	H	93.1	Very high	92.2	Very high	59 Å²	59	31.7 Å²	31.7	27%	0.273	18%	0.175	S	C	.	.	S	Bend	trans	-133.8	165.7	175.5	61.7	119.8	0	0	0	111	T172 G173 R179 G226 D228 S229	T172-H224 WeakPolarHBondContact OG1-CA 3.28Å; G173-H224 VanDerWaalsContact CA-O 3.31Å; G173-H224 WeakPolarHBondContact CA-O 3.36Å; R179-H224 PolarHBondContact NH2-O 2.91Å; H224-G226 PolarHBondContact O-N 3.43Å; H224-D228 IonicContact CE1-OD1 2.63Å; H224-D228 PolarHBondContact CE1-OD1 2.86Å; H224-D228 IonicContact CE1-OD2 2.97Å; H224-D228 PolarHBondContact CE1-OD2 2.85Å; H224-D228 IonicContact NE2-OD1 2.71Å; H224-D228 IonicContact NE2-OD2 2.79Å; H224-S229 VanDerWaalsContact CD2-CB 3.46Å; H224-S229 WeakPolarHBondContact CD2-CB 3.08Å; H224-S229 PolarHBondContact CD2-OG 3.5Å; H224-S229 VanDerWaalsContact CD2-OG 3.28Å; H224-S229 PolarHBondContact N-OG 3.31Å; H224-S229 VanDerWaalsContact NE2-CA 3.31Å; H224-S229 WeakPolarHBondContact NE2-CA 3.37Å; H224-S229 WeakPolarHBondContact NE2-CB 3.4Å; H224-S229 WeakPolarHBondContact O-CB 3.28Å; H224-S229 PolarHBondContact O-OG 2.83Å
225	P	89.6	Confident	92	Very high	105 Å²	105	32.4 Å²	32.4	68%	0.682	18%	0.178	S	C	*	.	S	Bend	trans	-70	-5.1	179.4	25.4	-34.8	0	0	0	115.4	R179	R179-P225 PolarHBondContact NH2-O 2.87Å
226	G	88.3	Confident	91.7	Very high	22 Å²	22	32.3 Å²	32.3	23%	0.227	18%	0.178	C	C	.	.	S	Bend	trans	-62.7	155.8	179.9	0	0	0	0	0	114.6	R179 H224 D228 S229	R179-G226 VanDerWaalsContact CZ-O 3.26Å; R179-G226 PolarHBondContact NH1-O 2.82Å; R179-G226 PolarHBondContact NH2-O 3.09Å; H224-G226 PolarHBondContact O-N 3.43Å; G226-D228 VanDerWaalsContact C-N 3.28Å; G226-D228 VanDerWaalsContact C-OD1 3.28Å; G226-D228 WeakPolarHBondContact CA-OD1 3.48Å; G226-D228 PolarHBondContact O-N 2.91Å; G226-S229 WeakPolarHBondContact O-CB 3.43Å; G226-S229 PolarHBondContact O-N 2.83Å
227	T	84.7	Confident	91.1	Very high	137 Å²	137	32.3 Å²	32.3	84%	0.84	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-25.2	-179	46.3	0	0	0	0	113.4
228	D	87.8	Confident	90.6	Very high	125 Å²	125	33 Å²	33	67%	0.668	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-12.9	173.9	59.6	-38.7	0	0	0	114.4	H224 G226 K230	H224-D228 IonicContact CE1-OD1 2.63Å; H224-D228 PolarHBondContact CE1-OD1 2.86Å; H224-D228 IonicContact CE1-OD2 2.97Å; H224-D228 PolarHBondContact CE1-OD2 2.85Å; H224-D228 IonicContact NE2-OD1 2.71Å; H224-D228 IonicContact NE2-OD2 2.79Å; G226-D228 VanDerWaalsContact C-N 3.28Å; G226-D228 VanDerWaalsContact C-OD1 3.28Å; G226-D228 WeakPolarHBondContact CA-OD1 3.48Å; G226-D228 PolarHBondContact O-N 2.91Å; D228-K230 PolarHBondContact O-N 2.94Å
229	S	93.6	Very high	90.2	Very high	4 Å²	4	30.6 Å²	30.6	3%	0.028	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-58.9	129.4	-169.8	-179.9	0	0	0	0	115.7	Y222 Y223 H224 G226	Y222-S229 WeakPolarHBondContact CD1-O 3.17Å; Y223-S229 PolarHBondContact N-OG 3.24Å; H224-S229 VanDerWaalsContact CD2-CB 3.46Å; H224-S229 WeakPolarHBondContact CD2-CB 3.08Å; H224-S229 PolarHBondContact CD2-OG 3.5Å; H224-S229 VanDerWaalsContact CD2-OG 3.28Å; H224-S229 PolarHBondContact N-OG 3.31Å; H224-S229 VanDerWaalsContact NE2-CA 3.31Å; H224-S229 WeakPolarHBondContact NE2-CA 3.37Å; H224-S229 WeakPolarHBondContact NE2-CB 3.4Å; H224-S229 WeakPolarHBondContact O-CB 3.28Å; H224-S229 PolarHBondContact O-OG 2.83Å; G226-S229 WeakPolarHBondContact O-CB 3.43Å; G226-S229 PolarHBondContact O-N 2.83Å
230	K	94.4	Very high	89.6	Confident	36 Å²	36	32 Å²	32	16%	0.157	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-63.8	143.4	173.7	66.9	174.1	-172.6	159.1	0	112.5	T149 E169 M197 Y222 Y223 D228 M232	T149-K230 WeakPolarHBondContact O-CD 3.41Å; T149-K230 PolarHBondContact O-NZ 3.01Å; E169-K230 IonicContact OE1-NZ 2.79Å; E169-K230 PolarHBondContact OE1-NZ 2.95Å; E169-K230 IonicContact OE2-NZ 3.23Å; M197-K230 HydrophobicContact SD-CB 4.27Å; Y222-K230 WeakPolarHBondContact CA-O 3.45Å; Y223-K230 HydrophobicContact CD1-CD 4.48Å; Y223-K230 HydrophobicContact CD1-CG 4.26Å; Y223-K230 HydrophobicContact CG-CG 4.2Å; Y223-K230 PolarHBondContact N-O 3.27Å; D228-K230 PolarHBondContact O-N 2.94Å; K230-M232 HydrophobicContact CD-CG 4.26Å; K230-M232 HydrophobicContact CD-SD 4.49Å; K230-M232 WeakPolarHBondContact CE-SD 3.26Å; K230-M232 HydrophobicContact CG-CG 4.28Å
231	I	95.5	Very high	88.6	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	142.6	160.6	-76.3	-72.3	0	0	0	109.6	N150 L176 V194 M197 V198 L220 L221 Y222	N150-I231 WeakPolarHBondContact CA-O 3.43Å; N150-I231 WeakPolarHBondContact CB-O 3.44Å; N150-I231 PolarHBondContact ND2-O 3.24Å; L176-I231 HydrophobicContact CD1-CD1 4.09Å; V194-I231 HydrophobicContact CG1-CG1 4.48Å; M197-I231 HydrophobicContact CB-CB 4.31Å; M197-I231 HydrophobicContact CE-CB 4.09Å; M197-I231 HydrophobicContact CE-CG1 3.96Å; M197-I231 HydrophobicContact SD-CB 4.39Å; M197-I231 PolarHBondContact SD-N 3.21Å; M197-I231 VanDerWaalsContact SD-N 3.43Å; V198-I231 HydrophobicContact CG2-CG2 3.6Å; L220-I231 HydrophobicContact CD2-CG2 4.47Å; L221-I231 CarbonylContact O-C 3.54Å; Y222-I231 HydrophobicContact CD1-CD1 3.66Å; Y222-I231 HydrophobicContact CD1-CG1 3.94Å; Y222-I231 HydrophobicContact CD2-CD1 3.64Å; Y222-I231 HydrophobicContact CE1-CD1 3.59Å; Y222-I231 HydrophobicContact CE1-CG1 3.65Å; Y222-I231 HydrophobicContact CE2-CD1 3.56Å; Y222-I231 HydrophobicContact CE2-CG1 4.46Å; Y222-I231 HydrophobicContact CG-CD1 3.7Å; Y222-I231 HydrophobicContact CG-CG1 4.48Å
232	M	96.4	Very high	87.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137	172.5	-56.7	-178.1	-58.8	0	0	110.9	N150 I152 A171 L221 Y223 K230	N150-M232 WeakPolarHBondContact O-CA 3.44Å; I152-M232 HydrophobicContact CD1-CE 3.47Å; I152-M232 VanDerWaalsContact CD1-CE 3.47Å; I152-M232 HydrophobicContact CD1-SD 3.94Å; A171-M232 HydrophobicContact CB-CE 3.6Å; L221-M232 PolarHBondContact N-O 2.96Å; L221-M232 PolarHBondContact O-N 3.32Å; Y223-M232 HydrophobicContact CD2-CE 3.79Å; Y223-M232 HydrophobicContact CD2-SD 4Å; Y223-M232 HydrophobicContact CG-CE 4.32Å; Y223-M232 HydrophobicContact CG-SD 4.33Å; K230-M232 HydrophobicContact CD-CG 4.26Å; K230-M232 HydrophobicContact CD-SD 4.49Å; K230-M232 WeakPolarHBondContact CE-SD 3.26Å; K230-M232 HydrophobicContact CG-CG 4.28Å
233	I	97.1	Very high	85.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	136	170.4	-58	168	0	0	0	109.1	N150 I152 V198 V202 L205 H212 L215 L220 F236	N150-I233 PolarHBondContact O-N 2.8Å; I152-I233 WeakPolarHBondContact CG2-O 3.17Å; I152-I233 PolarHBondContact N-O 3.27Å; I152-I233 VanDerWaalsContact N-O 3.09Å; V198-I233 HydrophobicContact CG1-CD1 4.37Å; V198-I233 HydrophobicContact CG1-CG1 4.46Å; V202-I233 HydrophobicContact CG2-CD1 3.76Å; L205-I233 HydrophobicContact CD1-CD1 4.44Å; H212-I233 WeakPolarHBondContact NE2-CG2 3.39Å; L215-I233 HydrophobicContact CD2-CG2 3.92Å; L220-I233 HydrophobicContact CD2-CB 4.49Å; L220-I233 HydrophobicContact CD2-CG1 3.87Å; I233-F236 HydrophobicContact CG2-CZ 4.21Å
234	T	93.2	Very high	83	Confident	9 Å²	9	52.3 Å²	52.3	6%	0.055	27%	0.273	C	S	.	.			trans	-140.6	165.2	-171.5	71.6	0	0	0	0	113.5	I152 H212 N219 L221	I152-T234 HydrophobicContact CB-CG2 4.02Å; I152-T234 HydrophobicContact CD1-CG2 4.49Å; I152-T234 HydrophobicContact CG1-CG2 4.49Å; I152-T234 HydrophobicContact CG2-CG2 4.15Å; H212-T234 PolarHBondContact NE2-O 3.46Å; N219-T234 WeakPolarHBondContact CA-OG1 3.46Å; N219-T234 WeakPolarHBondContact CB-O 3.49Å; N219-T234 PolarHBondContact O-N 2.94Å; N219-T234 PolarHBondContact O-OG1 3.2Å; L221-T234 HydrophobicContact CB-CG2 4.37Å; L221-T234 HydrophobicContact CD1-CG2 3.93Å; L221-T234 HydrophobicContact CG-CG2 4.01Å
235	D	86	Confident	80.9	Confident	18 Å²	18	53.9 Å²	53.9	10%	0.096	31%	0.305	C	S	.	.			trans	65.9	62.8	176.2	-160.9	33.5	0	0	0	116.1	K7 K123 G237	K7-D235 IonicContact NZ-OD2 2.64Å; K7-D235 PolarHBondContact NZ-OD2 3.29Å; K123-D235 IonicContact NZ-OD1 3.96Å; K123-D235 PolarHBondContact NZ-OD1 2.86Å; D235-G237 PolarHBondContact O-N 2.99Å
236	F	86.4	Confident	79	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-70.8	10.8	177.8	-65.9	-83.7	0	0	0	115	E139 V142 L143 I151 I152 L205 H212 I233 L238 A239	E139-F236 HydrophobicContact CG-CB 4.25Å; V142-F236 HydrophobicContact CB-CB 4.36Å; V142-F236 HydrophobicContact CB-CD1 4.42Å; V142-F236 HydrophobicContact CB-CG 4.45Å; V142-F236 HydrophobicContact CG1-CB 4.26Å; V142-F236 HydrophobicContact CG1-CD1 3.52Å; V142-F236 HydrophobicContact CG1-CD2 4.46Å; V142-F236 HydrophobicContact CG1-CE1 3.89Å; V142-F236 HydrophobicContact CG1-CG 3.83Å; L143-F236 HydrophobicContact CD2-CD2 3.63Å; L143-F236 HydrophobicContact CD2-CE2 3.94Å; L143-F236 HydrophobicContact CG-CD2 4.22Å; I151-F236 HydrophobicContact CG2-CE2 3.75Å; I151-F236 HydrophobicContact CG2-CZ 3.62Å; I152-F236 HydrophobicContact CG2-CE2 4.22Å; L205-F236 HydrophobicContact CD1-CE1 3.78Å; L205-F236 HydrophobicContact CD1-CZ 4.25Å; L205-F236 HydrophobicContact CD2-CE1 3.62Å; L205-F236 HydrophobicContact CD2-CZ 4.13Å; L205-F236 HydrophobicContact CG-CE1 4.36Å; H212-F236 AromaticContact CD2-CD1 3.64Å; H212-F236 AromaticContact CD2-CE1 3.47Å; H212-F236 VanDerWaalsContact CD2-CE1 3.47Å; H212-F236 WeakPolarHBondContact CD2-CE1 3.46Å; I233-F236 HydrophobicContact CG2-CZ 4.21Å; F236-L238 PolarHBondContact O-N 3.06Å; F236-A239 HydrophobicContact CB-CB 4.05Å; F236-A239 HydrophobicContact CD1-CB 4.05Å; F236-A239 VanDerWaalsContact O-CB 3.23Å; F236-A239 WeakPolarHBondContact O-CB 3.24Å; F236-A239 PolarHBondContact O-N 3.31Å
237	G	78.6	Confident	77.3	Confident	8 Å²	8	59.1 Å²	59.1	8%	0.082	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-62.5	-11.2	-178.9	0	0	0	0	0	115.8	D235	D235-G237 PolarHBondContact O-N 2.99Å
238	L	76.6	Confident	75.9	Confident	23 Å²	23	55.3 Å²	55.3	12%	0.12	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-114.6	6	170.2	-75.1	-175.2	0	0	0	113.9	K7 R213 D214 F236 C254	K7-L238 HydrophobicContact CB-CD1 3.83Å; K7-L238 HydrophobicContact CD-CD1 3.48Å; K7-L238 VanDerWaalsContact CD-CD1 3.48Å; K7-L238 HydrophobicContact CD-CG 4.01Å; K7-L238 HydrophobicContact CG-CD1 4.32Å; R213-L238 VanDerWaalsContact CZ-O 3.26Å; R213-L238 PolarHBondContact NE-O 3.07Å; R213-L238 PolarHBondContact NH2-O 3.16Å; D214-L238 HydrophobicContact CB-CB 4.04Å; D214-L238 HydrophobicContact CB-CD1 3.89Å; F236-L238 PolarHBondContact O-N 3.06Å; L238-C254 HydrophobicContact CD1-CB 4.04Å; L238-C254 HydrophobicContact CD2-CB 4.06Å
239	A	80.1	Confident	74.4	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.008	29%	0.289	C	S	.	.			trans	-62.7	169.4	-179	0	0	0	0	0	112.3	S138 V142 T211 R213 F236	S138-A239 PolarHBondContact OG-O 3.2Å; V142-A239 HydrophobicContact CG2-CB 3.88Å; T211-A239 CarbonylContact O-C 3.55Å; T211-A239 VanDerWaalsContact O-CA 3.28Å; T211-A239 WeakPolarHBondContact O-CA 3.47Å; R213-A239 PolarHBondContact NH2-O 3.08Å; F236-A239 HydrophobicContact CB-CB 4.05Å; F236-A239 HydrophobicContact CD1-CB 4.05Å; F236-A239 VanDerWaalsContact O-CB 3.23Å; F236-A239 WeakPolarHBondContact O-CB 3.24Å; F236-A239 PolarHBondContact O-N 3.31Å
240	S	80.5	Confident	73.1	Confident	31 Å²	31	54 Å²	54	22%	0.217	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	131.4	167.6	-179	0	0	0	0	109.2	I210 T211	I210-S240 CarbonylContact C-O 3.57Å; I210-S240 WeakPolarHBondContact CA-O 3.33Å; T211-S240 PolarHBondContact N-O 2.95Å; T211-S240 PolarHBondContact O-N 3.43Å
241	A	73.6	Confident	71.2	Confident	23 Å²	23	60 Å²	60	19%	0.19	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.6	170.7	0	0	0	0	0	109.2	I210 K243	I210-A241 HydrophobicContact CG1-CB 4.06Å; A241-K243 PolarHBondContact O-N 3.02Å
242	R	65.1	Low	69.5	Low	114 Å²	114	64 Å²	64	43%	0.43	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-56.3	133.5	174.4	-75.9	-178.3	167.7	-172.7	-5.5	110.8	G209 C248	G209-R242 PolarHBondContact O-N 3.29Å; R242-C248 VanDerWaalsContact NH2-CB 3.32Å; R242-C248 PolarHBondContact NH2-O 3.38Å; R242-C248 PolarHBondContact NH2-SG 3.29Å; R242-C248 VanDerWaalsContact NH2-SG 3.38Å
243	K	57.8	Low	67.7	Low	162 Å²	162	65.8 Å²	65.8	70%	0.704	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-82.7	145.3	161.9	-67.9	177.3	178.9	178.4	0	108.4	A241 G245 D246	A241-K243 PolarHBondContact O-N 3.02Å; K243-G245 PolarHBondContact O-N 3.41Å; K243-D246 HydrophobicContact CB-CB 4.12Å; K243-D246 PolarHBondContact O-N 3.19Å
244	K	44.4	Very low	66.1	Low	221 Å²	221	66.1 Å²	66.1	96%	0.961	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	131.9	171.8	-85.5	-172	170.9	-173.8	0	109	D246	K244-D246 VanDerWaalsContact C-N 3.33Å
245	G	49.5	Very low	64.5	Low	92 Å²	92	66.5 Å²	66.5	95%	0.948	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	-0.7	179.3	0	0	0	0	0	115.6	K243	K243-G245 PolarHBondContact O-N 3.41Å
246	D	50.3	Low	63.8	Low	112 Å²	112	67 Å²	67	60%	0.599	37%	0.367	S	S	*	.	S	Bend	trans	-86	141.1	170.6	-161.3	3	0	0	0	109.6	K243 K244	K243-D246 HydrophobicContact CB-CB 4.12Å; K243-D246 PolarHBondContact O-N 3.19Å; K244-D246 VanDerWaalsContact C-N 3.33Å
247	D	51	Low	63.3	Low	126 Å²	126	68.5 Å²	68.5	67%	0.674	38%	0.376	S	S	*	.			trans	-68.4	153	-175.2	-146.8	-18.8	0	0	0	110.3	L249	D247-L249 PolarHBondContact O-N 2.77Å
248	C	55.1	Low	63.5	Low	57 Å²	57	69.9 Å²	69.9	39%	0.385	38%	0.38	S	S	.	.	S	Bend	trans	-71	16.8	-154.3	-84.5	0	0	0	0	117.3	R242	R242-C248 VanDerWaalsContact NH2-CB 3.32Å; R242-C248 PolarHBondContact NH2-O 3.38Å; R242-C248 PolarHBondContact NH2-SG 3.29Å; R242-C248 VanDerWaalsContact NH2-SG 3.38Å
249	L	56.8	Low	64.1	Low	78 Å²	78	69.4 Å²	69.4	41%	0.408	38%	0.377	S	S	.	.			trans	-142.5	92.6	-136.4	-74.1	-173	0	0	0	113	D247 P269 T271	D247-L249 PolarHBondContact O-N 2.77Å; L249-P269 HydrophobicContact CB-CB 3.57Å; L249-P269 HydrophobicContact CD1-CB 4.3Å; L249-P269 HydrophobicContact CD2-CB 4.17Å; L249-P269 HydrophobicContact CG-CB 4.22Å; L249-T271 HydrophobicContact CD2-CG2 4.41Å
250	M	66.7	Low	64.5	Low	23 Å²	23	70 Å²	70	11%	0.113	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-78.8	142.8	-175.1	-56	-178	-169.8	0	0	112.8	T211 P269 Y270	T211-M250 WeakPolarHBondContact OG1-CE 3.47Å; M250-P269 CarbonylContact O-C 3.52Å; M250-P269 WeakPolarHBondContact O-CA 3.24Å; M250-Y270 HydrophobicContact CB-CD1 4.31Å; M250-Y270 HydrophobicContact CB-CD2 3.82Å; M250-Y270 HydrophobicContact CB-CE1 4.04Å; M250-Y270 HydrophobicContact CB-CE2 3.49Å; M250-Y270 VanDerWaalsContact CB-CE2 3.49Å; M250-Y270 HydrophobicContact CB-CG 4.21Å; M250-Y270 HydrophobicContact CG-CD2 4.45Å; M250-Y270 HydrophobicContact CG-CE2 4.16Å; M250-Y270 PolarHBondContact N-O 3.28Å; M250-Y270 WeakPolarHBondContact O-CD1 3.34Å; M250-Y270 WeakPolarHBondContact O-CE1 3.16Å; M250-Y270 PolarHBondContact O-N 2.98Å; M250-Y270 HydrophobicContact SD-CD2 4.29Å; M250-Y270 HydrophobicContact SD-CE2 3.75Å
251	K	53.6	Low	65	Low	161 Å²	161	68.5 Å²	68.5	70%	0.7	37%	0.37	S	S	*	.			trans	-116.9	-6.3	-172.4	-64.2	173.3	-175.4	170.3	0	116	P269	K251-P269 HydrophobicContact CG-CB 4.29Å; K251-P269 HydrophobicContact CG-CG 4.34Å
252	T	59.8	Low	65.9	Low	84 Å²	84	67.6 Å²	67.6	52%	0.515	36%	0.362	S	S	.	.			trans	-79.5	130.2	-174.4	-38.7	0	0	0	0	112.7	Y270	T252-Y270 VanDerWaalsContact O-CE1 3.29Å; T252-Y270 WeakPolarHBondContact O-CE1 3.42Å; T252-Y270 PolarHBondContact O-OH 3.3Å
253	T	58.8	Low	67	Low	38 Å²	38	62.6 Å²	62.6	23%	0.233	34%	0.343	C	S	.	.			trans	-84.9	108.8	169.3	52.5	0	0	0	0	111.4	I264 R267	T253-I264 HydrophobicContact CG2-CG2 4.14Å; T253-R267 HydrophobicContact CG2-CG 3.93Å
254	C	63.7	Low	68.4	Low	8 Å²	8	55.1 Å²	55.1	5%	0.054	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-143.9	171.2	178	59.8	0	0	0	0	111.6	L238	L238-C254 HydrophobicContact CD1-CB 4.04Å; L238-C254 HydrophobicContact CD2-CB 4.06Å
255	G	60.6	Low	70.4	Confident	17 Å²	17	46.5 Å²	46.5	18%	0.175	28%	0.275	C	S	.	.	S	Bend	trans	104.8	169.2	176.9	0	0	0	0	0	114.7
256	T	71.1	Confident	72	Confident	29 Å²	29	43.4 Å²	43.4	18%	0.178	24%	0.238	C	C	.	.			trans	-72.4	128.3	175.5	-70.6	0	0	0	0	110.7	K216 E258 Y259 I260	K216-T256 WeakPolarHBondContact CD-OG1 3.47Å; K216-T256 PolarHBondContact NZ-OG1 3.05Å; T256-E258 WeakPolarHBondContact CG2-OE2 3.18Å; T256-E258 PolarHBondContact O-N 2.76Å; T256-Y259 HydrophobicContact CG2-CD2 3.64Å; T256-Y259 HydrophobicContact CG2-CE2 3.89Å; T256-Y259 PolarHBondContact O-N 3.37Å; T256-Y259 VanDerWaalsContact O-N 3.07Å; T256-I260 PolarHBondContact O-N 3.09Å
257	P	75.5	Confident	73.3	Confident	30 Å²	30	46.1 Å²	46.1	20%	0.195	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.6	-169.7	-29.5	36.2	0	0	0	117.3	I260 Y302	P257-I260 WeakPolarHBondContact O-CG2 3.43Å; P257-Y302 HydrophobicContact CB-CE1 4.42Å
258	E	83.3	Confident	74.5	Confident	38 Å²	38	46.3 Å²	46.3	18%	0.178	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-5.5	-178.1	-40.7	92.4	100	0	0	114.3	T256 M291 L301 R378	T256-E258 WeakPolarHBondContact CG2-OE2 3.18Å; T256-E258 PolarHBondContact O-N 2.76Å; E258-M291 HydrophobicContact CB-CE 3.44Å; E258-M291 VanDerWaalsContact CB-CE 3.44Å; E258-M291 HydrophobicContact CG-CE 4.44Å; E258-L301 HydrophobicContact CG-CD2 4.34Å; E258-R378 IonicContact OE1-CZ 3.34Å; E258-R378 IonicContact OE1-NH2 3.46Å; E258-R378 PolarHBondContact OE1-NH2 3.31Å
259	Y	89.6	Confident	75.5	Confident	13 Å²	13	46.3 Å²	46.3	5%	0.051	23%	0.234	C	C	.	.	S	Bend	trans	-114.4	2.5	175.1	-54.9	-89.9	0	0	0	112.6	K216 P217 T256 V281 I282 I285	K216-Y259 HydrophobicContact CB-CD1 4.4Å; K216-Y259 HydrophobicContact CB-CD2 3.99Å; K216-Y259 HydrophobicContact CB-CE1 4.41Å; K216-Y259 HydrophobicContact CB-CE2 3.96Å; K216-Y259 HydrophobicContact CB-CG 4.22Å; P217-Y259 VanDerWaalsContact CD-CZ 3.5Å; P217-Y259 VanDerWaalsContact CD-OH 3.29Å; P217-Y259 WeakPolarHBondContact CD-OH 3.48Å; P217-Y259 HydrophobicContact CG-CE1 4.26Å; T256-Y259 HydrophobicContact CG2-CD2 3.64Å; T256-Y259 HydrophobicContact CG2-CE2 3.89Å; T256-Y259 PolarHBondContact O-N 3.37Å; T256-Y259 VanDerWaalsContact O-N 3.07Å; Y259-V281 HydrophobicContact CD1-CB 4.01Å; Y259-V281 HydrophobicContact CD1-CG1 3.42Å; Y259-V281 VanDerWaalsContact CD1-CG1 3.42Å; Y259-V281 HydrophobicContact CE1-CG1 3.75Å; Y259-V281 HydrophobicContact CG-CG1 4.31Å; Y259-I282 HydrophobicContact CD1-CG1 4.36Å; Y259-I282 HydrophobicContact CE1-CG1 4.3Å; Y259-I285 HydrophobicContact CE1-CD1 3.64Å
260	I	88	Confident	76.5	Confident	12 Å²	12	42.8 Å²	42.8	6%	0.062	22%	0.215	C	C	.	.			trans	-75.9	138.5	-173.3	-158.5	169.6	0	0	0	111.5	T256 P257 I264 L265 W277 I305	T256-I260 PolarHBondContact O-N 3.09Å; P257-I260 WeakPolarHBondContact O-CG2 3.43Å; I260-I264 HydrophobicContact CD1-CB 4.27Å; I260-I264 HydrophobicContact CD1-CG2 3.81Å; I260-I264 HydrophobicContact CG1-CB 3.95Å; I260-I264 HydrophobicContact CG1-CD1 3.98Å; I260-I264 HydrophobicContact CG1-CG2 3.99Å; I260-L265 HydrophobicContact CD1-CD2 4.13Å; I260-L265 HydrophobicContact CG2-CD1 4.1Å; I260-L265 HydrophobicContact CG2-CD2 3.79Å; I260-L265 HydrophobicContact CG2-CG 3.9Å; I260-W277 PolarHBondContact O-NE1 3.31Å; I260-I305 HydrophobicContact CG2-CD1 4.32Å
261	A	91.1	Very high	77.4	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	22%	0.221	C	C	.	.			trans	-78.5	151	-178.7	0	0	0	0	0	112.7	E263 I264 L265 V274 W277	A261-E263 VanDerWaalsContact C-N 3.3Å; A261-E263 HydrophobicContact CB-CG 4.5Å; A261-E263 WeakPolarHBondContact CB-OE2 3.14Å; A261-E263 PolarHBondContact O-N 2.88Å; A261-I264 HydrophobicContact CB-CD1 4.29Å; A261-I264 HydrophobicContact CB-CG1 4.35Å; A261-I264 PolarHBondContact O-N 2.91Å; A261-I264 VanDerWaalsContact O-N 3.14Å; A261-L265 PolarHBondContact O-N 3.04Å; A261-V274 HydrophobicContact CB-CB 4Å; A261-V274 HydrophobicContact CB-CG1 3.92Å; A261-W277 HydrophobicContact CB-CB 3.86Å; A261-W277 HydrophobicContact CB-CD2 4.44Å; A261-W277 HydrophobicContact CB-CG 3.81Å
262	P	91.9	Very high	79.2	Confident	4 Å²	4	38.2 Å²	38.2	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-55.7	-40.8	-177.6	-26.7	35.3	0	0	0	113.5	I264 L265 V266 W277 I305 L306 V334	P262-I264 VanDerWaalsContact C-N 3.29Å; P262-I264 PolarHBondContact O-N 3.07Å; P262-L265 WeakPolarHBondContact O-CB 3.46Å; P262-L265 PolarHBondContact O-N 2.8Å; P262-L265 VanDerWaalsContact O-N 3.1Å; P262-V266 PolarHBondContact O-N 3.5Å; P262-W277 HydrophobicContact CG-CD2 4.36Å; P262-W277 HydrophobicContact CG-CE3 4.02Å; P262-W277 HydrophobicContact CG-CH2 3.47Å; P262-W277 VanDerWaalsContact CG-CH2 3.47Å; P262-W277 HydrophobicContact CG-CZ2 3.85Å; P262-W277 HydrophobicContact CG-CZ3 3.55Å; P262-I305 HydrophobicContact CG-CG2 4.1Å; P262-L306 HydrophobicContact CB-CD2 4.3Å; P262-V334 HydrophobicContact CB-CG1 4.14Å; P262-V334 HydrophobicContact CG-CG1 4.22Å
263	E	89.5	Confident	80.8	Confident	8 Å²	8	34.6 Å²	34.6	4%	0.037	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-33.8	-179.1	61.6	-89.9	-146.5	0	0	113	A261 V266 R267 K268 S273 V274 R339	A261-E263 VanDerWaalsContact C-N 3.3Å; A261-E263 HydrophobicContact CB-CG 4.5Å; A261-E263 WeakPolarHBondContact CB-OE2 3.14Å; A261-E263 PolarHBondContact O-N 2.88Å; E263-V266 WeakPolarHBondContact O-CG2 3.42Å; E263-R267 PolarHBondContact O-N 2.73Å; E263-K268 HydrophobicContact CB-CB 4.35Å; E263-K268 PolarHBondContact O-N 2.85Å; E263-S273 PolarHBondContact OE1-OG 3.33Å; E263-V274 HydrophobicContact CG-CG1 4.03Å; E263-V274 WeakPolarHBondContact OE1-CG1 3.45Å; E263-R339 IonicContact OE1-CZ 3.89Å; E263-R339 IonicContact OE1-NH1 2.65Å; E263-R339 PolarHBondContact OE1-NH1 3.45Å; E263-R339 IonicContact OE1-NH2 2.75Å; E263-R339 PolarHBondContact OE1-NH2 2.99Å; E263-R339 IonicContact OE2-CZ 2.78Å; E263-R339 IonicContact OE2-NH1 2.87Å; E263-R339 PolarHBondContact OE2-NH1 3.34Å; E263-R339 IonicContact OE2-NH2 3.19Å; E263-R339 PolarHBondContact OE2-NH2 3.46Å
264	I	86.3	Confident	82.5	Confident	6 Å²	6	33.1 Å²	33.1	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-68.9	-38.9	175.6	-52.3	176.4	0	0	0	110.3	T253 I260 A261 P262 R267 Y270 V274	T253-I264 HydrophobicContact CG2-CG2 4.14Å; I260-I264 HydrophobicContact CD1-CB 4.27Å; I260-I264 HydrophobicContact CD1-CG2 3.81Å; I260-I264 HydrophobicContact CG1-CB 3.95Å; I260-I264 HydrophobicContact CG1-CD1 3.98Å; I260-I264 HydrophobicContact CG1-CG2 3.99Å; A261-I264 HydrophobicContact CB-CD1 4.29Å; A261-I264 HydrophobicContact CB-CG1 4.35Å; A261-I264 PolarHBondContact O-N 2.91Å; A261-I264 VanDerWaalsContact O-N 3.14Å; P262-I264 VanDerWaalsContact C-N 3.29Å; P262-I264 PolarHBondContact O-N 3.07Å; I264-R267 PolarHBondContact O-N 3.26Å; I264-R267 VanDerWaalsContact O-N 3.09Å; I264-Y270 HydrophobicContact CG1-CD1 3.84Å; I264-Y270 HydrophobicContact CG1-CD2 4.49Å; I264-Y270 HydrophobicContact CG1-CE1 4Å; I264-Y270 HydrophobicContact CG1-CG 4.1Å; I264-Y270 HydrophobicContact CG2-CE1 4.38Å; I264-V274 HydrophobicContact CD1-CB 3.97Å; I264-V274 HydrophobicContact CD1-CG1 3.78Å; I264-V274 HydrophobicContact CG1-CG1 3.84Å
265	L	85.3	Confident	84.1	Confident	40 Å²	40	32.8 Å²	32.8	21%	0.209	17%	0.167	C	C	.	.	H	α-helix	trans	-65.7	-41.1	-179.8	-70.7	178.9	0	0	0	112.8	I260 A261 P262 R267 Y302 I305 L306	I260-L265 HydrophobicContact CD1-CD2 4.13Å; I260-L265 HydrophobicContact CG2-CD1 4.1Å; I260-L265 HydrophobicContact CG2-CD2 3.79Å; I260-L265 HydrophobicContact CG2-CG 3.9Å; A261-L265 PolarHBondContact O-N 3.04Å; P262-L265 WeakPolarHBondContact O-CB 3.46Å; P262-L265 PolarHBondContact O-N 2.8Å; P262-L265 VanDerWaalsContact O-N 3.1Å; L265-R267 PolarHBondContact O-N 3.01Å; L265-Y302 HydrophobicContact CD1-CD1 3.75Å; L265-Y302 HydrophobicContact CD1-CE1 4.49Å; L265-Y302 HydrophobicContact CD1-CG 4.21Å; L265-Y302 HydrophobicContact CD2-CD1 3.67Å; L265-Y302 HydrophobicContact CD2-CE1 3.67Å; L265-Y302 HydrophobicContact CD2-CG 4.22Å; L265-Y302 HydrophobicContact CG-CD1 4.4Å; L265-I305 HydrophobicContact CD1-CB 3.98Å; L265-I305 HydrophobicContact CD1-CD1 4.35Å; L265-I305 HydrophobicContact CD1-CG2 3.55Å; L265-L306 HydrophobicContact CB-CD2 3.9Å; L265-L306 HydrophobicContact CB-CG 4.46Å; L265-L306 HydrophobicContact CD1-CD2 4.35Å; L265-L306 HydrophobicContact CD1-CG 4.23Å
266	V	83.8	Confident	85.9	Confident	27 Å²	27	32.1 Å²	32.1	16%	0.164	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-0.5	173.2	-66.9	0	0	0	0	113.5	P262 E263 K268 L306	P262-V266 PolarHBondContact O-N 3.5Å; E263-V266 WeakPolarHBondContact O-CG2 3.42Å; V266-K268 HydrophobicContact CG2-CB 3.91Å; V266-K268 HydrophobicContact CG2-CD 3.92Å; V266-K268 HydrophobicContact CG2-CG 3.65Å; V266-K268 PolarHBondContact O-N 2.88Å; V266-L306 HydrophobicContact CG1-CD2 3.66Å
267	R	78.3	Confident	87.1	Confident	169 Å²	169	30.8 Å²	30.8	64%	0.638	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	27.9	-173.6	-54.1	-179.7	174.2	-170.1	-5.9	113.2	T253 E263 I264 L265	T253-R267 HydrophobicContact CG2-CG 3.93Å; E263-R267 PolarHBondContact O-N 2.73Å; I264-R267 PolarHBondContact O-N 3.26Å; I264-R267 VanDerWaalsContact O-N 3.09Å; L265-R267 PolarHBondContact O-N 3.01Å
268	K	75.7	Confident	88.2	Confident	129 Å²	129	29.6 Å²	29.6	56%	0.561	14%	0.143	S	C	*	.			trans	-66.3	143.4	166.7	-83.5	-177.2	177.5	-173.1	0	107.8	E263 V266 Y270	E263-K268 HydrophobicContact CB-CB 4.35Å; E263-K268 PolarHBondContact O-N 2.85Å; V266-K268 HydrophobicContact CG2-CB 3.91Å; V266-K268 HydrophobicContact CG2-CD 3.92Å; V266-K268 HydrophobicContact CG2-CG 3.65Å; V266-K268 PolarHBondContact O-N 2.88Å; K268-Y270 PolarHBondContact O-N 3.02Å
269	P	75.2	Confident	88.9	Confident	57 Å²	57	27.9 Å²	27.9	37%	0.37	14%	0.136	S	C	.	.			trans	-63.9	133.3	173.8	-18.9	32.1	0	0	0	110.5	L249 M250 K251	L249-P269 HydrophobicContact CB-CB 3.57Å; L249-P269 HydrophobicContact CD1-CB 4.3Å; L249-P269 HydrophobicContact CD2-CB 4.17Å; L249-P269 HydrophobicContact CG-CB 4.22Å; M250-P269 CarbonylContact O-C 3.52Å; M250-P269 WeakPolarHBondContact O-CA 3.24Å; K251-P269 HydrophobicContact CG-CB 4.29Å; K251-P269 HydrophobicContact CG-CG 4.34Å
270	Y	78.4	Confident	89.3	Confident	5 Å²	5	27.2 Å²	27.2	2%	0.02	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-122.2	160.7	-167.5	61.5	-96.5	0	0	0	113.9	R213 M250 T252 I264 K268 V274	R213-Y270 WeakPolarHBondContact CD-OH 3.29Å; R213-Y270 HydrophobicContact CG-CE2 4.31Å; R213-Y270 PolarHBondContact NH1-OH 3.22Å; M250-Y270 HydrophobicContact CB-CD1 4.31Å; M250-Y270 HydrophobicContact CB-CD2 3.82Å; M250-Y270 HydrophobicContact CB-CE1 4.04Å; M250-Y270 HydrophobicContact CB-CE2 3.49Å; M250-Y270 VanDerWaalsContact CB-CE2 3.49Å; M250-Y270 HydrophobicContact CB-CG 4.21Å; M250-Y270 HydrophobicContact CG-CD2 4.45Å; M250-Y270 HydrophobicContact CG-CE2 4.16Å; M250-Y270 PolarHBondContact N-O 3.28Å; M250-Y270 WeakPolarHBondContact O-CD1 3.34Å; M250-Y270 WeakPolarHBondContact O-CE1 3.16Å; M250-Y270 PolarHBondContact O-N 2.98Å; M250-Y270 HydrophobicContact SD-CD2 4.29Å; M250-Y270 HydrophobicContact SD-CE2 3.75Å; T252-Y270 VanDerWaalsContact O-CE1 3.29Å; T252-Y270 WeakPolarHBondContact O-CE1 3.42Å; T252-Y270 PolarHBondContact O-OH 3.3Å; I264-Y270 HydrophobicContact CG1-CD1 3.84Å; I264-Y270 HydrophobicContact CG1-CD2 4.49Å; I264-Y270 HydrophobicContact CG1-CE1 4Å; I264-Y270 HydrophobicContact CG1-CG 4.1Å; I264-Y270 HydrophobicContact CG2-CE1 4.38Å; K268-Y270 PolarHBondContact O-N 3.02Å; Y270-V274 HydrophobicContact CD2-CB 4.48Å; Y270-V274 HydrophobicContact CD2-CG1 3.55Å; Y270-V274 HydrophobicContact CD2-CG2 4.09Å; Y270-V274 HydrophobicContact CE2-CG1 4.36Å; Y270-V274 HydrophobicContact CE2-CG2 4.29Å; Y270-V274 HydrophobicContact CG-CG1 3.86Å
271	T	85.4	Confident	89.7	Confident	39 Å²	39	26.7 Å²	26.7	24%	0.239	13%	0.13	C	C	.	.			trans	-110.9	-161.5	-179	71.7	0	0	0	0	110.8	L249 S273	L249-T271 HydrophobicContact CD2-CG2 4.41Å; T271-S273 PolarHBondContact O-N 2.87Å; T271-S273 WeakPolarHBondContact OG1-CB 3.18Å; T271-S273 PolarHBondContact OG1-N 2.96Å; T271-S273 PolarHBondContact OG1-OG 3.08Å
272	N	91	Very high	90	Very high	49 Å²	49	26.7 Å²	26.7	26%	0.262	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-5.1	170.7	61.9	-50.3	0	0	0	114.2	H206 T211 V274 D275	H206-N272 PolarHBondContact CE1-O 2.91Å; H206-N272 VanDerWaalsContact CE1-O 3.3Å; H206-N272 VanDerWaalsContact CG-ND2 3.33Å; H206-N272 PolarHBondContact ND1-ND2 2.97Å; T211-N272 HydrophobicContact CG2-CB 4.39Å; N272-V274 PolarHBondContact O-N 2.95Å; N272-V274 VanDerWaalsContact O-N 3.12Å; N272-D275 PolarHBondContact O-N 3.07Å
273	S	94.6	Very high	90.3	Very high	8 Å²	8	26.6 Å²	26.6	6%	0.056	13%	0.129	C	C	.	.	H	α-helix	trans	-51.3	-29.4	171.3	59.2	0	0	0	0	113.9	E263 T271 D275 M276 W277 P336 R339	E263-S273 PolarHBondContact OE1-OG 3.33Å; T271-S273 PolarHBondContact O-N 2.87Å; T271-S273 WeakPolarHBondContact OG1-CB 3.18Å; T271-S273 PolarHBondContact OG1-N 2.96Å; T271-S273 PolarHBondContact OG1-OG 3.08Å; S273-D275 VanDerWaalsContact C-N 3.33Å; S273-D275 PolarHBondContact O-N 3.48Å; S273-M276 WeakPolarHBondContact O-CB 3.47Å; S273-M276 PolarHBondContact O-N 2.84Å; S273-W277 PolarHBondContact O-N 3.12Å; S273-P336 WeakPolarHBondContact OG-CB 3.22Å; S273-R339 WeakPolarHBondContact O-CD 3.4Å; S273-R339 PolarHBondContact O-NH1 3.13Å
274	V	94.5	Very high	90.6	Very high	6 Å²	6	26.6 Å²	26.6	4%	0.036	13%	0.129	C	C	.	.	H	α-helix	trans	-68.2	-32.4	-175.9	-56.2	0	0	0	0	112.7	T211 R213 A261 E263 I264 Y270 N272 M276 W277 A278	T211-V274 HydrophobicContact CG2-CG2 3.64Å; R213-V274 HydrophobicContact CG-CG2 4.41Å; A261-V274 HydrophobicContact CB-CB 4Å; A261-V274 HydrophobicContact CB-CG1 3.92Å; E263-V274 HydrophobicContact CG-CG1 4.03Å; E263-V274 WeakPolarHBondContact OE1-CG1 3.45Å; I264-V274 HydrophobicContact CD1-CB 3.97Å; I264-V274 HydrophobicContact CD1-CG1 3.78Å; I264-V274 HydrophobicContact CG1-CG1 3.84Å; Y270-V274 HydrophobicContact CD2-CB 4.48Å; Y270-V274 HydrophobicContact CD2-CG1 3.55Å; Y270-V274 HydrophobicContact CD2-CG2 4.09Å; Y270-V274 HydrophobicContact CE2-CG1 4.36Å; Y270-V274 HydrophobicContact CE2-CG2 4.29Å; Y270-V274 HydrophobicContact CG-CG1 3.86Å; N272-V274 PolarHBondContact O-N 2.95Å; N272-V274 VanDerWaalsContact O-N 3.12Å; V274-M276 VanDerWaalsContact C-N 3.31Å; V274-W277 PolarHBondContact O-N 3.48Å; V274-A278 PolarHBondContact O-N 3.48Å
275	D	96.5	Very high	91.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-67.9	-36.3	174.5	-71.4	-17.7	0	0	0	110.3	V202 H206 T211 H212 R213 L215 N272 S273 A278 L279	V202-D275 HydrophobicContact CG1-CB 4.23Å; H206-D275 IonicContact CD2-OD2 3.38Å; H206-D275 IonicContact CE1-OD2 2.73Å; H206-D275 IonicContact NE2-OD2 3.63Å; H206-D275 PolarHBondContact NE2-OD2 3.33Å; T211-D275 WeakPolarHBondContact CA-OD2 3.47Å; T211-D275 WeakPolarHBondContact CG2-OD2 3.37Å; H212-D275 WeakPolarHBondContact CB-OD1 3.44Å; H212-D275 PolarHBondContact N-OD1 3.24Å; H212-D275 PolarHBondContact N-OD2 2.82Å; R213-D275 PolarHBondContact N-OD1 3.37Å; L215-D275 HydrophobicContact CD1-CB 3.68Å; N272-D275 PolarHBondContact O-N 3.07Å; S273-D275 VanDerWaalsContact C-N 3.33Å; S273-D275 PolarHBondContact O-N 3.48Å; D275-A278 PolarHBondContact O-N 3.21Å; D275-L279 WeakPolarHBondContact O-CG 3.5Å; D275-L279 PolarHBondContact O-N 3.44Å
276	M	98.3	Very high	91.5	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.015	12%	0.118	C	C	.	.	H	α-helix	trans	-69	-37.3	179.1	-55.8	-49.7	-52.7	0	0	112.2	L199 V202 S273 V274 L279 G280 L331 R339 M340 A342 A345	L199-M276 HydrophobicContact CD2-CE 3.84Å; V202-M276 HydrophobicContact CG1-SD 4.03Å; S273-M276 WeakPolarHBondContact O-CB 3.47Å; S273-M276 PolarHBondContact O-N 2.84Å; V274-M276 VanDerWaalsContact C-N 3.31Å; M276-L279 HydrophobicContact CE-CD1 3.9Å; M276-L279 PolarHBondContact O-N 3.5Å; M276-L279 HydrophobicContact SD-CD1 4.15Å; M276-G280 PolarHBondContact O-N 3.36Å; M276-L331 HydrophobicContact CB-CD2 4.08Å; M276-L331 HydrophobicContact CE-CD2 3.55Å; M276-R339 HydrophobicContact CB-CG 4.49Å; M276-M340 WeakPolarHBondContact CB-O 3.39Å; M276-M340 WeakPolarHBondContact CE-O 3.46Å; M276-M340 WeakPolarHBondContact CG-O 3.36Å; M276-A342 HydrophobicContact CE-CB 4.1Å; M276-A342 HydrophobicContact SD-CB 3.79Å; M276-A342 PolarHBondContact SD-N 3.4Å; M276-A342 VanDerWaalsContact SD-N 3.43Å; M276-A345 HydrophobicContact CE-CB 4.21Å
277	W	97.8	Very high	92	Very high	1 Å²	1	23.1 Å²	23.1	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-60.7	-47.1	170.9	176.7	-85.9	0	0	0	111.7	I260 A261 P262 S273 V274 L279 G280 V281 F293 I305 L332	I260-W277 PolarHBondContact O-NE1 3.31Å; A261-W277 HydrophobicContact CB-CB 3.86Å; A261-W277 HydrophobicContact CB-CD2 4.44Å; A261-W277 HydrophobicContact CB-CG 3.81Å; P262-W277 HydrophobicContact CG-CD2 4.36Å; P262-W277 HydrophobicContact CG-CE3 4.02Å; P262-W277 HydrophobicContact CG-CH2 3.47Å; P262-W277 VanDerWaalsContact CG-CH2 3.47Å; P262-W277 HydrophobicContact CG-CZ2 3.85Å; P262-W277 HydrophobicContact CG-CZ3 3.55Å; S273-W277 PolarHBondContact O-N 3.12Å; V274-W277 PolarHBondContact O-N 3.48Å; W277-L279 VanDerWaalsContact C-N 3.27Å; W277-L279 PolarHBondContact O-N 2.89Å; W277-G280 WeakPolarHBondContact O-CA 3.47Å; W277-G280 PolarHBondContact O-N 2.79Å; W277-V281 PolarHBondContact O-N 3.3Å; W277-F293 HydrophobicContact CH2-CE2 4.01Å; W277-F293 AromaticContact CH2-CZ 3.74Å; W277-F293 HydrophobicContact CH2-CZ 3.74Å; W277-F293 HydrophobicContact CZ2-CD2 4.27Å; W277-F293 AromaticContact CZ2-CE2 3.32Å; W277-F293 HydrophobicContact CZ2-CE2 3.32Å; W277-F293 AromaticContact CZ2-CZ 3.53Å; W277-F293 HydrophobicContact CZ2-CZ 3.53Å; W277-I305 HydrophobicContact CZ2-CG2 3.87Å; W277-L332 HydrophobicContact CD2-CD2 3.93Å; W277-L332 HydrophobicContact CE3-CD2 4.12Å; W277-L332 HydrophobicContact CG-CD2 4.41Å; W277-L332 HydrophobicContact CH2-CD2 4.48Å; W277-L332 HydrophobicContact CZ2-CD2 4.28Å; W277-L332 HydrophobicContact CZ3-CB 4.33Å; W277-L332 HydrophobicContact CZ3-CD2 4.41Å; W277-L332 WeakPolarHBondContact CZ3-O 3.37Å
278	A	97.1	Very high	92.7	Very high	5 Å²	5	15 Å²	15	4%	0.041	8%	0.079	C	C	.	.	H	α-helix	trans	-60.8	-36.4	176.5	0	0	0	0	0	111.9	L215 V274 D275 V281 I282	L215-A278 HydrophobicContact CB-CB 3.86Å; V274-A278 PolarHBondContact O-N 3.48Å; D275-A278 PolarHBondContact O-N 3.21Å; A278-V281 PolarHBondContact O-N 3.14Å; A278-I282 WeakPolarHBondContact O-CB 3.18Å; A278-I282 WeakPolarHBondContact O-CD1 3.32Å; A278-I282 WeakPolarHBondContact O-CG1 3.25Å; A278-I282 PolarHBondContact O-N 2.82Å
279	L	97.8	Very high	93.5	Very high	2 Å²	2	8.9 Å²	8.9	1%	0.01	5%	0.053	C	C	.	.	H	α-helix	trans	-66.1	-34.8	170.6	-68.7	-179.6	0	0	0	113.3	V198 L199 V202 L215 D275 M276 W277 I282 S283	V198-L279 HydrophobicContact CB-CD2 4.47Å; V198-L279 HydrophobicContact CG1-CD2 3.44Å; V198-L279 VanDerWaalsContact CG1-CD2 3.44Å; L199-L279 HydrophobicContact CD2-CD1 3.69Å; L199-L279 HydrophobicContact CG-CD1 4.49Å; V202-L279 HydrophobicContact CB-CD1 4.34Å; V202-L279 HydrophobicContact CG1-CD1 4.24Å; V202-L279 HydrophobicContact CG2-CD1 4.15Å; L215-L279 HydrophobicContact CD1-CD2 4.14Å; L215-L279 HydrophobicContact CD1-CG 4.11Å; D275-L279 WeakPolarHBondContact O-CG 3.5Å; D275-L279 PolarHBondContact O-N 3.44Å; M276-L279 HydrophobicContact CE-CD1 3.9Å; M276-L279 PolarHBondContact O-N 3.5Å; M276-L279 HydrophobicContact SD-CD1 4.15Å; W277-L279 VanDerWaalsContact C-N 3.27Å; W277-L279 PolarHBondContact O-N 2.89Å; L279-I282 HydrophobicContact CD2-CD1 4.32Å; L279-I282 PolarHBondContact O-N 2.78Å; L279-S283 VanDerWaalsContact O-CB 3.27Å; L279-S283 WeakPolarHBondContact O-CB 3.31Å; L279-S283 PolarHBondContact O-N 3.39Å; L279-S283 PolarHBondContact O-OG 3.44Å
280	G	98.3	Very high	94.3	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-60.2	-47	170.8	0	0	0	0	0	111.8	M276 W277 S283 Y284	M276-G280 PolarHBondContact O-N 3.36Å; W277-G280 WeakPolarHBondContact O-CA 3.47Å; W277-G280 PolarHBondContact O-N 2.79Å; G280-S283 PolarHBondContact O-N 2.8Å; G280-Y284 PolarHBondContact O-N 3.34Å
281	V	97.6	Very high	95	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-62	-45.7	175.6	178.1	0	0	0	0	111.2	Y259 W277 A278 S283 Y284 I285 M291 P292 F293 L332	Y259-V281 HydrophobicContact CD1-CB 4.01Å; Y259-V281 HydrophobicContact CD1-CG1 3.42Å; Y259-V281 VanDerWaalsContact CD1-CG1 3.42Å; Y259-V281 HydrophobicContact CE1-CG1 3.75Å; Y259-V281 HydrophobicContact CG-CG1 4.31Å; W277-V281 PolarHBondContact O-N 3.3Å; A278-V281 PolarHBondContact O-N 3.14Å; V281-S283 VanDerWaalsContact C-N 3.34Å; V281-S283 PolarHBondContact O-N 3.21Å; V281-Y284 PolarHBondContact O-N 3.5Å; V281-I285 HydrophobicContact CG1-CD1 3.96Å; V281-I285 WeakPolarHBondContact O-CD1 3.47Å; V281-I285 VanDerWaalsContact O-CG1 3.26Å; V281-I285 WeakPolarHBondContact O-CG1 3.4Å; V281-I285 PolarHBondContact O-N 2.81Å; V281-I285 VanDerWaalsContact O-N 3.15Å; V281-M291 HydrophobicContact CG1-CE 4.03Å; V281-P292 HydrophobicContact CB-CG 4.3Å; V281-P292 HydrophobicContact CG1-CG 3.92Å; V281-P292 HydrophobicContact CG2-CG 4.12Å; V281-F293 HydrophobicContact CG2-CD2 4.41Å; V281-F293 HydrophobicContact CG2-CE2 4.24Å; V281-L332 HydrophobicContact CG2-CD2 3.79Å
282	I	96.8	Very high	95.5	Very high	2 Å²	2	7.2 Å²	7.2	1%	0.01	4%	0.041	C	C	.	.	H	α-helix	trans	-61	-43.1	176.5	-68.9	160.7	0	0	0	110.9	L176 L215 L220 Y259 A278 L279 I285 L286	L176-I282 HydrophobicContact CD2-CG2 4.35Å; L215-I282 HydrophobicContact CB-CD1 4.33Å; L220-I282 HydrophobicContact CD1-CD1 4.11Å; L220-I282 HydrophobicContact CD1-CG2 4.24Å; Y259-I282 HydrophobicContact CD1-CG1 4.36Å; Y259-I282 HydrophobicContact CE1-CG1 4.3Å; A278-I282 WeakPolarHBondContact O-CB 3.18Å; A278-I282 WeakPolarHBondContact O-CD1 3.32Å; A278-I282 WeakPolarHBondContact O-CG1 3.25Å; A278-I282 PolarHBondContact O-N 2.82Å; L279-I282 HydrophobicContact CD2-CD1 4.32Å; L279-I282 PolarHBondContact O-N 2.78Å; I282-I285 PolarHBondContact O-N 2.95Å; I282-L286 VanDerWaalsContact O-CB 3.22Å; I282-L286 WeakPolarHBondContact O-CB 3.45Å; I282-L286 PolarHBondContact O-N 2.95Å
283	S	97.4	Very high	95.6	Very high	1 Å²	1	4.9 Å²	4.9	1%	0.007	3%	0.029	C	C	.	.	H	α-helix	trans	-64.3	-40.1	179.8	-57.9	0	0	0	0	112.4	L195 L279 G280 V281 L286 L287	L195-S283 WeakPolarHBondContact CD1-OG 3.34Å; L195-S283 WeakPolarHBondContact CD2-OG 3.44Å; L279-S283 VanDerWaalsContact O-CB 3.27Å; L279-S283 WeakPolarHBondContact O-CB 3.31Å; L279-S283 PolarHBondContact O-N 3.39Å; L279-S283 PolarHBondContact O-OG 3.44Å; G280-S283 PolarHBondContact O-N 2.8Å; V281-S283 VanDerWaalsContact C-N 3.34Å; V281-S283 PolarHBondContact O-N 3.21Å; S283-L286 WeakPolarHBondContact O-CB 3.41Å; S283-L286 PolarHBondContact O-N 2.87Å; S283-L287 PolarHBondContact O-N 3.09Å
284	Y	97.4	Very high	95.3	Very high	8 Å²	8	9.3 Å²	9.3	3%	0.031	5%	0.049	C	C	.	.	H	α-helix	trans	-61	-47.1	174.1	-178	-76	0	0	0	111.7	G280 V281 L286 L287 S288 T290 M291 P292 Y310 S311 Y312 W317 I328	G280-Y284 PolarHBondContact O-N 3.34Å; V281-Y284 PolarHBondContact O-N 3.5Å; Y284-L286 VanDerWaalsContact C-N 3.33Å; Y284-L286 PolarHBondContact O-N 3.44Å; Y284-L287 PolarHBondContact O-N 2.99Å; Y284-S288 PolarHBondContact O-N 2.67Å; Y284-S288 PolarHBondContact O-OG 3.07Å; Y284-T290 WeakPolarHBondContact CD1-O 3.47Å; Y284-M291 VanDerWaalsContact CE1-O 3.3Å; Y284-M291 WeakPolarHBondContact CE1-O 3.26Å; Y284-P292 HydrophobicContact CD1-CB 3.89Å; Y284-P292 VanDerWaalsContact CD1-CD 3.48Å; Y284-P292 HydrophobicContact CD1-CG 4.1Å; Y284-P292 HydrophobicContact CD2-CB 3.86Å; Y284-P292 HydrophobicContact CE1-CB 4.11Å; Y284-P292 VanDerWaalsContact CE1-N 3.32Å; Y284-P292 HydrophobicContact CE2-CB 4.06Å; Y284-P292 HydrophobicContact CG-CB 3.77Å; Y284-P292 HydrophobicContact CG-CG 4.09Å; Y284-Y310 HydrophobicContact CD2-CD2 4.38Å; Y284-Y310 HydrophobicContact CE2-CD2 4.12Å; Y284-S311 PolarHBondContact OH-O 2.88Å; Y284-S311 VanDerWaalsContact OH-O 3.11Å; Y284-Y312 HydrophobicContact CD2-CD1 4.46Å; Y284-Y312 HydrophobicContact CD2-CE1 4.05Å; Y284-Y312 HydrophobicContact CE2-CD1 4.09Å; Y284-Y312 HydrophobicContact CE2-CE1 4.1Å; Y284-W317 AromaticContact CD1-CZ2 3.95Å; Y284-W317 HydrophobicContact CD1-CZ2 3.95Å; Y284-W317 AromaticContact CD2-CH2 3.76Å; Y284-W317 HydrophobicContact CD2-CH2 3.76Å; Y284-W317 AromaticContact CD2-CZ2 3.48Å; Y284-W317 HydrophobicContact CD2-CZ2 3.48Å; Y284-W317 VanDerWaalsContact CD2-CZ2 3.48Å; Y284-W317 AromaticContact CE1-CZ2 3.79Å; Y284-W317 HydrophobicContact CE1-CZ2 3.79Å; Y284-W317 AromaticContact CE2-CE2 3.96Å; Y284-W317 HydrophobicContact CE2-CH2 4.01Å; Y284-W317 AromaticContact CE2-CZ2 3.32Å; Y284-W317 HydrophobicContact CE2-CZ2 3.32Å; Y284-W317 HydrophobicContact CG-CH2 4.1Å; Y284-W317 AromaticContact CG-CZ2 3.8Å; Y284-W317 HydrophobicContact CG-CZ2 3.8Å; Y284-W317 AromaticContact CZ-CE2 3.94Å; Y284-W317 AromaticContact CZ-CZ2 3.49Å; Y284-W317 VanDerWaalsContact CZ-CZ2 3.49Å; Y284-W317 AromaticContact CZ-NE1 3.87Å; Y284-I328 HydrophobicContact CD2-CG2 4.4Å
285	I	95	Very high	95	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-68.4	-35.9	178.6	-51.6	151.9	0	0	0	110.6	F177 Y259 V281 I282 L287 S288 G289 T290 M291 L371	F177-I285 HydrophobicContact CD2-CG2 4.25Å; F177-I285 HydrophobicContact CE1-CG2 4.39Å; F177-I285 HydrophobicContact CE2-CB 4.01Å; F177-I285 HydrophobicContact CE2-CD1 4.31Å; F177-I285 HydrophobicContact CE2-CG2 3.35Å; F177-I285 HydrophobicContact CZ-CB 3.69Å; F177-I285 HydrophobicContact CZ-CD1 4.36Å; F177-I285 HydrophobicContact CZ-CG2 3.47Å; F177-I285 VanDerWaalsContact CZ-CG2 3.47Å; Y259-I285 HydrophobicContact CE1-CD1 3.64Å; V281-I285 HydrophobicContact CG1-CD1 3.96Å; V281-I285 WeakPolarHBondContact O-CD1 3.47Å; V281-I285 VanDerWaalsContact O-CG1 3.26Å; V281-I285 WeakPolarHBondContact O-CG1 3.4Å; V281-I285 PolarHBondContact O-N 2.81Å; V281-I285 VanDerWaalsContact O-N 3.15Å; I282-I285 PolarHBondContact O-N 2.95Å; I285-L287 PolarHBondContact O-N 3Å; I285-S288 PolarHBondContact O-N 2.83Å; I285-G289 WeakPolarHBondContact O-CA 3.34Å; I285-G289 PolarHBondContact O-N 2.88Å; I285-T290 WeakPolarHBondContact CA-O 3.34Å; I285-T290 WeakPolarHBondContact CG1-O 3.14Å; I285-M291 HydrophobicContact CD1-SD 3.46Å; I285-M291 WeakPolarHBondContact CD1-SD 3.42Å; I285-M291 HydrophobicContact CG1-SD 3.7Å; I285-L371 HydrophobicContact CG2-CD2 4.01Å
286	L	94.1	Very high	94.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.6	-30.4	179.4	-169.6	66.1	0	0	0	112.6	L176 F177 I180 F186 A191 V194 L195 I282 S283 Y284	L176-L286 HydrophobicContact CD1-CD1 4.32Å; L176-L286 HydrophobicContact CD2-CD1 4.26Å; L176-L286 HydrophobicContact CG-CD1 4.41Å; F177-L286 HydrophobicContact CE1-CD1 4.07Å; I180-L286 HydrophobicContact CD1-CD1 3.38Å; F186-L286 HydrophobicContact CE1-CD1 4.34Å; F186-L286 HydrophobicContact CE1-CG 4.25Å; F186-L286 VanDerWaalsContact CE1-O 3.28Å; F186-L286 WeakPolarHBondContact CE1-O 3.41Å; F186-L286 HydrophobicContact CZ-CD1 3.77Å; F186-L286 HydrophobicContact CZ-CG 4.01Å; A191-L286 HydrophobicContact CB-CD2 3.78Å; A191-L286 HydrophobicContact CB-CG 3.98Å; V194-L286 HydrophobicContact CB-CD2 4.34Å; V194-L286 HydrophobicContact CG1-CD2 4.14Å; L195-L286 HydrophobicContact CD1-CD2 3.79Å; L195-L286 HydrophobicContact CD2-CD2 4.03Å; L195-L286 HydrophobicContact CG-CD2 3.64Å; I282-L286 VanDerWaalsContact O-CB 3.22Å; I282-L286 WeakPolarHBondContact O-CB 3.45Å; I282-L286 PolarHBondContact O-N 2.95Å; S283-L286 WeakPolarHBondContact O-CB 3.41Å; S283-L286 PolarHBondContact O-N 2.87Å; Y284-L286 VanDerWaalsContact C-N 3.33Å; Y284-L286 PolarHBondContact O-N 3.44Å
287	L	94.6	Very high	94	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-97	-16.1	-180	-66.9	176.6	0	0	0	114.7	E188 A191 S283 Y284 I285 P316 W317 V320 A324 I328 W350 I367	E188-L287 HydrophobicContact CG-CD2 4.12Å; A191-L287 HydrophobicContact CB-CD2 3.61Å; A191-L287 HydrophobicContact CB-CG 4.47Å; S283-L287 PolarHBondContact O-N 3.09Å; Y284-L287 PolarHBondContact O-N 2.99Å; I285-L287 PolarHBondContact O-N 3Å; L287-P316 WeakPolarHBondContact O-CG 3.5Å; L287-W317 HydrophobicContact CB-CH2 4.19Å; L287-W317 HydrophobicContact CB-CZ3 4.28Å; L287-V320 HydrophobicContact CD1-CG1 4.14Å; L287-A324 HydrophobicContact CD1-CB 3.76Å; L287-I328 HydrophobicContact CD1-CD1 4.12Å; L287-W350 HydrophobicContact CD1-CH2 3.89Å; L287-W350 HydrophobicContact CD1-CZ2 3.87Å; L287-W350 HydrophobicContact CD2-CH2 4.34Å; L287-W350 HydrophobicContact CD2-CZ2 4.07Å; L287-W350 HydrophobicContact CG-CH2 4.42Å; L287-W350 HydrophobicContact CG-CZ2 4.48Å; L287-I367 WeakPolarHBondContact O-CD1 3.27Å; L287-I367 WeakPolarHBondContact O-CG1 3.43Å
288	S	94.3	Very high	93.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-126.7	-22.9	-173.5	64.8	0	0	0	0	116.1	Y284 I285 T290 W317 N370	Y284-S288 PolarHBondContact O-N 2.67Å; Y284-S288 PolarHBondContact O-OG 3.07Å; I285-S288 PolarHBondContact O-N 2.83Å; S288-T290 PolarHBondContact O-N 3.42Å; S288-T290 PolarHBondContact OG-N 3.47Å; S288-T290 VanDerWaalsContact OG-N 3.16Å; S288-T290 PolarHBondContact OG-O 3.03Å; S288-T290 PolarHBondContact OG-OG1 3.05Å; S288-W317 VanDerWaalsContact CB-CZ2 3.42Å; S288-N370 WeakPolarHBondContact O-CB 3.49Å; S288-N370 PolarHBondContact O-ND2 3.35Å
289	G	92.3	Very high	92.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	71	-1	-167.3	0	0	0	0	0	115	I285 N370	I285-G289 WeakPolarHBondContact O-CA 3.34Å; I285-G289 PolarHBondContact O-N 2.88Å; G289-N370 CarbonylContact O-C 3.51Å
290	T	92.3	Very high	92.4	Very high	45 Å²	45	34.6 Å²	34.6	28%	0.276	17%	0.166	S	C	.	.	S	Bend	trans	-109.2	169.8	178.8	63.2	0	0	0	0	111.5	Y284 I285 S288 N370	Y284-T290 WeakPolarHBondContact CD1-O 3.47Å; I285-T290 WeakPolarHBondContact CA-O 3.34Å; I285-T290 WeakPolarHBondContact CG1-O 3.14Å; S288-T290 PolarHBondContact O-N 3.42Å; S288-T290 PolarHBondContact OG-N 3.47Å; S288-T290 VanDerWaalsContact OG-N 3.16Å; S288-T290 PolarHBondContact OG-O 3.03Å; S288-T290 PolarHBondContact OG-OG1 3.05Å; T290-N370 HydrophobicContact CG2-CB 3.78Å
291	M	92.6	Very high	92	Very high	11 Å²	11	35.1 Å²	35.1	5%	0.054	17%	0.169	C	C	.	.			trans	-89.6	147.2	176.1	-73.5	-62.1	-69.4	0	0	112	E258 V281 Y284 I285 E294 R374	E258-M291 HydrophobicContact CB-CE 3.44Å; E258-M291 VanDerWaalsContact CB-CE 3.44Å; E258-M291 HydrophobicContact CG-CE 4.44Å; V281-M291 HydrophobicContact CG1-CE 4.03Å; Y284-M291 VanDerWaalsContact CE1-O 3.3Å; Y284-M291 WeakPolarHBondContact CE1-O 3.26Å; I285-M291 HydrophobicContact CD1-SD 3.46Å; I285-M291 WeakPolarHBondContact CD1-SD 3.42Å; I285-M291 HydrophobicContact CG1-SD 3.7Å; M291-E294 HydrophobicContact CB-CB 3.92Å; M291-E294 HydrophobicContact CB-CG 4.46Å; M291-R374 VanDerWaalsContact CG-CZ 3.49Å; M291-R374 PolarHBondContact SD-NH1 3.42Å; M291-R374 PolarHBondContact SD-NH2 3.19Å
292	P	95.3	Very high	91.6	Very high	9 Å²	9	36.6 Å²	36.6	6%	0.058	18%	0.175	C	C	.	.	S	Bend	trans	-74.2	-32.3	168.7	28	-30.7	0	0	0	111.6	V281 Y284 Y310 L332	V281-P292 HydrophobicContact CB-CG 4.3Å; V281-P292 HydrophobicContact CG1-CG 3.92Å; V281-P292 HydrophobicContact CG2-CG 4.12Å; Y284-P292 HydrophobicContact CD1-CB 3.89Å; Y284-P292 VanDerWaalsContact CD1-CD 3.48Å; Y284-P292 HydrophobicContact CD1-CG 4.1Å; Y284-P292 HydrophobicContact CD2-CB 3.86Å; Y284-P292 HydrophobicContact CE1-CB 4.11Å; Y284-P292 VanDerWaalsContact CE1-N 3.32Å; Y284-P292 HydrophobicContact CE2-CB 4.06Å; Y284-P292 HydrophobicContact CG-CB 3.77Å; Y284-P292 HydrophobicContact CG-CG 4.09Å; P292-Y310 HydrophobicContact CB-CG 4.12Å; P292-Y310 WeakPolarHBondContact O-CB 3.46Å; P292-L332 HydrophobicContact CB-CD1 4.19Å; P292-L332 HydrophobicContact CG-CD1 4.45Å
293	F	94	Very high	91.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-128.6	116.5	179.6	-45.6	-69.5	0	0	0	109.3	W277 V281 L301 Q304 I305 Y310 L332	W277-F293 HydrophobicContact CH2-CE2 4.01Å; W277-F293 AromaticContact CH2-CZ 3.74Å; W277-F293 HydrophobicContact CH2-CZ 3.74Å; W277-F293 HydrophobicContact CZ2-CD2 4.27Å; W277-F293 AromaticContact CZ2-CE2 3.32Å; W277-F293 HydrophobicContact CZ2-CE2 3.32Å; W277-F293 AromaticContact CZ2-CZ 3.53Å; W277-F293 HydrophobicContact CZ2-CZ 3.53Å; V281-F293 HydrophobicContact CG2-CD2 4.41Å; V281-F293 HydrophobicContact CG2-CE2 4.24Å; F293-L301 HydrophobicContact CB-CD1 3.76Å; F293-Q304 HydrophobicContact CD1-CB 3.93Å; F293-I305 HydrophobicContact CB-CD1 4.43Å; F293-I305 HydrophobicContact CB-CG1 3.82Å; F293-I305 HydrophobicContact CD1-CG1 4.19Å; F293-I305 HydrophobicContact CD2-CG1 3.85Å; F293-I305 HydrophobicContact CE2-CG1 4.49Å; F293-I305 HydrophobicContact CG-CG1 3.68Å; F293-Y310 AromaticContact CE1-CD1 3.72Å; F293-Y310 HydrophobicContact CE1-CD1 3.72Å; F293-Y310 HydrophobicContact CE1-CG 4.4Å; F293-Y310 AromaticContact CZ-CD1 3.64Å; F293-Y310 HydrophobicContact CZ-CD1 3.64Å; F293-Y310 HydrophobicContact CZ-CE1 4.35Å; F293-L332 HydrophobicContact CE2-CD1 4.41Å; F293-L332 HydrophobicContact CE2-CD2 4.26Å; F293-L332 HydrophobicContact CZ-CD1 4.43Å
294	E	88.4	Confident	91.1	Very high	101 Å²	101	43.8 Å²	43.8	47%	0.472	20%	0.203	S	C	.	.			trans	-153	130.4	179.9	-159.5	152.5	-131.8	0	0	109.5	M291 Q304 R374	M291-E294 HydrophobicContact CB-CB 3.92Å; M291-E294 HydrophobicContact CB-CG 4.46Å; E294-Q304 VanDerWaalsContact N-OE1 3.09Å; E294-Q304 PolarHBondContact O-NE2 3.13Å; E294-Q304 VanDerWaalsContact O-NE2 3.13Å; E294-R374 IonicContact OE1-NE 3.27Å
295	D	88.2	Confident	90.9	Very high	42 Å²	42	43.4 Å²	43.4	23%	0.225	20%	0.202	C	C	.	.			trans	-165.9	132.2	175.7	-164.2	-51.1	0	0	0	109.2	N297 R300 L301	D295-N297 PolarHBondContact O-N 3.31Å; D295-N297 VanDerWaalsContact O-N 3.16Å; D295-N297 WeakPolarHBondContact OD1-CB 3.25Å; D295-N297 PolarHBondContact OD1-N 2.89Å; D295-R300 HydrophobicContact CB-CB 4.24Å; D295-R300 VanDerWaalsContact CG-NE 3.27Å; D295-R300 IonicContact OD1-CZ 3.24Å; D295-R300 VanDerWaalsContact OD1-CZ 3.24Å; D295-R300 IonicContact OD1-NE 2.71Å; D295-R300 PolarHBondContact OD1-NE 3.14Å; D295-R300 IonicContact OD1-NH2 2.68Å; D295-R300 PolarHBondContact OD1-NH2 2.75Å; D295-R300 WeakPolarHBondContact OD2-CB 3.29Å; D295-R300 WeakPolarHBondContact OD2-CD 3.47Å; D295-R300 IonicContact OD2-CZ 3.66Å; D295-R300 IonicContact OD2-NE 2.91Å; D295-R300 PolarHBondContact OD2-NE 3.02Å; D295-R300 IonicContact OD2-NH2 3.7Å; D295-L301 HydrophobicContact CB-CB 4.12Å
296	D	85.9	Confident	90.8	Very high	170 Å²	170	44.4 Å²	44.4	91%	0.909	21%	0.207	S	C	*	.	S	Bend	trans	-57.1	-28.9	175.5	-62.3	-57.1	0	0	0	112.8
297	N	88	Confident	90.8	Very high	68 Å²	68	50.9 Å²	50.9	36%	0.364	24%	0.236	S	C	.	.	S	Bend	trans	-91.2	106.7	175.7	-172.4	-56.9	0	0	0	110.3	D295 T299 R300 L301	D295-N297 PolarHBondContact O-N 3.31Å; D295-N297 VanDerWaalsContact O-N 3.16Å; D295-N297 WeakPolarHBondContact OD1-CB 3.25Å; D295-N297 PolarHBondContact OD1-N 2.89Å; N297-T299 PolarHBondContact O-N 3Å; N297-T299 VanDerWaalsContact O-N 3.08Å; N297-T299 WeakPolarHBondContact OD1-CA 3.16Å; N297-T299 VanDerWaalsContact OD1-CB 3.29Å; N297-T299 WeakPolarHBondContact OD1-CB 3.4Å; N297-T299 PolarHBondContact OD1-N 3.2Å; N297-R300 HydrophobicContact CB-CB 4.23Å; N297-R300 HydrophobicContact CB-CG 4.06Å; N297-R300 WeakPolarHBondContact O-CA 3.22Å; N297-R300 WeakPolarHBondContact O-CB 3.38Å; N297-R300 PolarHBondContact O-N 2.98Å; N297-R300 PolarHBondContact OD1-N 3.2Å; N297-L301 PolarHBondContact O-N 3.09Å
298	R	83.8	Confident	90.8	Very high	127 Å²	127	51.6 Å²	51.6	48%	0.479	24%	0.243	S	C	.	.	H	α-helix	trans	-50.4	-35.1	178.1	-64.3	177.2	68.1	118.8	-6.2	114.2	R300 L301 Y302	R298-R300 VanDerWaalsContact C-N 3.34Å; R298-L301 PolarHBondContact O-N 3.36Å; R298-Y302 HydrophobicContact CB-CE2 4.29Å; R298-Y302 PolarHBondContact NH2-OH 3.07Å; R298-Y302 WeakPolarHBondContact O-CB 3.37Å; R298-Y302 WeakPolarHBondContact O-CD2 3.47Å; R298-Y302 PolarHBondContact O-N 3.46Å
299	T	85.3	Confident	90.6	Very high	27 Å²	27	59 Å²	59	17%	0.166	28%	0.275	C	S	.	.	H	α-helix	trans	-70.4	-31.5	177.9	-51.3	0	0	0	0	111.9	N297 R303 L407	N297-T299 PolarHBondContact O-N 3Å; N297-T299 VanDerWaalsContact O-N 3.08Å; N297-T299 WeakPolarHBondContact OD1-CA 3.16Å; N297-T299 VanDerWaalsContact OD1-CB 3.29Å; N297-T299 WeakPolarHBondContact OD1-CB 3.4Å; N297-T299 PolarHBondContact OD1-N 3.2Å; T299-R303 WeakPolarHBondContact O-CB 3.4Å; T299-R303 PolarHBondContact O-N 2.92Å; T299-L407 HydrophobicContact CG2-CD1 3.98Å
300	R	89.5	Confident	90.8	Very high	116 Å²	116	61.2 Å²	61.2	44%	0.438	28%	0.284	S	S	.	.	H	α-helix	trans	-76.2	-43	171.9	-62.9	-167.5	-57.5	-126.6	-0.8	111.5	D295 N297 R298 Y302 R303 Q304	D295-R300 HydrophobicContact CB-CB 4.24Å; D295-R300 VanDerWaalsContact CG-NE 3.27Å; D295-R300 IonicContact OD1-CZ 3.24Å; D295-R300 VanDerWaalsContact OD1-CZ 3.24Å; D295-R300 IonicContact OD1-NE 2.71Å; D295-R300 PolarHBondContact OD1-NE 3.14Å; D295-R300 IonicContact OD1-NH2 2.68Å; D295-R300 PolarHBondContact OD1-NH2 2.75Å; D295-R300 WeakPolarHBondContact OD2-CB 3.29Å; D295-R300 WeakPolarHBondContact OD2-CD 3.47Å; D295-R300 IonicContact OD2-CZ 3.66Å; D295-R300 IonicContact OD2-NE 2.91Å; D295-R300 PolarHBondContact OD2-NE 3.02Å; D295-R300 IonicContact OD2-NH2 3.7Å; N297-R300 HydrophobicContact CB-CB 4.23Å; N297-R300 HydrophobicContact CB-CG 4.06Å; N297-R300 WeakPolarHBondContact O-CA 3.22Å; N297-R300 WeakPolarHBondContact O-CB 3.38Å; N297-R300 PolarHBondContact O-N 2.98Å; N297-R300 PolarHBondContact OD1-N 3.2Å; R298-R300 VanDerWaalsContact C-N 3.34Å; R300-Y302 PolarHBondContact O-N 2.81Å; R300-R303 CarbonylContact O-C 3.55Å; R300-R303 WeakPolarHBondContact O-CA 3.41Å; R300-R303 WeakPolarHBondContact O-CB 3.4Å; R300-R303 PolarHBondContact O-N 3.07Å; R300-Q304 PolarHBondContact O-N 2.91Å
301	L	89.1	Confident	90.9	Very high	11 Å²	11	62.3 Å²	62.3	6%	0.058	29%	0.293	C	S	.	.	H	α-helix	trans	-53.3	-51.8	172.2	175.3	62.9	0	0	0	111.5	E258 F293 D295 N297 R298 R303 Q304 I305	E258-L301 HydrophobicContact CG-CD2 4.34Å; F293-L301 HydrophobicContact CB-CD1 3.76Å; D295-L301 HydrophobicContact CB-CB 4.12Å; N297-L301 PolarHBondContact O-N 3.09Å; R298-L301 PolarHBondContact O-N 3.36Å; L301-R303 VanDerWaalsContact C-N 3.25Å; L301-R303 PolarHBondContact O-N 3.44Å; L301-Q304 WeakPolarHBondContact O-CB 3.43Å; L301-Q304 PolarHBondContact O-N 2.68Å; L301-I305 HydrophobicContact CD1-CD1 4.13Å; L301-I305 HydrophobicContact CG-CD1 4.08Å; L301-I305 PolarHBondContact O-N 3.09Å
302	Y	89.9	Confident	91.1	Very high	31 Å²	31	64.7 Å²	64.7	12%	0.122	30%	0.302	C	S	.	.	H	α-helix	trans	-61.2	-33.8	176.1	-63.2	-29.2	0	0	0	112.4	P257 L265 R298 R300 I305 L306	P257-Y302 HydrophobicContact CB-CE1 4.42Å; L265-Y302 HydrophobicContact CD1-CD1 3.75Å; L265-Y302 HydrophobicContact CD1-CE1 4.49Å; L265-Y302 HydrophobicContact CD1-CG 4.21Å; L265-Y302 HydrophobicContact CD2-CD1 3.67Å; L265-Y302 HydrophobicContact CD2-CE1 3.67Å; L265-Y302 HydrophobicContact CD2-CG 4.22Å; L265-Y302 HydrophobicContact CG-CD1 4.4Å; R298-Y302 HydrophobicContact CB-CE2 4.29Å; R298-Y302 PolarHBondContact NH2-OH 3.07Å; R298-Y302 WeakPolarHBondContact O-CB 3.37Å; R298-Y302 WeakPolarHBondContact O-CD2 3.47Å; R298-Y302 PolarHBondContact O-N 3.46Å; R300-Y302 PolarHBondContact O-N 2.81Å; Y302-I305 HydrophobicContact CD1-CD1 4.45Å; Y302-I305 PolarHBondContact O-N 2.95Å; Y302-L306 VanDerWaalsContact O-CB 3.24Å; Y302-L306 WeakPolarHBondContact O-CB 3.03Å; Y302-L306 WeakPolarHBondContact O-CG 3.46Å; Y302-L306 PolarHBondContact O-N 3.26Å
303	R	91.1	Very high	90.9	Very high	104 Å²	104	68 Å²	68	39%	0.392	33%	0.325	S	S	.	.	H	α-helix	trans	-70.8	-27.5	174.5	-167.3	-176.2	-62.7	133	-0.5	113.4	T299 R300 L301 K307	T299-R303 WeakPolarHBondContact O-CB 3.4Å; T299-R303 PolarHBondContact O-N 2.92Å; R300-R303 CarbonylContact O-C 3.55Å; R300-R303 WeakPolarHBondContact O-CA 3.41Å; R300-R303 WeakPolarHBondContact O-CB 3.4Å; R300-R303 PolarHBondContact O-N 3.07Å; L301-R303 VanDerWaalsContact C-N 3.25Å; L301-R303 PolarHBondContact O-N 3.44Å; R303-K307 WeakPolarHBondContact O-CB 3.43Å; R303-K307 WeakPolarHBondContact O-CG 3.42Å
304	Q	92.5	Very high	90.8	Very high	49 Å²	49	70.3 Å²	70.3	23%	0.229	35%	0.35	C	S	.	.	H	α-helix	trans	-68.6	-52.1	170.1	-63	171.4	4.7	0	0	109.8	F293 E294 R300 L301 L306 K307 G308 K309	F293-Q304 HydrophobicContact CD1-CB 3.93Å; E294-Q304 VanDerWaalsContact N-OE1 3.09Å; E294-Q304 PolarHBondContact O-NE2 3.13Å; E294-Q304 VanDerWaalsContact O-NE2 3.13Å; R300-Q304 PolarHBondContact O-N 2.91Å; L301-Q304 WeakPolarHBondContact O-CB 3.43Å; L301-Q304 PolarHBondContact O-N 2.68Å; Q304-L306 PolarHBondContact O-N 2.83Å; Q304-K307 CarbonylContact O-C 3.59Å; Q304-K307 PolarHBondContact O-N 3.16Å; Q304-K307 VanDerWaalsContact O-N 3.09Å; Q304-G308 PolarHBondContact O-N 3.46Å; Q304-G308 VanDerWaalsContact O-N 3.09Å; Q304-K309 PolarHBondContact O-N 3.1Å
305	I	93.3	Very high	90.9	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-57.6	-51.3	179.9	-66.2	166.9	0	0	0	111.1	I260 P262 L265 W277 F293 L301 Y302 K307 G308	I260-I305 HydrophobicContact CG2-CD1 4.32Å; P262-I305 HydrophobicContact CG-CG2 4.1Å; L265-I305 HydrophobicContact CD1-CB 3.98Å; L265-I305 HydrophobicContact CD1-CD1 4.35Å; L265-I305 HydrophobicContact CD1-CG2 3.55Å; W277-I305 HydrophobicContact CZ2-CG2 3.87Å; F293-I305 HydrophobicContact CB-CD1 4.43Å; F293-I305 HydrophobicContact CB-CG1 3.82Å; F293-I305 HydrophobicContact CD1-CG1 4.19Å; F293-I305 HydrophobicContact CD2-CG1 3.85Å; F293-I305 HydrophobicContact CE2-CG1 4.49Å; F293-I305 HydrophobicContact CG-CG1 3.68Å; L301-I305 HydrophobicContact CD1-CD1 4.13Å; L301-I305 HydrophobicContact CG-CD1 4.08Å; L301-I305 PolarHBondContact O-N 3.09Å; Y302-I305 HydrophobicContact CD1-CD1 4.45Å; Y302-I305 PolarHBondContact O-N 2.95Å; I305-K307 PolarHBondContact O-N 3Å; I305-G308 PolarHBondContact O-N 2.86Å
306	L	92.8	Very high	91.1	Very high	22 Å²	22	68.6 Å²	68.6	12%	0.115	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.7	178.8	-70.5	173.5	0	0	0	114.4	P262 L265 V266 Y302 Q304 Y414	P262-L306 HydrophobicContact CB-CD2 4.3Å; L265-L306 HydrophobicContact CB-CD2 3.9Å; L265-L306 HydrophobicContact CB-CG 4.46Å; L265-L306 HydrophobicContact CD1-CD2 4.35Å; L265-L306 HydrophobicContact CD1-CG 4.23Å; V266-L306 HydrophobicContact CG1-CD2 3.66Å; Y302-L306 VanDerWaalsContact O-CB 3.24Å; Y302-L306 WeakPolarHBondContact O-CB 3.03Å; Y302-L306 WeakPolarHBondContact O-CG 3.46Å; Y302-L306 PolarHBondContact O-N 3.26Å; Q304-L306 PolarHBondContact O-N 2.83Å; L306-Y414 WeakPolarHBondContact O-CE2 3.06Å; L306-Y414 PolarHBondContact O-OH 3.16Å
307	K	94	Very high	91.5	Very high	136 Å²	136	60.7 Å²	60.7	59%	0.591	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-0.1	175	-70.5	-167.9	171.8	-150.9	0	113.4	R303 Q304 I305 K309	R303-K307 WeakPolarHBondContact O-CB 3.43Å; R303-K307 WeakPolarHBondContact O-CG 3.42Å; Q304-K307 CarbonylContact O-C 3.59Å; Q304-K307 PolarHBondContact O-N 3.16Å; Q304-K307 VanDerWaalsContact O-N 3.09Å; I305-K307 PolarHBondContact O-N 3Å; K307-K309 HydrophobicContact CB-CB 4.25Å; K307-K309 PolarHBondContact O-N 2.69Å; K307-K309 VanDerWaalsContact O-N 3.14Å
308	G	93.6	Very high	91.7	Very high	15 Å²	15	62 Å²	62	16%	0.155	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	22	-170.4	0	0	0	0	0	113.7	Q304 I305 Y310	Q304-G308 PolarHBondContact O-N 3.46Å; Q304-G308 VanDerWaalsContact O-N 3.09Å; I305-G308 PolarHBondContact O-N 2.86Å; G308-Y310 WeakPolarHBondContact O-CD1 3.24Å; G308-Y310 VanDerWaalsContact O-CE1 3.25Å; G308-Y310 WeakPolarHBondContact O-CE1 3.49Å; G308-Y310 PolarHBondContact O-N 3.06Å
309	K	91.4	Very high	92.1	Very high	154 Å²	154	57.2 Å²	57.2	67%	0.67	30%	0.296	S	S	*	.			trans	-89.6	100.2	-169.9	-172.7	175	177.5	173.9	0	112.3	Q304 K307	Q304-K309 PolarHBondContact O-N 3.1Å; K307-K309 HydrophobicContact CB-CB 4.25Å; K307-K309 PolarHBondContact O-N 2.69Å; K307-K309 VanDerWaalsContact O-N 3.14Å
310	Y	95.2	Very high	92.5	Very high	48 Å²	48	56.1 Å²	56.1	19%	0.188	29%	0.289	C	S	.	.			trans	-126	-178.7	166.6	56.6	-87.2	0	0	0	109.9	Y284 P292 F293 G308 Y312 I328 D329 L332	Y284-Y310 HydrophobicContact CD2-CD2 4.38Å; Y284-Y310 HydrophobicContact CE2-CD2 4.12Å; P292-Y310 HydrophobicContact CB-CG 4.12Å; P292-Y310 WeakPolarHBondContact O-CB 3.46Å; F293-Y310 AromaticContact CE1-CD1 3.72Å; F293-Y310 HydrophobicContact CE1-CD1 3.72Å; F293-Y310 HydrophobicContact CE1-CG 4.4Å; F293-Y310 AromaticContact CZ-CD1 3.64Å; F293-Y310 HydrophobicContact CZ-CD1 3.64Å; F293-Y310 HydrophobicContact CZ-CE1 4.35Å; G308-Y310 WeakPolarHBondContact O-CD1 3.24Å; G308-Y310 VanDerWaalsContact O-CE1 3.25Å; G308-Y310 WeakPolarHBondContact O-CE1 3.49Å; G308-Y310 PolarHBondContact O-N 3.06Å; Y310-Y312 HydrophobicContact CE2-CE1 4.28Å; Y310-Y312 HydrophobicContact CE2-CE2 4.14Å; Y310-Y312 AromaticContact CE2-CZ 3.77Å; Y310-I328 HydrophobicContact CE2-CG2 4.43Å; Y310-D329 WeakPolarHBondContact CE2-OD1 3.4Å; Y310-D329 WeakPolarHBondContact OH-CA 3.43Å; Y310-D329 PolarHBondContact OH-OD1 2.81Å; Y310-L332 HydrophobicContact CD1-CD1 3.86Å; Y310-L332 HydrophobicContact CE1-CB 3.6Å; Y310-L332 HydrophobicContact CE1-CD1 3.57Å; Y310-L332 HydrophobicContact CE1-CG 4.23Å; Y310-L332 HydrophobicContact CE2-CD1 4.32Å; Y310-L332 HydrophobicContact CG-CD1 4.37Å
311	S	94.8	Very high	92.7	Very high	67 Å²	67	51.8 Å²	51.8	47%	0.469	28%	0.277	S	S	.	.			trans	-154	138.5	177.6	54	0	0	0	0	113.6	Y284 S313	Y284-S311 PolarHBondContact OH-O 2.88Å; Y284-S311 VanDerWaalsContact OH-O 3.11Å; S311-S313 PolarHBondContact O-N 2.9Å; S311-S313 PolarHBondContact O-OG 3.07Å; S311-S313 PolarHBondContact OG-OG 3.33Å; S311-S313 VanDerWaalsContact OG-OG 3.08Å
312	Y	96.6	Very high	93	Very high	61 Å²	61	57.4 Å²	57.4	24%	0.239	31%	0.307	C	S	.	.			trans	-76.9	56.2	175.8	-59.3	-60.8	0	0	0	112.7	Y284 Y310 W317 K325 I328 D329	Y284-Y312 HydrophobicContact CD2-CD1 4.46Å; Y284-Y312 HydrophobicContact CD2-CE1 4.05Å; Y284-Y312 HydrophobicContact CE2-CD1 4.09Å; Y284-Y312 HydrophobicContact CE2-CE1 4.1Å; Y310-Y312 HydrophobicContact CE2-CE1 4.28Å; Y310-Y312 HydrophobicContact CE2-CE2 4.14Å; Y310-Y312 AromaticContact CE2-CZ 3.77Å; Y312-W317 VanDerWaalsContact C-CD1 3.49Å; Y312-W317 AromaticContact CD1-CD2 3.69Å; Y312-W317 HydrophobicContact CD1-CD2 3.69Å; Y312-W317 AromaticContact CD1-CE2 3.86Å; Y312-W317 AromaticContact CD1-CE3 3.49Å; Y312-W317 HydrophobicContact CD1-CE3 3.49Å; Y312-W317 VanDerWaalsContact CD1-CE3 3.49Å; Y312-W317 HydrophobicContact CD1-CG 4.48Å; Y312-W317 AromaticContact CD1-CH2 3.73Å; Y312-W317 HydrophobicContact CD1-CH2 3.73Å; Y312-W317 AromaticContact CD1-CZ2 3.9Å; Y312-W317 HydrophobicContact CD1-CZ2 3.9Å; Y312-W317 AromaticContact CD1-CZ3 3.51Å; Y312-W317 HydrophobicContact CD1-CZ3 3.51Å; Y312-W317 HydrophobicContact CE1-CE3 4.2Å; Y312-W317 AromaticContact CE1-CH2 3.81Å; Y312-W317 HydrophobicContact CE1-CH2 3.81Å; Y312-W317 HydrophobicContact CE1-CZ2 4.29Å; Y312-W317 AromaticContact CE1-CZ3 3.74Å; Y312-W317 HydrophobicContact CE1-CZ3 3.74Å; Y312-W317 HydrophobicContact CG-CD2 4.36Å; Y312-W317 HydrophobicContact CG-CE3 4.26Å; Y312-W317 VanDerWaalsContact O-CB 3.3Å; Y312-W317 WeakPolarHBondContact O-CB 3.21Å; Y312-K325 HydrophobicContact CD1-CG 4.08Å; Y312-K325 HydrophobicContact CD2-CB 4.3Å; Y312-K325 HydrophobicContact CD2-CD 4.21Å; Y312-K325 HydrophobicContact CD2-CG 3.97Å; Y312-K325 HydrophobicContact CE1-CB 4.41Å; Y312-K325 HydrophobicContact CE1-CG 3.99Å; Y312-K325 HydrophobicContact CE2-CB 3.79Å; Y312-K325 HydrophobicContact CE2-CG 3.89Å; Y312-K325 HydrophobicContact CG-CD 4.31Å; Y312-K325 HydrophobicContact CG-CG 4.07Å; Y312-K325 PolarHBondContact OH-O 3.19Å; Y312-I328 HydrophobicContact CE1-CD1 4.24Å; Y312-I328 HydrophobicContact CE1-CG2 4.41Å; Y312-I328 WeakPolarHBondContact OH-CB 3.42Å; Y312-I328 VanDerWaalsContact OH-CG2 3.28Å; Y312-I328 WeakPolarHBondContact OH-CG2 3.31Å; Y312-D329 WeakPolarHBondContact CE2-OD1 3.49Å; Y312-D329 VanDerWaalsContact OH-CG 3.28Å; Y312-D329 PolarHBondContact OH-OD1 2.59Å
313	S	92.1	Very high	93.2	Very high	78 Å²	78	59.2 Å²	59.2	55%	0.545	32%	0.318	S	S	.	.			trans	-105.7	131.6	-170.5	51.1	0	0	0	0	112.7	S311	S311-S313 PolarHBondContact O-N 2.9Å; S311-S313 PolarHBondContact O-OG 3.07Å; S311-S313 PolarHBondContact OG-OG 3.33Å; S311-S313 VanDerWaalsContact OG-OG 3.08Å
314	G	91.1	Very high	93.5	Very high	50 Å²	50	54.2 Å²	54.2	52%	0.515	30%	0.299	S	S	.	.	S	Bend	trans	84.7	171.4	178.9	0	0	0	0	0	114.2	W317	G314-W317 WeakPolarHBondContact O-CB 3.39Å; G314-W317 PolarHBondContact O-N 2.78Å
315	E	90.4	Very high	93.7	Very high	105 Å²	105	53.5 Å²	53.5	49%	0.491	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	135.5	-178.1	-76.8	-60	118.6	0	0	112.4	P318 N370	E315-P318 WeakPolarHBondContact OE1-CD 3.43Å; E315-P318 WeakPolarHBondContact OE1-CG 3.38Å; E315-N370 PolarHBondContact O-ND2 2.87Å
316	P	92.6	Very high	93.9	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.013	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	cis	-99.6	14.4	11.5	39	-35.7	0	0	0	115.6	L287 P318 S319 V320 L363 I367	L287-P316 WeakPolarHBondContact O-CG 3.5Å; P316-P318 VanDerWaalsContact O-N 3.15Å; P316-S319 WeakPolarHBondContact O-CA 3.49Å; P316-S319 PolarHBondContact O-N 2.8Å; P316-V320 HydrophobicContact CG-CG2 4.36Å; P316-V320 PolarHBondContact O-N 3.42Å; P316-L363 HydrophobicContact CB-CD2 4.25Å; P316-I367 HydrophobicContact CG-CG1 4.28Å
317	W	94.7	Very high	94.2	Very high	3 Å²	3	54.9 Å²	54.9	1%	0.011	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-55.8	-30.6	-169.1	-68	117.5	0	0	0	117.2	Y284 L287 S288 Y312 G314 S319 V320 K325 I328	Y284-W317 AromaticContact CD1-CZ2 3.95Å; Y284-W317 HydrophobicContact CD1-CZ2 3.95Å; Y284-W317 AromaticContact CD2-CH2 3.76Å; Y284-W317 HydrophobicContact CD2-CH2 3.76Å; Y284-W317 AromaticContact CD2-CZ2 3.48Å; Y284-W317 HydrophobicContact CD2-CZ2 3.48Å; Y284-W317 VanDerWaalsContact CD2-CZ2 3.48Å; Y284-W317 AromaticContact CE1-CZ2 3.79Å; Y284-W317 HydrophobicContact CE1-CZ2 3.79Å; Y284-W317 AromaticContact CE2-CE2 3.96Å; Y284-W317 HydrophobicContact CE2-CH2 4.01Å; Y284-W317 AromaticContact CE2-CZ2 3.32Å; Y284-W317 HydrophobicContact CE2-CZ2 3.32Å; Y284-W317 HydrophobicContact CG-CH2 4.1Å; Y284-W317 AromaticContact CG-CZ2 3.8Å; Y284-W317 HydrophobicContact CG-CZ2 3.8Å; Y284-W317 AromaticContact CZ-CE2 3.94Å; Y284-W317 AromaticContact CZ-CZ2 3.49Å; Y284-W317 VanDerWaalsContact CZ-CZ2 3.49Å; Y284-W317 AromaticContact CZ-NE1 3.87Å; L287-W317 HydrophobicContact CB-CH2 4.19Å; L287-W317 HydrophobicContact CB-CZ3 4.28Å; S288-W317 VanDerWaalsContact CB-CZ2 3.42Å; Y312-W317 VanDerWaalsContact C-CD1 3.49Å; Y312-W317 AromaticContact CD1-CD2 3.69Å; Y312-W317 HydrophobicContact CD1-CD2 3.69Å; Y312-W317 AromaticContact CD1-CE2 3.86Å; Y312-W317 AromaticContact CD1-CE3 3.49Å; Y312-W317 HydrophobicContact CD1-CE3 3.49Å; Y312-W317 VanDerWaalsContact CD1-CE3 3.49Å; Y312-W317 HydrophobicContact CD1-CG 4.48Å; Y312-W317 AromaticContact CD1-CH2 3.73Å; Y312-W317 HydrophobicContact CD1-CH2 3.73Å; Y312-W317 AromaticContact CD1-CZ2 3.9Å; Y312-W317 HydrophobicContact CD1-CZ2 3.9Å; Y312-W317 AromaticContact CD1-CZ3 3.51Å; Y312-W317 HydrophobicContact CD1-CZ3 3.51Å; Y312-W317 HydrophobicContact CE1-CE3 4.2Å; Y312-W317 AromaticContact CE1-CH2 3.81Å; Y312-W317 HydrophobicContact CE1-CH2 3.81Å; Y312-W317 HydrophobicContact CE1-CZ2 4.29Å; Y312-W317 AromaticContact CE1-CZ3 3.74Å; Y312-W317 HydrophobicContact CE1-CZ3 3.74Å; Y312-W317 HydrophobicContact CG-CD2 4.36Å; Y312-W317 HydrophobicContact CG-CE3 4.26Å; Y312-W317 VanDerWaalsContact O-CB 3.3Å; Y312-W317 WeakPolarHBondContact O-CB 3.21Å; G314-W317 WeakPolarHBondContact O-CB 3.39Å; G314-W317 PolarHBondContact O-N 2.78Å; W317-S319 PolarHBondContact O-N 3.05Å; W317-V320 HydrophobicContact CE3-CB 3.97Å; W317-V320 HydrophobicContact CE3-CG1 3.98Å; W317-V320 HydrophobicContact CE3-CG2 4.09Å; W317-V320 HydrophobicContact CZ3-CB 4.39Å; W317-V320 HydrophobicContact CZ3-CG1 3.92Å; W317-V320 HydrophobicContact CZ3-CG2 4.46Å; W317-V320 PolarHBondContact O-N 3.41Å; W317-K325 WeakPolarHBondContact O-CE 3.09Å; W317-K325 PolarHBondContact O-NZ 3.18Å; W317-I328 HydrophobicContact CH2-CD1 3.85Å; W317-I328 HydrophobicContact CZ3-CD1 4.19Å
318	P	93	Very high	94.4	Very high	95 Å²	95	48.4 Å²	48.4	62%	0.617	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-63.6	-21.1	171.1	-25	36.4	0	0	0	114.2	E315 P316	E315-P318 WeakPolarHBondContact OE1-CD 3.43Å; E315-P318 WeakPolarHBondContact OE1-CG 3.38Å; P316-P318 VanDerWaalsContact O-N 3.15Å
319	S	91.1	Very high	94.6	Very high	27 Å²	27	50.5 Å²	50.5	19%	0.189	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-101.6	-2.1	179.3	-77	0	0	0	0	114.6	P316 W317 S359 K361	P316-S319 WeakPolarHBondContact O-CA 3.49Å; P316-S319 PolarHBondContact O-N 2.8Å; W317-S319 PolarHBondContact O-N 3.05Å; S319-S359 VanDerWaalsContact O-CB 3.31Å; S319-S359 WeakPolarHBondContact O-CB 3.42Å; S319-S359 PolarHBondContact O-OG 3.09Å; S319-K361 WeakPolarHBondContact OG-CD 3.39Å; S319-K361 PolarHBondContact OG-NZ 3.08Å
320	V	93.5	Very high	95	Very high	5 Å²	5	49 Å²	49	3%	0.03	27%	0.272	C	S	.	.	S	Bend	trans	-92.8	134.7	177.4	174.2	0	0	0	0	110.4	L287 P316 W317 A324 K325 L363	L287-V320 HydrophobicContact CD1-CG1 4.14Å; P316-V320 HydrophobicContact CG-CG2 4.36Å; P316-V320 PolarHBondContact O-N 3.42Å; W317-V320 HydrophobicContact CE3-CB 3.97Å; W317-V320 HydrophobicContact CE3-CG1 3.98Å; W317-V320 HydrophobicContact CE3-CG2 4.09Å; W317-V320 HydrophobicContact CZ3-CB 4.39Å; W317-V320 HydrophobicContact CZ3-CG1 3.92Å; W317-V320 HydrophobicContact CZ3-CG2 4.46Å; W317-V320 PolarHBondContact O-N 3.41Å; V320-A324 HydrophobicContact CG1-CB 3.66Å; V320-K325 WeakPolarHBondContact O-CE 3.36Å; V320-K325 PolarHBondContact O-NZ 3.4Å; V320-L363 HydrophobicContact CG2-CD1 3.92Å
321	S	94.3	Very high	95.1	Very high	24 Å²	24	46.7 Å²	46.7	17%	0.168	26%	0.263	C	S	.	.			trans	-63.5	155.7	-176.2	75.5	0	0	0	0	114.1	E188 L323 A324 K325 S358	E188-S321 WeakPolarHBondContact OE1-CB 3.32Å; E188-S321 PolarHBondContact OE1-N 3.45Å; E188-S321 PolarHBondContact OE1-OG 3.36Å; E188-S321 WeakPolarHBondContact OE2-CB 3.46Å; E188-S321 PolarHBondContact OE2-OG 3.25Å; S321-L323 VanDerWaalsContact C-N 3.26Å; S321-L323 PolarHBondContact O-N 3.48Å; S321-A324 WeakPolarHBondContact O-CB 3.31Å; S321-A324 PolarHBondContact O-N 3.43Å; S321-A324 WeakPolarHBondContact OG-CB 3.5Å; S321-A324 PolarHBondContact OG-N 3.26Å; S321-A324 VanDerWaalsContact OG-N 3.15Å; S321-K325 PolarHBondContact O-N 3.34Å; S321-S358 PolarHBondContact OG-OG 2.81Å
322	N	94.6	Very high	95.3	Very high	130 Å²	130	43.7 Å²	43.7	70%	0.695	24%	0.242	S	C	*	.	H	α-helix	trans	-69.4	-26.3	174.7	-66.8	-8.9	0	0	0	112.1	K325 D326	N322-K325 PolarHBondContact O-N 3.46Å; N322-D326 WeakPolarHBondContact O-CB 3.05Å; N322-D326 PolarHBondContact O-N 2.91Å
323	L	95.5	Very high	95.3	Very high	68 Å²	68	42.6 Å²	42.6	36%	0.356	24%	0.242	S	C	.	.	H	α-helix	trans	-67.3	-34.7	173	-66.9	178.6	0	0	0	112.2	S321 F327 H348 P349 W350	S321-L323 VanDerWaalsContact C-N 3.26Å; S321-L323 PolarHBondContact O-N 3.48Å; L323-F327 WeakPolarHBondContact O-CB 3.31Å; L323-F327 PolarHBondContact O-N 3.19Å; L323-F327 VanDerWaalsContact O-N 3.09Å; L323-H348 PolarHBondContact O-CE1 3.4Å; L323-P349 HydrophobicContact CD2-CB 4.41Å; L323-W350 HydrophobicContact CB-CB 3.95Å; L323-W350 HydrophobicContact CB-CG 4.27Å
324	A	96.2	Very high	95.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-69.2	-34.6	173.7	0	0	0	0	0	112.5	L287 V320 S321 I328 W350	L287-A324 HydrophobicContact CD1-CB 3.76Å; V320-A324 HydrophobicContact CG1-CB 3.66Å; S321-A324 WeakPolarHBondContact O-CB 3.31Å; S321-A324 PolarHBondContact O-N 3.43Å; S321-A324 WeakPolarHBondContact OG-CB 3.5Å; S321-A324 PolarHBondContact OG-N 3.26Å; S321-A324 VanDerWaalsContact OG-N 3.15Å; A324-I328 WeakPolarHBondContact O-CG1 3.43Å; A324-I328 PolarHBondContact O-N 3.09Å; A324-W350 HydrophobicContact CB-CD2 4.09Å; A324-W350 HydrophobicContact CB-CG 4.39Å; A324-W350 HydrophobicContact CB-CZ2 3.83Å
325	K	97.4	Very high	95.6	Very high	34 Å²	34	41.9 Å²	41.9	15%	0.148	22%	0.222	C	C	.	.	H	α-helix	trans	-70.2	-51.6	176.3	-68	160.6	179.5	152.9	0	110.8	Y312 W317 V320 S321 N322 F327 I328 D329	Y312-K325 HydrophobicContact CD1-CG 4.08Å; Y312-K325 HydrophobicContact CD2-CB 4.3Å; Y312-K325 HydrophobicContact CD2-CD 4.21Å; Y312-K325 HydrophobicContact CD2-CG 3.97Å; Y312-K325 HydrophobicContact CE1-CB 4.41Å; Y312-K325 HydrophobicContact CE1-CG 3.99Å; Y312-K325 HydrophobicContact CE2-CB 3.79Å; Y312-K325 HydrophobicContact CE2-CG 3.89Å; Y312-K325 HydrophobicContact CG-CD 4.31Å; Y312-K325 HydrophobicContact CG-CG 4.07Å; Y312-K325 PolarHBondContact OH-O 3.19Å; W317-K325 WeakPolarHBondContact O-CE 3.09Å; W317-K325 PolarHBondContact O-NZ 3.18Å; V320-K325 WeakPolarHBondContact O-CE 3.36Å; V320-K325 PolarHBondContact O-NZ 3.4Å; S321-K325 PolarHBondContact O-N 3.34Å; N322-K325 PolarHBondContact O-N 3.46Å; K325-F327 PolarHBondContact O-N 2.92Å; K325-I328 CarbonylContact O-C 3.56Å; K325-I328 WeakPolarHBondContact O-CA 3.46Å; K325-I328 PolarHBondContact O-N 3.28Å; K325-D329 PolarHBondContact O-N 2.67Å; K325-D329 VanDerWaalsContact O-OD2 3.11Å
326	D	97.8	Very high	95.8	Very high	50 Å²	50	39.2 Å²	39.2	27%	0.267	21%	0.213	S	C	.	.	H	α-helix	trans	-54.7	-36.6	173.9	-177.3	56.4	0	0	0	112.7	N322 R330 H348	N322-D326 WeakPolarHBondContact O-CB 3.05Å; N322-D326 PolarHBondContact O-N 2.91Å; D326-R330 VanDerWaalsContact O-CG 3.26Å; D326-R330 WeakPolarHBondContact O-CG 3.47Å; D326-R330 PolarHBondContact O-N 3.22Å; D326-R330 IonicContact OD1-CZ 2.71Å; D326-R330 IonicContact OD1-NE 2.81Å; D326-R330 PolarHBondContact OD1-NE 3.17Å; D326-R330 IonicContact OD1-NH2 2.68Å; D326-R330 PolarHBondContact OD1-NH2 2.98Å; D326-R330 IonicContact OD2-CZ 3.35Å; D326-R330 VanDerWaalsContact OD2-CZ 3.3Å; D326-R330 IonicContact OD2-NE 3.97Å; D326-R330 PolarHBondContact OD2-NE 2.95Å; D326-R330 IonicContact OD2-NH2 2.69Å; D326-R330 PolarHBondContact OD2-NH2 3.39Å; D326-H348 IonicContact OD2-CE1 3.82Å; D326-H348 IonicContact OD2-NE2 3.19Å; D326-H348 PolarHBondContact OD2-NE2 3.09Å; D326-H348 VanDerWaalsContact OD2-NE2 3.09Å
327	F	98.1	Very high	95.8	Very high	1 Å²	1	44 Å²	44	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-44.3	173	-179.5	-101.5	0	0	0	113.1	L195 L199 L323 K325 L331 M340 A345 H348 W350 V351	L195-F327 HydrophobicContact CD1-CE1 4.06Å; L199-F327 HydrophobicContact CD1-CZ 4.16Å; L323-F327 WeakPolarHBondContact O-CB 3.31Å; L323-F327 PolarHBondContact O-N 3.19Å; L323-F327 VanDerWaalsContact O-N 3.09Å; K325-F327 PolarHBondContact O-N 2.92Å; F327-L331 HydrophobicContact CD1-CD1 4.02Å; F327-L331 HydrophobicContact CE1-CD1 3.45Å; F327-L331 VanDerWaalsContact CE1-CD1 3.45Å; F327-L331 HydrophobicContact CE2-CD1 4.23Å; F327-L331 HydrophobicContact CZ-CD1 3.58Å; F327-L331 WeakPolarHBondContact O-CG 3.35Å; F327-L331 PolarHBondContact O-N 3.29Å; F327-M340 HydrophobicContact CD2-CE 4.33Å; F327-A345 HydrophobicContact CE2-CB 3.91Å; F327-A345 HydrophobicContact CZ-CB 4.37Å; F327-H348 HydrophobicContact CD2-CB 3.82Å; F327-H348 AromaticContact CD2-CG 3.64Å; F327-H348 AromaticContact CD2-ND1 3.62Å; F327-H348 HydrophobicContact CE2-CB 4.19Å; F327-W350 HydrophobicContact CB-CD2 4.46Å; F327-W350 HydrophobicContact CB-CE3 3.86Å; F327-W350 AromaticContact CD1-CE3 3.53Å; F327-W350 HydrophobicContact CD1-CE3 3.53Å; F327-W350 AromaticContact CD1-CZ3 3.46Å; F327-W350 HydrophobicContact CD1-CZ3 3.46Å; F327-W350 VanDerWaalsContact CD1-CZ3 3.46Å; F327-W350 HydrophobicContact CD2-CE3 4.21Å; F327-W350 HydrophobicContact CE1-CE3 4.09Å; F327-W350 AromaticContact CE1-CZ3 3.78Å; F327-W350 HydrophobicContact CE1-CZ3 3.78Å; F327-W350 AromaticContact CG-CE3 3.58Å; F327-W350 HydrophobicContact CG-CE3 3.58Å; F327-W350 HydrophobicContact CG-CZ3 4.04Å; F327-V351 HydrophobicContact CD2-CG2 3.89Å; F327-V351 HydrophobicContact CE2-CG2 3.49Å; F327-V351 VanDerWaalsContact CE2-CG2 3.49Å; F327-V351 HydrophobicContact CZ-CG2 3.95Å
328	I	98.4	Very high	95.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.3	-43.9	176.3	-70.4	163.9	0	0	0	110.5	Y284 L287 Y310 Y312 W317 A324 K325 R330 L331 L332	Y284-I328 HydrophobicContact CD2-CG2 4.4Å; L287-I328 HydrophobicContact CD1-CD1 4.12Å; Y310-I328 HydrophobicContact CE2-CG2 4.43Å; Y312-I328 HydrophobicContact CE1-CD1 4.24Å; Y312-I328 HydrophobicContact CE1-CG2 4.41Å; Y312-I328 WeakPolarHBondContact OH-CB 3.42Å; Y312-I328 VanDerWaalsContact OH-CG2 3.28Å; Y312-I328 WeakPolarHBondContact OH-CG2 3.31Å; W317-I328 HydrophobicContact CH2-CD1 3.85Å; W317-I328 HydrophobicContact CZ3-CD1 4.19Å; A324-I328 WeakPolarHBondContact O-CG1 3.43Å; A324-I328 PolarHBondContact O-N 3.09Å; K325-I328 CarbonylContact O-C 3.56Å; K325-I328 WeakPolarHBondContact O-CA 3.46Å; K325-I328 PolarHBondContact O-N 3.28Å; I328-R330 VanDerWaalsContact C-N 3.31Å; I328-R330 PolarHBondContact O-N 2.58Å; I328-L331 CarbonylContact O-C 3.59Å; I328-L331 WeakPolarHBondContact O-CA 3.28Å; I328-L331 PolarHBondContact O-N 3.24Å; I328-L332 HydrophobicContact CG2-CD1 3.64Å; I328-L332 HydrophobicContact CG2-CG 4.09Å; I328-L332 PolarHBondContact O-N 3.35Å
329	D	98.4	Very high	96.1	Very high	58 Å²	58	45.7 Å²	45.7	31%	0.31	25%	0.25	S	C	.	.	H	α-helix	trans	-61.2	-39.4	-176	-63.1	-33.5	0	0	0	112.2	Y310 Y312 K325 L331 L332 T333	Y310-D329 WeakPolarHBondContact CE2-OD1 3.4Å; Y310-D329 WeakPolarHBondContact OH-CA 3.43Å; Y310-D329 PolarHBondContact OH-OD1 2.81Å; Y312-D329 WeakPolarHBondContact CE2-OD1 3.49Å; Y312-D329 VanDerWaalsContact OH-CG 3.28Å; Y312-D329 PolarHBondContact OH-OD1 2.59Å; K325-D329 PolarHBondContact O-N 2.67Å; K325-D329 VanDerWaalsContact O-OD2 3.11Å; D329-L331 VanDerWaalsContact C-N 3.3Å; D329-L331 PolarHBondContact O-N 2.97Å; D329-L332 CarbonylContact O-C 3.53Å; D329-L332 PolarHBondContact O-N 3.22Å; D329-T333 PolarHBondContact O-N 3.29Å; D329-T333 VanDerWaalsContact O-N 3.09Å; D329-T333 PolarHBondContact O-OG1 3.31Å
330	R	98.4	Very high	96.4	Very high	123 Å²	123	45 Å²	45	46%	0.464	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-13.8	175.2	-65.3	173.5	-161.7	-121.2	10.7	114.5	D326 I328 T333 M340	D326-R330 VanDerWaalsContact O-CG 3.26Å; D326-R330 WeakPolarHBondContact O-CG 3.47Å; D326-R330 PolarHBondContact O-N 3.22Å; D326-R330 IonicContact OD1-CZ 2.71Å; D326-R330 IonicContact OD1-NE 2.81Å; D326-R330 PolarHBondContact OD1-NE 3.17Å; D326-R330 IonicContact OD1-NH2 2.68Å; D326-R330 PolarHBondContact OD1-NH2 2.98Å; D326-R330 IonicContact OD2-CZ 3.35Å; D326-R330 VanDerWaalsContact OD2-CZ 3.3Å; D326-R330 IonicContact OD2-NE 3.97Å; D326-R330 PolarHBondContact OD2-NE 2.95Å; D326-R330 IonicContact OD2-NH2 2.69Å; D326-R330 PolarHBondContact OD2-NH2 3.39Å; I328-R330 VanDerWaalsContact C-N 3.31Å; I328-R330 PolarHBondContact O-N 2.58Å; R330-T333 WeakPolarHBondContact CA-OG1 3.37Å; R330-T333 PolarHBondContact O-OG1 2.83Å; R330-M340 HydrophobicContact CB-CB 4.19Å; R330-M340 HydrophobicContact CB-CE 3.27Å; R330-M340 HydrophobicContact CG-CE 4.08Å; R330-M340 WeakPolarHBondContact O-CB 3.37Å; R330-M340 PolarHBondContact O-N 2.79Å
331	L	98.4	Very high	96.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-31.9	171.8	-71.5	176.3	0	0	0	112.4	M276 F327 I328 D329 T333 R339 M340	M276-L331 HydrophobicContact CB-CD2 4.08Å; M276-L331 HydrophobicContact CE-CD2 3.55Å; F327-L331 HydrophobicContact CD1-CD1 4.02Å; F327-L331 HydrophobicContact CE1-CD1 3.45Å; F327-L331 VanDerWaalsContact CE1-CD1 3.45Å; F327-L331 HydrophobicContact CE2-CD1 4.23Å; F327-L331 HydrophobicContact CZ-CD1 3.58Å; F327-L331 WeakPolarHBondContact O-CG 3.35Å; F327-L331 PolarHBondContact O-N 3.29Å; I328-L331 CarbonylContact O-C 3.59Å; I328-L331 WeakPolarHBondContact O-CA 3.28Å; I328-L331 PolarHBondContact O-N 3.24Å; D329-L331 VanDerWaalsContact C-N 3.3Å; D329-L331 PolarHBondContact O-N 2.97Å; L331-T333 VanDerWaalsContact C-N 3.27Å; L331-R339 VanDerWaalsContact O-CD 3.28Å; L331-R339 WeakPolarHBondContact O-CD 3.21Å; L331-R339 WeakPolarHBondContact O-CG 3.26Å; L331-M340 HydrophobicContact CD2-CB 4.22Å
332	L	98	Very high	96.8	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.021	25%	0.253	C	S	.	.	S	Bend	trans	-92.2	18.5	174	-62.8	-175.9	0	0	0	112.9	W277 V281 P292 F293 Y310 I328 D329 V334	W277-L332 HydrophobicContact CD2-CD2 3.93Å; W277-L332 HydrophobicContact CE3-CD2 4.12Å; W277-L332 HydrophobicContact CG-CD2 4.41Å; W277-L332 HydrophobicContact CH2-CD2 4.48Å; W277-L332 HydrophobicContact CZ2-CD2 4.28Å; W277-L332 HydrophobicContact CZ3-CB 4.33Å; W277-L332 HydrophobicContact CZ3-CD2 4.41Å; W277-L332 WeakPolarHBondContact CZ3-O 3.37Å; V281-L332 HydrophobicContact CG2-CD2 3.79Å; P292-L332 HydrophobicContact CB-CD1 4.19Å; P292-L332 HydrophobicContact CG-CD1 4.45Å; F293-L332 HydrophobicContact CE2-CD1 4.41Å; F293-L332 HydrophobicContact CE2-CD2 4.26Å; F293-L332 HydrophobicContact CZ-CD1 4.43Å; Y310-L332 HydrophobicContact CD1-CD1 3.86Å; Y310-L332 HydrophobicContact CE1-CB 3.6Å; Y310-L332 HydrophobicContact CE1-CD1 3.57Å; Y310-L332 HydrophobicContact CE1-CG 4.23Å; Y310-L332 HydrophobicContact CE2-CD1 4.32Å; Y310-L332 HydrophobicContact CG-CD1 4.37Å; I328-L332 HydrophobicContact CG2-CD1 3.64Å; I328-L332 HydrophobicContact CG2-CG 4.09Å; I328-L332 PolarHBondContact O-N 3.35Å; D329-L332 CarbonylContact O-C 3.53Å; D329-L332 PolarHBondContact O-N 3.22Å; L332-V334 PolarHBondContact O-N 3Å
333	T	97.8	Very high	96.9	Very high	38 Å²	38	45 Å²	45	23%	0.233	24%	0.244	C	C	.	.			trans	-62.1	126.1	168.9	-56.2	0	0	0	0	109.7	D329 R330 L331 D338 R339	D329-T333 PolarHBondContact O-N 3.29Å; D329-T333 VanDerWaalsContact O-N 3.09Å; D329-T333 PolarHBondContact O-OG1 3.31Å; R330-T333 WeakPolarHBondContact CA-OG1 3.37Å; R330-T333 PolarHBondContact O-OG1 2.83Å; L331-T333 VanDerWaalsContact C-N 3.27Å; T333-D338 HydrophobicContact CG2-CB 3.78Å; T333-R339 PolarHBondContact O-NE 3.46Å; T333-R339 PolarHBondContact O-NH2 2.84Å
334	V	95.7	Very high	97	Very high	42 Å²	42	46.8 Å²	46.8	26%	0.255	25%	0.25	S	S	.	.	S	Bend	trans	-66.9	-43.9	-172.6	176.7	0	0	0	0	111.3	P262 L332 R339	P262-V334 HydrophobicContact CB-CG1 4.14Å; P262-V334 HydrophobicContact CG-CG1 4.22Å; L332-V334 PolarHBondContact O-N 3Å; V334-R339 PolarHBondContact O-NH2 3.36Å
335	D	94.3	Very high	97.1	Very high	71 Å²	71	46.8 Å²	46.8	38%	0.38	25%	0.25	S	S	.	.	S	Bend	trans	-72	126.1	176.4	-160	-67.5	0	0	0	111.1	S337 R339	D335-S337 VanDerWaalsContact C-N 3.28Å; D335-S337 PolarHBondContact O-N 3.15Å; D335-S337 PolarHBondContact OD1-N 3.21Å; D335-S337 PolarHBondContact OD1-OG 3.35Å; D335-R339 WeakPolarHBondContact O-CB 3.49Å; D335-R339 PolarHBondContact O-N 3.1Å
336	P	93.6	Very high	97.1	Very high	49 Å²	49	46.7 Å²	46.7	32%	0.318	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-12.4	-179.6	30.1	-36.8	0	0	0	115.1	S273	S273-P336 WeakPolarHBondContact OG-CB 3.22Å
337	S	92.8	Very high	97	Very high	102 Å²	102	51.4 Å²	51.4	71%	0.713	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-34.2	175	61.8	0	0	0	0	113.4	D335	D335-S337 VanDerWaalsContact C-N 3.28Å; D335-S337 PolarHBondContact O-N 3.15Å; D335-S337 PolarHBondContact OD1-N 3.21Å; D335-S337 PolarHBondContact OD1-OG 3.35Å
338	D	95.9	Very high	97	Very high	124 Å²	124	51.9 Å²	51.9	66%	0.663	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-23.1	174.6	-65.4	-41.6	0	0	0	112.5	T333 M340	T333-D338 HydrophobicContact CG2-CB 3.78Å; D338-M340 PolarHBondContact O-N 3.27Å
339	R	97.7	Very high	96.8	Very high	9 Å²	9	55.5 Å²	55.5	3%	0.034	30%	0.295	C	S	.	.	S	Bend	trans	-62.7	130.8	-176.5	-166	-175.2	-57	149.3	8	112.1	E263 S273 M276 L331 T333 V334 D335 T341	E263-R339 IonicContact OE1-CZ 3.89Å; E263-R339 IonicContact OE1-NH1 2.65Å; E263-R339 PolarHBondContact OE1-NH1 3.45Å; E263-R339 IonicContact OE1-NH2 2.75Å; E263-R339 PolarHBondContact OE1-NH2 2.99Å; E263-R339 IonicContact OE2-CZ 2.78Å; E263-R339 IonicContact OE2-NH1 2.87Å; E263-R339 PolarHBondContact OE2-NH1 3.34Å; E263-R339 IonicContact OE2-NH2 3.19Å; E263-R339 PolarHBondContact OE2-NH2 3.46Å; S273-R339 WeakPolarHBondContact O-CD 3.4Å; S273-R339 PolarHBondContact O-NH1 3.13Å; M276-R339 HydrophobicContact CB-CG 4.49Å; L331-R339 VanDerWaalsContact O-CD 3.28Å; L331-R339 WeakPolarHBondContact O-CD 3.21Å; L331-R339 WeakPolarHBondContact O-CG 3.26Å; T333-R339 PolarHBondContact O-NE 3.46Å; T333-R339 PolarHBondContact O-NH2 2.84Å; V334-R339 PolarHBondContact O-NH2 3.36Å; D335-R339 WeakPolarHBondContact O-CB 3.49Å; D335-R339 PolarHBondContact O-N 3.1Å; R339-T341 PolarHBondContact O-N 2.97Å
340	M	97.6	Very high	96.6	Very high	14 Å²	14	52.7 Å²	52.7	7%	0.069	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-61.8	127.1	-173	-162.7	-173.4	-25.7	0	0	113	M276 F327 R330 L331 D338 Q344 A345 H348	M276-M340 WeakPolarHBondContact CB-O 3.39Å; M276-M340 WeakPolarHBondContact CE-O 3.46Å; M276-M340 WeakPolarHBondContact CG-O 3.36Å; F327-M340 HydrophobicContact CD2-CE 4.33Å; R330-M340 HydrophobicContact CB-CB 4.19Å; R330-M340 HydrophobicContact CB-CE 3.27Å; R330-M340 HydrophobicContact CG-CE 4.08Å; R330-M340 WeakPolarHBondContact O-CB 3.37Å; R330-M340 PolarHBondContact O-N 2.79Å; L331-M340 HydrophobicContact CD2-CB 4.22Å; D338-M340 PolarHBondContact O-N 3.27Å; M340-Q344 HydrophobicContact CG-CB 3.37Å; M340-Q344 HydrophobicContact CG-CG 4.5Å; M340-Q344 HydrophobicContact SD-CB 3.94Å; M340-A345 HydrophobicContact CG-CB 4.4Å; M340-A345 WeakPolarHBondContact SD-CA 3.15Å; M340-A345 HydrophobicContact SD-CB 3.81Å; M340-A345 PolarHBondContact SD-N 3.17Å; M340-H348 HydrophobicContact SD-CB 4.43Å
341	T	98.3	Very high	96.3	Very high	59 Å²	59	46.9 Å²	46.9	36%	0.362	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-73.1	160	173.7	66.1	0	0	0	0	112.3	R339 L343 Q344 A345	R339-T341 PolarHBondContact O-N 2.97Å; T341-L343 PolarHBondContact O-N 2.68Å; T341-L343 VanDerWaalsContact O-N 3.16Å; T341-Q344 PolarHBondContact O-N 3.2Å; T341-Q344 PolarHBondContact OG1-N 3.47Å; T341-Q344 PolarHBondContact OG1-OE1 3.19Å; T341-A345 WeakPolarHBondContact O-CB 3.48Å; T341-A345 PolarHBondContact O-N 3.41Å
342	A	97.8	Very high	95.9	Very high	3 Å²	3	51.2 Å²	51.2	3%	0.025	29%	0.285	C	S	.	.	H	α-helix	trans	-55.7	-34.1	176.8	0	0	0	0	0	113.6	L199 V202 K203 M276 A345 L346	L199-A342 HydrophobicContact CD2-CB 4.41Å; V202-A342 HydrophobicContact CG1-CB 4.26Å; K203-A342 HydrophobicContact CB-CB 3.91Å; M276-A342 HydrophobicContact CE-CB 4.1Å; M276-A342 HydrophobicContact SD-CB 3.79Å; M276-A342 PolarHBondContact SD-N 3.4Å; M276-A342 VanDerWaalsContact SD-N 3.43Å; A342-A345 PolarHBondContact O-N 3.14Å; A342-L346 WeakPolarHBondContact O-CD1 3.14Å; A342-L346 WeakPolarHBondContact O-CG 3.43Å; A342-L346 PolarHBondContact O-N 3.46Å; A342-L346 VanDerWaalsContact O-N 3.08Å
343	L	97.1	Very high	95	Very high	97 Å²	97	53 Å²	53	51%	0.508	30%	0.297	S	S	.	.	H	α-helix	trans	-70.6	-36.7	177.5	179.6	61	0	0	0	112.8	K203 T341 K347	K203-L343 HydrophobicContact CD-CD1 4.5Å; T341-L343 PolarHBondContact O-N 2.68Å; T341-L343 VanDerWaalsContact O-N 3.16Å; L343-K347 WeakPolarHBondContact O-CG 3.5Å
344	Q	98	Very high	93.5	Very high	104 Å²	104	53.9 Å²	53.9	49%	0.486	30%	0.3	S	S	.	.	H	α-helix	trans	-73	-38.3	173.1	-71.6	157.1	-48.8	0	0	110.8	M340 T341 L346 K347 H348	M340-Q344 HydrophobicContact CG-CB 3.37Å; M340-Q344 HydrophobicContact CG-CG 4.5Å; M340-Q344 HydrophobicContact SD-CB 3.94Å; T341-Q344 PolarHBondContact O-N 3.2Å; T341-Q344 PolarHBondContact OG1-N 3.47Å; T341-Q344 PolarHBondContact OG1-OE1 3.19Å; Q344-L346 PolarHBondContact O-N 3.48Å; Q344-K347 CarbonylContact O-C 3.57Å; Q344-K347 WeakPolarHBondContact O-CA 3.41Å; Q344-K347 WeakPolarHBondContact O-CB 3.37Å; Q344-K347 PolarHBondContact O-N 3.1Å; Q344-H348 PolarHBondContact O-N 3.04Å; Q344-H348 VanDerWaalsContact O-N 3.07Å
345	A	97.9	Very high	91.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.5	-38.4	179.4	0	0	0	0	0	113.1	L199 M276 F327 M340 T341 A342 K347 H348 V351	L199-A345 HydrophobicContact CD1-CB 3.92Å; L199-A345 HydrophobicContact CD2-CB 3.57Å; L199-A345 HydrophobicContact CG-CB 4.41Å; M276-A345 HydrophobicContact CE-CB 4.21Å; F327-A345 HydrophobicContact CE2-CB 3.91Å; F327-A345 HydrophobicContact CZ-CB 4.37Å; M340-A345 HydrophobicContact CG-CB 4.4Å; M340-A345 WeakPolarHBondContact SD-CA 3.15Å; M340-A345 HydrophobicContact SD-CB 3.81Å; M340-A345 PolarHBondContact SD-N 3.17Å; T341-A345 WeakPolarHBondContact O-CB 3.48Å; T341-A345 PolarHBondContact O-N 3.41Å; A342-A345 PolarHBondContact O-N 3.14Å; A345-K347 PolarHBondContact O-N 3.32Å; A345-H348 WeakPolarHBondContact O-CB 3.43Å; A345-H348 PolarHBondContact O-N 3.38Å; A345-V351 WeakPolarHBondContact O-CG2 3.28Å
346	L	96.6	Very high	89.7	Confident	33 Å²	33	52.7 Å²	52.7	17%	0.173	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-21.5	171.1	-73.9	160.7	0	0	0	113.6	L199 D200 K203 A342 Q344 V352	L199-L346 HydrophobicContact CB-CD1 4.25Å; L199-L346 HydrophobicContact CB-CD2 3.65Å; L199-L346 HydrophobicContact CB-CG 3.75Å; L199-L346 HydrophobicContact CD1-CD2 4.21Å; L199-L346 HydrophobicContact CD1-CG 4.27Å; D200-L346 VanDerWaalsContact OD1-CD1 3.26Å; D200-L346 WeakPolarHBondContact OD1-CD1 3.35Å; K203-L346 HydrophobicContact CB-CD1 4.25Å; K203-L346 HydrophobicContact CD-CD1 3.72Å; A342-L346 WeakPolarHBondContact O-CD1 3.14Å; A342-L346 WeakPolarHBondContact O-CG 3.43Å; A342-L346 PolarHBondContact O-N 3.46Å; A342-L346 VanDerWaalsContact O-N 3.08Å; Q344-L346 PolarHBondContact O-N 3.48Å; L346-V352 VanDerWaalsContact O-CG2 3.25Å; L346-V352 WeakPolarHBondContact O-CG2 3.44Å
347	K	96.6	Very high	87.8	Confident	149 Å²	149	55.6 Å²	55.6	65%	0.648	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-0.8	176.1	-66.4	-179.9	179.1	-172	0	113.4	L343 Q344 A345 V352	L343-K347 WeakPolarHBondContact O-CG 3.5Å; Q344-K347 CarbonylContact O-C 3.57Å; Q344-K347 WeakPolarHBondContact O-CA 3.41Å; Q344-K347 WeakPolarHBondContact O-CB 3.37Å; Q344-K347 PolarHBondContact O-N 3.1Å; A345-K347 PolarHBondContact O-N 3.32Å; K347-V352 VanDerWaalsContact C-CG2 3.45Å; K347-V352 WeakPolarHBondContact O-CG2 3.48Å
348	H	97.1	Very high	86.2	Confident	10 Å²	10	51.5 Å²	51.5	5%	0.046	30%	0.297	C	S	.	.	S	Bend	trans	-67.4	137.8	-177.3	-168.1	-97.1	0	0	0	111.2	L323 D326 F327 M340 Q344 A345 W350 V351 V352	L323-H348 PolarHBondContact O-CE1 3.4Å; D326-H348 IonicContact OD2-CE1 3.82Å; D326-H348 IonicContact OD2-NE2 3.19Å; D326-H348 PolarHBondContact OD2-NE2 3.09Å; D326-H348 VanDerWaalsContact OD2-NE2 3.09Å; F327-H348 HydrophobicContact CD2-CB 3.82Å; F327-H348 AromaticContact CD2-CG 3.64Å; F327-H348 AromaticContact CD2-ND1 3.62Å; F327-H348 HydrophobicContact CE2-CB 4.19Å; M340-H348 HydrophobicContact SD-CB 4.43Å; Q344-H348 PolarHBondContact O-N 3.04Å; Q344-H348 VanDerWaalsContact O-N 3.07Å; A345-H348 WeakPolarHBondContact O-CB 3.43Å; A345-H348 PolarHBondContact O-N 3.38Å; H348-W350 WeakPolarHBondContact ND1-CB 3.48Å; H348-W350 PolarHBondContact ND1-N 3.49Å; H348-W350 PolarHBondContact O-N 3.24Å; H348-W350 VanDerWaalsContact O-N 3.1Å; H348-V351 HydrophobicContact CB-CB 4.46Å; H348-V351 HydrophobicContact CB-CG2 4.25Å; H348-V351 WeakPolarHBondContact O-CA 3.46Å; H348-V351 PolarHBondContact O-N 3.31Å; H348-V352 PolarHBondContact O-N 3.3Å
349	P	94.3	Very high	84.6	Confident	76 Å²	76	47 Å²	47	49%	0.494	28%	0.276	S	S	.	.	H	α-helix	trans	-54.6	-36.4	-174.8	-29.3	36.1	0	0	0	114.6	L323 V351 S353	L323-P349 HydrophobicContact CD2-CB 4.41Å; P349-V351 VanDerWaalsContact C-N 3.34Å; P349-V351 PolarHBondContact O-N 2.89Å; P349-S353 VanDerWaalsContact O-CB 3.24Å; P349-S353 WeakPolarHBondContact O-CB 3.28Å; P349-S353 PolarHBondContact O-N 3.11Å; P349-S353 PolarHBondContact O-OG 3.17Å
350	W	94.4	Very high	83.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-58.8	-43.3	173.9	-171.4	56.7	0	0	0	113	E188 A191 T192 L195 L287 L323 A324 F327 H348 S353 A355	E188-W350 HydrophobicContact CB-CZ2 4.28Å; E188-W350 HydrophobicContact CG-CZ2 4.32Å; E188-W350 PolarHBondContact OE2-NE1 3.29Å; A191-W350 HydrophobicContact CB-CH2 4.13Å; A191-W350 HydrophobicContact CB-CZ2 4.32Å; T192-W350 HydrophobicContact CG2-CD2 3.66Å; T192-W350 HydrophobicContact CG2-CE3 3.91Å; T192-W350 HydrophobicContact CG2-CG 4.25Å; T192-W350 HydrophobicContact CG2-CH2 3.95Å; T192-W350 HydrophobicContact CG2-CZ2 3.68Å; T192-W350 HydrophobicContact CG2-CZ3 4.06Å; T192-W350 WeakPolarHBondContact CG2-O 3.42Å; L195-W350 HydrophobicContact CD1-CH2 3.76Å; L195-W350 HydrophobicContact CD1-CZ3 3.55Å; L287-W350 HydrophobicContact CD1-CH2 3.89Å; L287-W350 HydrophobicContact CD1-CZ2 3.87Å; L287-W350 HydrophobicContact CD2-CH2 4.34Å; L287-W350 HydrophobicContact CD2-CZ2 4.07Å; L287-W350 HydrophobicContact CG-CH2 4.42Å; L287-W350 HydrophobicContact CG-CZ2 4.48Å; L323-W350 HydrophobicContact CB-CB 3.95Å; L323-W350 HydrophobicContact CB-CG 4.27Å; A324-W350 HydrophobicContact CB-CD2 4.09Å; A324-W350 HydrophobicContact CB-CG 4.39Å; A324-W350 HydrophobicContact CB-CZ2 3.83Å; F327-W350 HydrophobicContact CB-CD2 4.46Å; F327-W350 HydrophobicContact CB-CE3 3.86Å; F327-W350 AromaticContact CD1-CE3 3.53Å; F327-W350 HydrophobicContact CD1-CE3 3.53Å; F327-W350 AromaticContact CD1-CZ3 3.46Å; F327-W350 HydrophobicContact CD1-CZ3 3.46Å; F327-W350 VanDerWaalsContact CD1-CZ3 3.46Å; F327-W350 HydrophobicContact CD2-CE3 4.21Å; F327-W350 HydrophobicContact CE1-CE3 4.09Å; F327-W350 AromaticContact CE1-CZ3 3.78Å; F327-W350 HydrophobicContact CE1-CZ3 3.78Å; F327-W350 AromaticContact CG-CE3 3.58Å; F327-W350 HydrophobicContact CG-CE3 3.58Å; F327-W350 HydrophobicContact CG-CZ3 4.04Å; H348-W350 WeakPolarHBondContact ND1-CB 3.48Å; H348-W350 PolarHBondContact ND1-N 3.49Å; H348-W350 PolarHBondContact O-N 3.24Å; H348-W350 VanDerWaalsContact O-N 3.1Å; W350-S353 PolarHBondContact O-OG 3.45Å; W350-A355 PolarHBondContact O-N 3.31Å
351	V	93.1	Very high	82.4	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.006	33%	0.334	C	S	.	.	H	α-helix	trans	-79.6	-43.1	-175.8	-179.8	0	0	0	0	111	Q196 L199 F327 A345 H348 P349 M354	Q196-V351 HydrophobicContact CG-CG1 3.56Å; Q196-V351 PolarHBondContact NE2-O 3.29Å; L199-V351 HydrophobicContact CD1-CG1 4.47Å; F327-V351 HydrophobicContact CD2-CG2 3.89Å; F327-V351 HydrophobicContact CE2-CG2 3.49Å; F327-V351 VanDerWaalsContact CE2-CG2 3.49Å; F327-V351 HydrophobicContact CZ-CG2 3.95Å; A345-V351 WeakPolarHBondContact O-CG2 3.28Å; H348-V351 HydrophobicContact CB-CB 4.46Å; H348-V351 HydrophobicContact CB-CG2 4.25Å; H348-V351 WeakPolarHBondContact O-CA 3.46Å; H348-V351 PolarHBondContact O-N 3.31Å; P349-V351 VanDerWaalsContact C-N 3.34Å; P349-V351 PolarHBondContact O-N 2.89Å; V351-M354 PolarHBondContact O-N 3.27Å
352	V	88.4	Confident	81.8	Confident	90 Å²	90	61 Å²	61	55%	0.545	34%	0.34	S	S	.	.	H	α-helix	trans	-68.3	-43.1	-178.7	175.4	0	0	0	0	111.8	L346 K347 H348 M354	L346-V352 VanDerWaalsContact O-CG2 3.25Å; L346-V352 WeakPolarHBondContact O-CG2 3.44Å; K347-V352 VanDerWaalsContact C-CG2 3.45Å; K347-V352 WeakPolarHBondContact O-CG2 3.48Å; H348-V352 PolarHBondContact O-N 3.3Å; V352-M354 PolarHBondContact O-N 3.07Å
353	S	79.4	Confident	81.3	Confident	41 Å²	41	61 Å²	61	29%	0.287	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-4	178.2	63.4	0	0	0	0	113.9	P349 W350 A355 A356	P349-S353 VanDerWaalsContact O-CB 3.24Å; P349-S353 WeakPolarHBondContact O-CB 3.28Å; P349-S353 PolarHBondContact O-N 3.11Å; P349-S353 PolarHBondContact O-OG 3.17Å; W350-S353 PolarHBondContact O-OG 3.45Å; S353-A355 PolarHBondContact O-N 3.48Å; S353-A355 VanDerWaalsContact O-N 3.11Å; S353-A356 WeakPolarHBondContact O-CB 3.3Å; S353-A356 PolarHBondContact O-N 3.47Å
354	M	66.1	Low	81	Confident	58 Å²	58	57.6 Å²	57.6	29%	0.286	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	33.7	-170.4	-58.2	-161.7	79.7	0	0	113.2	R189 R193 V351 V352 A356	R189-M354 VanDerWaalsContact CG-O 3.28Å; R189-M354 WeakPolarHBondContact CG-O 3.36Å; R193-M354 HydrophobicContact CG-CE 3.76Å; V351-M354 PolarHBondContact O-N 3.27Å; V352-M354 PolarHBondContact O-N 3.07Å; M354-A356 PolarHBondContact O-N 3.32Å; M354-A356 VanDerWaalsContact O-N 3.17Å
355	A	59.5	Low	80.6	Confident	5 Å²	5	61.7 Å²	61.7	4%	0.041	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	25.4	-174.4	0	0	0	0	0	114	E188 R189 T192 W350 S353 S357 S358	E188-A355 HydrophobicContact CB-CB 3.84Å; R189-A355 HydrophobicContact CB-CB 3.98Å; T192-A355 HydrophobicContact CG2-CB 4.27Å; W350-A355 PolarHBondContact O-N 3.31Å; S353-A355 PolarHBondContact O-N 3.48Å; S353-A355 VanDerWaalsContact O-N 3.11Å; A355-S357 PolarHBondContact O-N 3.15Å; A355-S358 WeakPolarHBondContact O-CB 3.48Å; A355-S358 PolarHBondContact O-N 3.29Å
356	A	52.2	Low	80.2	Confident	83 Å²	83	63 Å²	63	69%	0.686	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.1	177.3	0	0	0	0	0	113.7	S353 M354	S353-A356 WeakPolarHBondContact O-CB 3.3Å; S353-A356 PolarHBondContact O-N 3.47Å; M354-A356 PolarHBondContact O-N 3.32Å; M354-A356 VanDerWaalsContact O-N 3.17Å
357	S	53.3	Low	79.9	Confident	110 Å²	110	61.5 Å²	61.5	77%	0.769	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	5	170.3	-48.6	0	0	0	0	113	A355	A355-S357 PolarHBondContact O-N 3.15Å
358	S	59.4	Low	79.5	Confident	15 Å²	15	54.8 Å²	54.8	11%	0.105	31%	0.305	C	S	.	.	S	Bend	trans	-93.7	168.7	-179	-83.1	0	0	0	0	112.3	E188 S321 A355 M360	E188-S358 WeakPolarHBondContact OE2-CB 3.33Å; E188-S358 PolarHBondContact OE2-OG 3.43Å; S321-S358 PolarHBondContact OG-OG 2.81Å; A355-S358 WeakPolarHBondContact O-CB 3.48Å; A355-S358 PolarHBondContact O-N 3.29Å; S358-M360 PolarHBondContact O-N 2.65Å; S358-M360 VanDerWaalsContact O-N 3.09Å
359	S	62	Low	79.2	Confident	31 Å²	31	59.3 Å²	59.3	22%	0.217	33%	0.326	C	S	.	.			trans	-52	107.4	173.3	-167.3	0	0	0	0	112.5	S319 K361	S319-S359 VanDerWaalsContact O-CB 3.31Å; S319-S359 WeakPolarHBondContact O-CB 3.42Å; S319-S359 PolarHBondContact O-OG 3.09Å; S359-K361 PolarHBondContact O-N 2.84Å; S359-K361 WeakPolarHBondContact OG-CB 3.5Å; S359-K361 WeakPolarHBondContact OG-CD 3.21Å; S359-K361 VanDerWaalsContact OG-CG 3.3Å; S359-K361 WeakPolarHBondContact OG-CG 3.5Å
360	M	69.3	Low	79	Confident	168 Å²	168	57 Å²	57	83%	0.828	31%	0.31	S	S	*	.			trans	-74.7	8.9	166.8	-66.5	-156.9	-63.4	0	0	113	S358 N362	S358-M360 PolarHBondContact O-N 2.65Å; S358-M360 VanDerWaalsContact O-N 3.09Å; M360-N362 PolarHBondContact O-N 2.84Å
361	K	79.5	Confident	78.7	Confident	117 Å²	117	57.5 Å²	57.5	51%	0.509	31%	0.313	S	S	.	.			trans	-61.1	134.5	175.7	-64.7	-179.8	-173.4	-177	0	109.7	S319 S359 L363	S319-K361 WeakPolarHBondContact OG-CD 3.39Å; S319-K361 PolarHBondContact OG-NZ 3.08Å; S359-K361 PolarHBondContact O-N 2.84Å; S359-K361 WeakPolarHBondContact OG-CB 3.5Å; S359-K361 WeakPolarHBondContact OG-CD 3.21Å; S359-K361 VanDerWaalsContact OG-CG 3.3Å; S359-K361 WeakPolarHBondContact OG-CG 3.5Å; K361-L363 HydrophobicContact CB-CD2 4.26Å; K361-L363 PolarHBondContact O-N 3.19Å; K361-L363 VanDerWaalsContact O-N 3.15Å
362	N	85.8	Confident	78.4	Confident	89 Å²	89	61.8 Å²	61.8	48%	0.476	34%	0.335	S	S	.	.			trans	-73.5	105.3	175.2	-174.9	9.9	0	0	0	110.2	G184 S185 F186 M360 H364	G184-N362 PolarHBondContact O-ND2 2.84Å; S185-N362 WeakPolarHBondContact CA-OD1 3.44Å; F186-N362 PolarHBondContact N-OD1 2.9Å; F186-N362 PolarHBondContact O-OD1 3.35Å; M360-N362 PolarHBondContact O-N 2.84Å; N362-H364 VanDerWaalsContact C-N 3.3Å; N362-H364 WeakPolarHBondContact OD1-CB 3.35Å; N362-H364 PolarHBondContact OD1-N 3.45Å; N362-H364 VanDerWaalsContact OD1-N 3.16Å
363	L	87.4	Confident	78.3	Confident	5 Å²	5	63.3 Å²	63.3	3%	0.026	33%	0.334	C	S	.	.			trans	-82.5	-9.3	-179.1	-49.5	-176	0	0	0	112.6	F186 P316 V320 K361 R365 S366 I367	F186-L363 PolarHBondContact O-N 2.71Å; P316-L363 HydrophobicContact CB-CD2 4.25Å; V320-L363 HydrophobicContact CG2-CD1 3.92Å; K361-L363 HydrophobicContact CB-CD2 4.26Å; K361-L363 PolarHBondContact O-N 3.19Å; K361-L363 VanDerWaalsContact O-N 3.15Å; L363-R365 VanDerWaalsContact C-N 3.3Å; L363-R365 PolarHBondContact O-N 3.21Å; L363-R365 VanDerWaalsContact O-N 3.15Å; L363-S366 PolarHBondContact O-N 3.4Å; L363-I367 HydrophobicContact CB-CD1 3.54Å; L363-I367 HydrophobicContact CB-CG1 4.24Å; L363-I367 HydrophobicContact CD1-CD1 4.47Å; L363-I367 WeakPolarHBondContact O-CG1 3.38Å; L363-I367 PolarHBondContact O-N 3.25Å; L363-I367 VanDerWaalsContact O-N 3.16Å
364	H	91.1	Very high	78.4	Confident	25 Å²	25	62.6 Å²	62.6	12%	0.116	33%	0.325	C	S	.	.	H	α-helix	trans	-50.3	-42.2	-171	-179.5	-86.5	0	0	0	114.7	I180 I181 G184 F186 N362 S368	I180-H364 PolarHBondContact O-CD2 3.09Å; I180-H364 PolarHBondContact O-NE2 3.19Å; I181-H364 PolarHBondContact O-CE1 2.88Å; I181-H364 PolarHBondContact O-NE2 3.11Å; G184-H364 VanDerWaalsContact C-CG 3.49Å; G184-H364 PolarHBondContact N-NE2 2.86Å; F186-H364 HydrophobicContact CB-CB 4.11Å; N362-H364 VanDerWaalsContact C-N 3.3Å; N362-H364 WeakPolarHBondContact OD1-CB 3.35Å; N362-H364 PolarHBondContact OD1-N 3.45Å; N362-H364 VanDerWaalsContact OD1-N 3.16Å; H364-S368 PolarHBondContact CD2-OG 2.94Å; H364-S368 PolarHBondContact CE1-OG 3.1Å; H364-S368 PolarHBondContact NE2-OG 3.33Å; H364-S368 VanDerWaalsContact NE2-OG 3.1Å; H364-S368 WeakPolarHBondContact O-CB 3.49Å; H364-S368 PolarHBondContact O-N 2.79Å; H364-S368 PolarHBondContact O-OG 3.41Å
365	R	89	Confident	79	Confident	190 Å²	190	62.3 Å²	62.3	72%	0.717	33%	0.332	S	S	*	.	H	α-helix	trans	-60.6	-50.4	-176.3	-178.1	176.5	-71.3	150.7	-2.6	111.4	L363 Q369	L363-R365 VanDerWaalsContact C-N 3.3Å; L363-R365 PolarHBondContact O-N 3.21Å; L363-R365 VanDerWaalsContact O-N 3.15Å; R365-Q369 WeakPolarHBondContact O-CB 3.48Å; R365-Q369 VanDerWaalsContact O-CG 3.24Å; R365-Q369 WeakPolarHBondContact O-CG 3.36Å; R365-Q369 PolarHBondContact O-N 2.7Å; R365-Q369 VanDerWaalsContact O-N 3.12Å
366	S	89.4	Confident	79.7	Confident	28 Å²	28	65.1 Å²	65.1	20%	0.196	35%	0.351	C	S	.	.	H	α-helix	trans	-68.1	-47.4	-179.6	-50.8	0	0	0	0	110.9	L363 S368 Q369 N370	L363-S366 PolarHBondContact O-N 3.4Å; S366-S368 PolarHBondContact O-N 3.08Å; S366-Q369 PolarHBondContact O-N 3.2Å; S366-N370 WeakPolarHBondContact O-CB 3.36Å; S366-N370 PolarHBondContact O-N 3.44Å; S366-N370 PolarHBondContact O-ND2 3.16Å
367	I	89.9	Confident	80.4	Confident	1 Å²	1	64 Å²	64	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-58.1	-51.1	179.2	-64.9	169.9	0	0	0	110.9	I180 F186 L287 P316 L363 Q369 N370 L371	I180-I367 HydrophobicContact CG2-CG2 4.03Å; F186-I367 HydrophobicContact CD1-CD1 3.75Å; F186-I367 HydrophobicContact CE1-CD1 4.37Å; L287-I367 WeakPolarHBondContact O-CD1 3.27Å; L287-I367 WeakPolarHBondContact O-CG1 3.43Å; P316-I367 HydrophobicContact CG-CG1 4.28Å; L363-I367 HydrophobicContact CB-CD1 3.54Å; L363-I367 HydrophobicContact CB-CG1 4.24Å; L363-I367 HydrophobicContact CD1-CD1 4.47Å; L363-I367 WeakPolarHBondContact O-CG1 3.38Å; L363-I367 PolarHBondContact O-N 3.25Å; L363-I367 VanDerWaalsContact O-N 3.16Å; I367-Q369 PolarHBondContact O-N 3.2Å; I367-N370 PolarHBondContact O-N 3.31Å; I367-L371 HydrophobicContact CG2-CD1 3.82Å; I367-L371 HydrophobicContact CG2-CG 4.34Å; I367-L371 WeakPolarHBondContact O-CG 3.3Å; I367-L371 PolarHBondContact O-N 3.5Å
368	S	89	Confident	80.8	Confident	8 Å²	8	63.4 Å²	63.4	6%	0.056	32%	0.319	C	S	.	.	H	α-helix	trans	-66.5	-40	-177	-58.1	0	0	0	0	112.3	H364 S366 N370 L371 L372	H364-S368 PolarHBondContact CD2-OG 2.94Å; H364-S368 PolarHBondContact CE1-OG 3.1Å; H364-S368 PolarHBondContact NE2-OG 3.33Å; H364-S368 VanDerWaalsContact NE2-OG 3.1Å; H364-S368 WeakPolarHBondContact O-CB 3.49Å; H364-S368 PolarHBondContact O-N 2.79Å; H364-S368 PolarHBondContact O-OG 3.41Å; S366-S368 PolarHBondContact O-N 3.08Å; S368-N370 VanDerWaalsContact C-N 3.32Å; S368-N370 PolarHBondContact O-N 3.08Å; S368-L371 PolarHBondContact O-N 3.13Å; S368-L372 WeakPolarHBondContact O-CB 3.33Å; S368-L372 WeakPolarHBondContact O-CD1 3.18Å; S368-L372 WeakPolarHBondContact O-CG 3.39Å; S368-L372 PolarHBondContact O-N 3.08Å
369	Q	89.8	Confident	80.1	Confident	104 Å²	104	66.4 Å²	66.4	49%	0.486	34%	0.34	S	S	.	.	H	α-helix	trans	-61.7	-41.2	173.4	-76	-179.5	7.9	0	0	111.8	R365 S366 I367 K373	R365-Q369 WeakPolarHBondContact O-CB 3.48Å; R365-Q369 VanDerWaalsContact O-CG 3.24Å; R365-Q369 WeakPolarHBondContact O-CG 3.36Å; R365-Q369 PolarHBondContact O-N 2.7Å; R365-Q369 VanDerWaalsContact O-N 3.12Å; S366-Q369 PolarHBondContact O-N 3.2Å; I367-Q369 PolarHBondContact O-N 3.2Å; Q369-K373 WeakPolarHBondContact O-CB 3.48Å; Q369-K373 WeakPolarHBondContact O-CD 3.5Å; Q369-K373 WeakPolarHBondContact O-CG 3.09Å; Q369-K373 PolarHBondContact O-N 3.43Å
370	N	90.4	Very high	79.1	Confident	27 Å²	27	71.6 Å²	71.6	14%	0.144	36%	0.36	C	S	.	.	H	α-helix	trans	-69.1	-42.6	179.9	-69.1	-15.9	0	0	0	111.9	S288 G289 T290 E315 S366 I367 S368 L372 K373 R374	S288-N370 WeakPolarHBondContact O-CB 3.49Å; S288-N370 PolarHBondContact O-ND2 3.35Å; G289-N370 CarbonylContact O-C 3.51Å; T290-N370 HydrophobicContact CG2-CB 3.78Å; E315-N370 PolarHBondContact O-ND2 2.87Å; S366-N370 WeakPolarHBondContact O-CB 3.36Å; S366-N370 PolarHBondContact O-N 3.44Å; S366-N370 PolarHBondContact O-ND2 3.16Å; I367-N370 PolarHBondContact O-N 3.31Å; S368-N370 VanDerWaalsContact C-N 3.32Å; S368-N370 PolarHBondContact O-N 3.08Å; N370-L372 PolarHBondContact O-N 2.89Å; N370-K373 PolarHBondContact O-N 3.27Å; N370-K373 PolarHBondContact OD1-NZ 3.17Å; N370-R374 WeakPolarHBondContact O-CB 3.48Å; N370-R374 PolarHBondContact O-N 3.05Å
371	L	88.2	Confident	78	Confident	12 Å²	12	67.2 Å²	67.2	6%	0.063	35%	0.347	C	S	.	.	H	α-helix	trans	-60.1	-45.2	172.9	-69.5	171	0	0	0	112.2	F177 I181 I285 I367 S368 R374 A375	F177-L371 HydrophobicContact CB-CD1 4.12Å; F177-L371 HydrophobicContact CB-CD2 4.3Å; F177-L371 HydrophobicContact CD2-CD2 3.79Å; F177-L371 HydrophobicContact CE2-CD2 4.3Å; F177-L371 HydrophobicContact CG-CD1 4.43Å; F177-L371 HydrophobicContact CG-CD2 4.09Å; I181-L371 HydrophobicContact CD1-CB 4.01Å; I181-L371 HydrophobicContact CD1-CD1 4.32Å; I181-L371 HydrophobicContact CG1-CB 4.26Å; I181-L371 HydrophobicContact CG1-CD1 3.95Å; I285-L371 HydrophobicContact CG2-CD2 4.01Å; I367-L371 HydrophobicContact CG2-CD1 3.82Å; I367-L371 HydrophobicContact CG2-CG 4.34Å; I367-L371 WeakPolarHBondContact O-CG 3.3Å; I367-L371 PolarHBondContact O-N 3.5Å; S368-L371 PolarHBondContact O-N 3.13Å; L371-R374 PolarHBondContact O-N 3.39Å; L371-A375 PolarHBondContact O-N 3.24Å
372	L	87.1	Confident	76.1	Confident	90 Å²	90	65.9 Å²	65.9	47%	0.471	35%	0.348	S	S	.	.	H	α-helix	trans	-66.9	-38	179.5	-72.3	168.6	0	0	0	112.7	I181 S368 N370 S376	I181-L372 HydrophobicContact CD1-CD2 4.26Å; I181-L372 HydrophobicContact CD1-CG 4.39Å; I181-L372 HydrophobicContact CG2-CD1 4.41Å; I181-L372 HydrophobicContact CG2-CD2 4.38Å; I181-L372 HydrophobicContact CG2-CG 4.47Å; S368-L372 WeakPolarHBondContact O-CB 3.33Å; S368-L372 WeakPolarHBondContact O-CD1 3.18Å; S368-L372 WeakPolarHBondContact O-CG 3.39Å; S368-L372 PolarHBondContact O-N 3.08Å; N370-L372 PolarHBondContact O-N 2.89Å; L372-S376 WeakPolarHBondContact O-CB 3.49Å; L372-S376 PolarHBondContact O-N 2.99Å; L372-S376 PolarHBondContact O-OG 3.05Å
373	K	86.9	Confident	73.6	Confident	123 Å²	123	68.9 Å²	68.9	54%	0.535	36%	0.357	S	S	.	.	H	α-helix	trans	-60.2	-46.8	171.2	-71.7	163.4	-167	166.8	0	110.8	Q369 N370 S376 S377	Q369-K373 WeakPolarHBondContact O-CB 3.48Å; Q369-K373 WeakPolarHBondContact O-CD 3.5Å; Q369-K373 WeakPolarHBondContact O-CG 3.09Å; Q369-K373 PolarHBondContact O-N 3.43Å; N370-K373 PolarHBondContact O-N 3.27Å; N370-K373 PolarHBondContact OD1-NZ 3.17Å; K373-S376 WeakPolarHBondContact O-CB 3.46Å; K373-S376 PolarHBondContact O-N 3.38Å; K373-S376 VanDerWaalsContact O-N 3.17Å; K373-S377 PolarHBondContact O-N 2.75Å
374	R	81.4	Confident	71	Confident	25 Å²	25	72 Å²	72	9%	0.094	38%	0.38	C	S	.	.	H	α-helix	trans	-66.4	-38	-179.7	-175.5	177.4	172.7	-139.2	-7	113.2	M291 E294 N370 L371 S376 S377 R378	M291-R374 VanDerWaalsContact CG-CZ 3.49Å; M291-R374 PolarHBondContact SD-NH1 3.42Å; M291-R374 PolarHBondContact SD-NH2 3.19Å; E294-R374 IonicContact OE1-NE 3.27Å; N370-R374 WeakPolarHBondContact O-CB 3.48Å; N370-R374 PolarHBondContact O-N 3.05Å; L371-R374 PolarHBondContact O-N 3.39Å; R374-S376 VanDerWaalsContact C-N 3.32Å; R374-S377 PolarHBondContact O-OG 3.1Å; R374-S377 VanDerWaalsContact O-OG 3.08Å; R374-R378 PolarHBondContact O-N 3.05Å
375	A	78.1	Confident	68.3	Low	52 Å²	52	74 Å²	74	43%	0.43	40%	0.4	S	S	.	.	H	α-helix	trans	-62.2	-42.1	171	0	0	0	0	0	111.2	L371 C379	L371-A375 PolarHBondContact O-N 3.24Å; A375-C379 PolarHBondContact O-N 3.36Å; A375-C379 VanDerWaalsContact O-N 3.13Å; A375-C379 PolarHBondContact O-SG 3.25Å; A375-C379 VanDerWaalsContact O-SG 3.39Å
376	S	73.6	Confident	65.7	Low	64 Å²	64	72.5 Å²	72.5	45%	0.448	40%	0.401	S	S	.	.	H	α-helix	trans	-65.8	-43.6	179.7	-56.9	0	0	0	0	112.9	L372 K373 R374 C379 Q380	L372-S376 WeakPolarHBondContact O-CB 3.49Å; L372-S376 PolarHBondContact O-N 2.99Å; L372-S376 PolarHBondContact O-OG 3.05Å; K373-S376 WeakPolarHBondContact O-CB 3.46Å; K373-S376 PolarHBondContact O-N 3.38Å; K373-S376 VanDerWaalsContact O-N 3.17Å; R374-S376 VanDerWaalsContact C-N 3.32Å; S376-C379 PolarHBondContact O-N 3.21Å; S376-Q380 WeakPolarHBondContact O-CG 3.41Å; S376-Q380 PolarHBondContact O-N 2.76Å
377	S	66.9	Low	62.9	Low	61 Å²	61	75.9 Å²	75.9	43%	0.427	43%	0.425	S	S	.	.	H	α-helix	trans	-65.5	-42.9	178.7	62.7	0	0	0	0	112.3	K373 R374 C379 Q380 S381	K373-S377 PolarHBondContact O-N 2.75Å; R374-S377 PolarHBondContact O-OG 3.1Å; R374-S377 VanDerWaalsContact O-OG 3.08Å; S377-C379 VanDerWaalsContact C-N 3.3Å; S377-C379 PolarHBondContact O-N 2.78Å; S377-Q380 PolarHBondContact O-N 3.23Å; S377-Q380 VanDerWaalsContact O-N 3.1Å; S377-S381 PolarHBondContact O-N 3.33Å
378	R	62.5	Low	60.1	Low	96 Å²	96	80.7 Å²	80.7	36%	0.362	46%	0.455	S	S	.	.	H	α-helix	trans	-57	-41.8	172.2	-79.2	-179.5	162.1	-166.2	-4.9	111.7	E218 E258 R374 Q380 S381 T382	E218-R378 IonicContact OE1-NH1 3.85Å; E258-R378 IonicContact OE1-CZ 3.34Å; E258-R378 IonicContact OE1-NH2 3.46Å; E258-R378 PolarHBondContact OE1-NH2 3.31Å; R374-R378 PolarHBondContact O-N 3.05Å; R378-Q380 PolarHBondContact O-N 2.72Å; R378-S381 PolarHBondContact O-N 3.47Å; R378-T382 PolarHBondContact O-N 3.09Å; R378-T382 PolarHBondContact O-OG1 3.02Å
379	C	45.5	Very low	57.4	Low	78 Å²	78	91.6 Å²	91.6	53%	0.527	50%	0.495	S	S	.	.	H	α-helix	trans	-69.3	-24.7	176.1	-75.2	0	0	0	0	114.8	A375 S376 S377 T382 K383	A375-C379 PolarHBondContact O-N 3.36Å; A375-C379 VanDerWaalsContact O-N 3.13Å; A375-C379 PolarHBondContact O-SG 3.25Å; A375-C379 VanDerWaalsContact O-SG 3.39Å; S376-C379 PolarHBondContact O-N 3.21Å; S377-C379 VanDerWaalsContact C-N 3.3Å; S377-C379 PolarHBondContact O-N 2.78Å; C379-T382 PolarHBondContact O-OG1 2.97Å; C379-K383 WeakPolarHBondContact O-CG 3.18Å
380	Q	41	Very low	55	Low	140 Å²	140	91.6 Å²	91.6	65%	0.654	51%	0.506	S	S	*	.	H	α-helix	trans	-78.8	-39.9	172.5	-70.8	176.8	-0.1	0	0	111.4	S376 S377 R378 T382 K383 S384	S376-Q380 WeakPolarHBondContact O-CG 3.41Å; S376-Q380 PolarHBondContact O-N 2.76Å; S377-Q380 PolarHBondContact O-N 3.23Å; S377-Q380 VanDerWaalsContact O-N 3.1Å; R378-Q380 PolarHBondContact O-N 2.72Å; Q380-T382 VanDerWaalsContact C-N 3.34Å; Q380-T382 PolarHBondContact O-N 2.61Å; Q380-K383 PolarHBondContact O-N 2.86Å; Q380-K383 VanDerWaalsContact O-N 3.17Å; Q380-S384 PolarHBondContact O-N 2.68Å; Q380-S384 PolarHBondContact O-OG 2.85Å
381	S	45.3	Very low	52.1	Low	77 Å²	77	95.9 Å²	95.9	54%	0.538	54%	0.538	S	S	.	.	H	α-helix	trans	-59.1	-40.1	175.7	-171.4	0	0	0	0	112.9	S377 R378 K383 S384 A385	S377-S381 PolarHBondContact O-N 3.33Å; R378-S381 PolarHBondContact O-N 3.47Å; S381-K383 PolarHBondContact O-N 3.34Å; S381-S384 PolarHBondContact O-OG 2.85Å; S381-S384 VanDerWaalsContact O-OG 3.1Å; S381-A385 WeakPolarHBondContact O-CB 3.49Å; S381-A385 PolarHBondContact O-N 3.3Å; S381-A385 VanDerWaalsContact O-N 3.14Å
382	T	39.8	Very low	49.6	Very low	89 Å²	89	107.3 Å²	107.3	55%	0.546	58%	0.58	S	S	.	*	H	α-helix	trans	-70.1	-28.9	176.7	54.3	0	0	0	0	113.5	R378 C379 Q380	R378-T382 PolarHBondContact O-N 3.09Å; R378-T382 PolarHBondContact O-OG1 3.02Å; C379-T382 PolarHBondContact O-OG1 2.97Å; Q380-T382 VanDerWaalsContact C-N 3.34Å; Q380-T382 PolarHBondContact O-N 2.61Å
383	K	34.1	Very low	46.9	Very low	152 Å²	152	107.7 Å²	107.7	66%	0.661	59%	0.59	S	S	*	*	H	α-helix	trans	-74.1	-44.2	174.5	-73.4	-178.7	177	-175.3	0	112.3	C379 Q380 S381 A385 Q386 S387	C379-K383 WeakPolarHBondContact O-CG 3.18Å; Q380-K383 PolarHBondContact O-N 2.86Å; Q380-K383 VanDerWaalsContact O-N 3.17Å; S381-K383 PolarHBondContact O-N 3.34Å; K383-A385 VanDerWaalsContact C-N 3.27Å; K383-A385 PolarHBondContact O-N 2.85Å; K383-Q386 PolarHBondContact O-N 2.81Å; K383-S387 PolarHBondContact O-N 3.45Å
384	S	31.9	Very low	44.5	Very low	71 Å²	71	108.8 Å²	108.8	50%	0.497	61%	0.608	S	S	.	*	H	α-helix	trans	-65.6	-31.6	177.3	58	0	0	0	0	112.4	Q380 S381 Q386 S387	Q380-S384 PolarHBondContact O-N 2.68Å; Q380-S384 PolarHBondContact O-OG 2.85Å; S381-S384 PolarHBondContact O-OG 2.85Å; S381-S384 VanDerWaalsContact O-OG 3.1Å; S384-Q386 PolarHBondContact O-N 3.1Å; S384-S387 PolarHBondContact O-N 3.3Å
385	A	35.2	Very low	42.3	Very low	66 Å²	66	115.7 Å²	115.7	55%	0.545	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.7	-20.9	170.9	0	0	0	0	0	114.5	S381 K383	S381-A385 WeakPolarHBondContact O-CB 3.49Å; S381-A385 PolarHBondContact O-N 3.3Å; S381-A385 VanDerWaalsContact O-N 3.14Å; K383-A385 VanDerWaalsContact C-N 3.27Å; K383-A385 PolarHBondContact O-N 2.85Å
386	Q	33	Very low	40.6	Very low	158 Å²	158	117.3 Å²	117.3	74%	0.738	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-28.3	173.5	-71	-178.4	-23.6	0	0	112.8	K383 S384 T388	K383-Q386 PolarHBondContact O-N 2.81Å; S384-Q386 PolarHBondContact O-N 3.1Å; Q386-T388 VanDerWaalsContact C-N 3.32Å; Q386-T388 PolarHBondContact O-N 3.2Å
387	S	30.3	Very low	38.7	Very low	99 Å²	99	120.3 Å²	120.3	69%	0.692	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	3.5	-171.4	-150.7	0	0	0	0	115.7	K383 S384	K383-S387 PolarHBondContact O-N 3.45Å; S384-S387 PolarHBondContact O-N 3.3Å
388	T	31.4	Very low	37	Very low	103 Å²	103	125.9 Å²	125.9	63%	0.632	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	8	-171.6	47.3	0	0	0	0	114.9	Q386 S390	Q386-T388 VanDerWaalsContact C-N 3.32Å; Q386-T388 PolarHBondContact O-N 3.2Å; T388-S390 PolarHBondContact O-N 3.03Å
389	R	34	Very low	35.6	Very low	237 Å²	237	124 Å²	124	89%	0.894	68%	0.675	S	S	*	*			trans	-81.5	47.6	177.2	-68.2	-169.2	68.9	178.1	0.4	113.8
390	S	37.5	Very low	35	Very low	103 Å²	103	127 Å²	127	72%	0.72	68%	0.676	S	S	*	*	S	Bend	trans	-143.4	29.8	-175.9	51.7	0	0	0	0	115.4	T388	T388-S390 PolarHBondContact O-N 3.03Å
391	S	29.3	Very low	34.6	Very low	117 Å²	117	129.9 Å²	129.9	82%	0.818	68%	0.681	S	S	*	*			trans	-156.6	138.3	156.6	46.7	0	0	0	0	112.8
392	R	35.8	Very low	34.4	Very low	253 Å²	253	129.6 Å²	129.6	96%	0.955	68%	0.676	S	S	*	*			trans	-93.1	132.4	170.6	-94.9	178.5	164.5	172	-5.5	109.2
393	S	31.3	Very low	34.8	Very low	97 Å²	97	132.8 Å²	132.8	68%	0.678	68%	0.677	S	S	*	*			trans	-148	139	165.4	-170	0	0	0	0	110.9	K395	S393-K395 VanDerWaalsContact C-N 3.31Å; S393-K395 PolarHBondContact O-N 3.11Å; S393-K395 VanDerWaalsContact O-N 3.12Å
394	T	36.3	Very low	35.2	Very low	147 Å²	147	129.3 Å²	129.3	90%	0.902	66%	0.664	S	S	*	*	S	Bend	trans	-85.7	26.7	-159.6	40.5	0	0	0	0	115.6
395	K	36.3	Very low	35.8	Very low	169 Å²	169	133.9 Å²	133.9	74%	0.735	67%	0.67	S	S	*	*			trans	-92.2	2.3	-171.7	-71.4	-174.6	175.4	178.1	0	116.8	S393	S393-K395 VanDerWaalsContact C-N 3.31Å; S393-K395 PolarHBondContact O-N 3.11Å; S393-K395 VanDerWaalsContact O-N 3.12Å
396	S	40.7	Very low	36.5	Very low	87 Å²	87	135.1 Å²	135.1	61%	0.608	67%	0.665	S	S	*	*	H	α-helix	trans	-69.9	-37.7	-165.8	58	0	0	0	0	116.4	R400	S396-R400 PolarHBondContact O-N 3.3Å
397	N	33.7	Very low	37.1	Very low	126 Å²	126	131.4 Å²	131.4	67%	0.674	65%	0.649	S	S	*	*	H	α-helix	trans	-70.3	-37	-169.8	-83.1	-11.5	0	0	0	114.4	R400 R401	N397-R400 PolarHBondContact O-N 3.13Å; N397-R401 PolarHBondContact O-N 3.41Å
398	K	31.2	Very low	38.2	Very low	178 Å²	178	133.1 Å²	133.1	77%	0.774	64%	0.641	S	S	*	*	H	α-helix	trans	-66.8	-46.5	-178.8	-146.2	173.7	-172.4	179	0	110.5	R400 R401 V402	K398-R400 VanDerWaalsContact C-N 3.26Å; K398-R400 PolarHBondContact O-N 3.43Å; K398-R401 PolarHBondContact O-N 2.96Å; K398-V402 WeakPolarHBondContact O-CG2 3.34Å; K398-V402 PolarHBondContact O-N 3.3Å
399	S	34.3	Very low	39.3	Very low	56 Å²	56	131.8 Å²	131.8	39%	0.392	63%	0.627	S	S	.	*	H	α-helix	trans	-66.3	-21.9	177.3	-52.2	0	0	0	0	114.2	R403	S399-R403 WeakPolarHBondContact O-CG 3.48Å; S399-R403 PolarHBondContact O-NE 3.49Å
400	R	31.9	Very low	40.1	Very low	143 Å²	143	123 Å²	123	54%	0.54	60%	0.597	S	S	.	*	H	α-helix	trans	-76.5	-47.4	175	-148.8	-169.5	109.1	166	5.9	111.7	S396 N397 K398 V402 R403 E404	S396-R400 PolarHBondContact O-N 3.3Å; N397-R400 PolarHBondContact O-N 3.13Å; K398-R400 VanDerWaalsContact C-N 3.26Å; K398-R400 PolarHBondContact O-N 3.43Å; R400-V402 VanDerWaalsContact C-N 3.3Å; R400-V402 PolarHBondContact O-N 2.9Å; R400-R403 PolarHBondContact O-N 3.32Å; R400-E404 IonicContact CZ-OE1 3.3Å; R400-E404 VanDerWaalsContact CZ-OE1 3.23Å; R400-E404 IonicContact NE-OE1 2.78Å; R400-E404 PolarHBondContact NE-OE1 2.9Å; R400-E404 IonicContact NH2-OE1 3.2Å; R400-E404 PolarHBondContact NH2-OE1 3.21Å; R400-E404 PolarHBondContact O-N 3.47Å; R400-E404 VanDerWaalsContact O-N 3.13Å
401	R	33.8	Very low	40.6	Very low	200 Å²	200	120.5 Å²	120.5	76%	0.755	58%	0.576	S	S	*	*	H	α-helix	trans	-61.2	-36	176.6	-71.8	-176.1	174.2	-177.7	-2.2	112.5	N397 K398 R405	N397-R401 PolarHBondContact O-N 3.41Å; K398-R401 PolarHBondContact O-N 2.96Å; R401-R405 WeakPolarHBondContact O-CB 3.41Å; R401-R405 PolarHBondContact O-N 3.49Å
402	V	40.2	Very low	41.8	Very low	71 Å²	71	119.6 Å²	119.6	43%	0.43	56%	0.562	S	S	.	*	H	α-helix	trans	-61.5	-48.9	174.6	170.8	0	0	0	0	111.6	K398 R400 E404 R405 E406	K398-V402 WeakPolarHBondContact O-CG2 3.34Å; K398-V402 PolarHBondContact O-N 3.3Å; R400-V402 VanDerWaalsContact C-N 3.3Å; R400-V402 PolarHBondContact O-N 2.9Å; V402-E404 PolarHBondContact O-N 2.84Å; V402-R405 WeakPolarHBondContact O-CB 3.42Å; V402-R405 PolarHBondContact O-N 2.99Å; V402-R405 VanDerWaalsContact O-N 3.14Å; V402-E406 HydrophobicContact CG1-CG 4.35Å; V402-E406 WeakPolarHBondContact CG1-OE1 3.21Å; V402-E406 WeakPolarHBondContact O-CG 3.31Å; V402-E406 PolarHBondContact O-N 3.42Å
403	R	48.4	Very low	42.6	Very low	155 Å²	155	115.2 Å²	115.2	59%	0.585	55%	0.545	S	S	*	.	H	α-helix	trans	-63.8	-37.6	178.9	-65.5	169.7	-160.2	168.2	3.7	113.2	S399 R400 R405 L407	S399-R403 WeakPolarHBondContact O-CG 3.48Å; S399-R403 PolarHBondContact O-NE 3.49Å; R400-R403 PolarHBondContact O-N 3.32Å; R403-R405 VanDerWaalsContact C-N 3.32Å; R403-L407 PolarHBondContact O-N 3.29Å; R403-L407 VanDerWaalsContact O-N 3.09Å
404	E	42.3	Very low	43.5	Very low	80 Å²	80	113.1 Å²	113.1	37%	0.374	52%	0.523	S	S	.	.	H	α-helix	trans	-66	-35.5	175.3	-71.8	171.5	-163.1	0	0	111.4	R400 V402 R408	R400-E404 IonicContact CZ-OE1 3.3Å; R400-E404 VanDerWaalsContact CZ-OE1 3.23Å; R400-E404 IonicContact NE-OE1 2.78Å; R400-E404 PolarHBondContact NE-OE1 2.9Å; R400-E404 IonicContact NH2-OE1 3.2Å; R400-E404 PolarHBondContact NH2-OE1 3.21Å; R400-E404 PolarHBondContact O-N 3.47Å; R400-E404 VanDerWaalsContact O-N 3.13Å; V402-E404 PolarHBondContact O-N 2.84Å; E404-R408 WeakPolarHBondContact O-CG 3.45Å; E404-R408 PolarHBondContact O-N 2.84Å
405	R	43.6	Very low	43.8	Very low	167 Å²	167	111 Å²	111	63%	0.63	50%	0.503	S	S	*	.	H	α-helix	trans	-69.5	-47.2	173.2	-178.8	176.2	172.4	162.4	3	112.2	R401 V402 R403 L407 R408 E409	R401-R405 WeakPolarHBondContact O-CB 3.41Å; R401-R405 PolarHBondContact O-N 3.49Å; V402-R405 WeakPolarHBondContact O-CB 3.42Å; V402-R405 PolarHBondContact O-N 2.99Å; V402-R405 VanDerWaalsContact O-N 3.14Å; R403-R405 VanDerWaalsContact C-N 3.32Å; R405-L407 VanDerWaalsContact C-N 3.29Å; R405-L407 PolarHBondContact O-N 3.12Å; R405-R408 PolarHBondContact O-N 3.41Å; R405-R408 VanDerWaalsContact O-N 3.09Å; R405-E409 HydrophobicContact CG-CG 4.42Å; R405-E409 IonicContact CZ-OE1 3.85Å; R405-E409 VanDerWaalsContact CZ-OE1 3.27Å; R405-E409 IonicContact NE-OE1 2.78Å; R405-E409 PolarHBondContact NE-OE1 3.42Å; R405-E409 IonicContact NH2-OE1 2.8Å; R405-E409 PolarHBondContact NH2-OE1 3.5Å; R405-E409 PolarHBondContact O-N 3.04Å
406	E	50.1	Low	44.7	Very low	92 Å²	92	109.4 Å²	109.4	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-55.8	-41.1	176.3	-73.8	169.7	-179.1	0	0	112.3	V402 L410	V402-E406 HydrophobicContact CG1-CG 4.35Å; V402-E406 WeakPolarHBondContact CG1-OE1 3.21Å; V402-E406 WeakPolarHBondContact O-CG 3.31Å; V402-E406 PolarHBondContact O-N 3.42Å; E406-L410 VanDerWaalsContact O-CB 3.31Å; E406-L410 WeakPolarHBondContact O-CB 3.37Å; E406-L410 PolarHBondContact O-N 3.47Å
407	L	45.6	Very low	44.7	Very low	80 Å²	80	112.1 Å²	112.1	42%	0.419	50%	0.501	S	S	.	.	H	α-helix	trans	-66.6	-38.9	176.2	-114.8	74.4	0	0	0	112.6	T299 R403 R405 N411	T299-L407 HydrophobicContact CG2-CD1 3.98Å; R403-L407 PolarHBondContact O-N 3.29Å; R403-L407 VanDerWaalsContact O-N 3.09Å; R405-L407 VanDerWaalsContact C-N 3.29Å; R405-L407 PolarHBondContact O-N 3.12Å; L407-N411 WeakPolarHBondContact O-CB 3.3Å; L407-N411 PolarHBondContact O-N 3Å
408	R	53.4	Low	45.1	Very low	135 Å²	135	114.2 Å²	114.2	51%	0.509	50%	0.5	S	S	.	.	H	α-helix	trans	-66.2	-45.7	175.8	-70.9	177.6	-171.1	-157	3.3	111.5	E404 R405 L410 N411 L412	E404-R408 WeakPolarHBondContact O-CG 3.45Å; E404-R408 PolarHBondContact O-N 2.84Å; R405-R408 PolarHBondContact O-N 3.41Å; R405-R408 VanDerWaalsContact O-N 3.09Å; R408-L410 VanDerWaalsContact C-N 3.34Å; R408-L410 PolarHBondContact O-N 3.41Å; R408-N411 PolarHBondContact O-N 3.49Å; R408-L412 WeakPolarHBondContact O-CD1 3.42Å; R408-L412 PolarHBondContact O-N 2.76Å
409	E	54.7	Low	45.5	Very low	74 Å²	74	111.3 Å²	111.3	35%	0.346	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-35.5	178.3	-70.3	-178.3	-171.9	0	0	112.1	R405 R413	R405-E409 HydrophobicContact CG-CG 4.42Å; R405-E409 IonicContact CZ-OE1 3.85Å; R405-E409 VanDerWaalsContact CZ-OE1 3.27Å; R405-E409 IonicContact NE-OE1 2.78Å; R405-E409 PolarHBondContact NE-OE1 3.42Å; R405-E409 IonicContact NH2-OE1 2.8Å; R405-E409 PolarHBondContact NH2-OE1 3.5Å; R405-E409 PolarHBondContact O-N 3.04Å; E409-R413 WeakPolarHBondContact O-CG 3.32Å; E409-R413 PolarHBondContact O-N 3.44Å; E409-R413 VanDerWaalsContact O-N 3.09Å
410	L	52.3	Low	45.7	Very low	52 Å²	52	115.4 Å²	115.4	27%	0.272	55%	0.549	S	S	.	.	H	α-helix	trans	-64.3	-41.1	171.8	-167.5	74.2	0	0	0	111.7	E406 R408 Y414	E406-L410 VanDerWaalsContact O-CB 3.31Å; E406-L410 WeakPolarHBondContact O-CB 3.37Å; E406-L410 PolarHBondContact O-N 3.47Å; R408-L410 VanDerWaalsContact C-N 3.34Å; R408-L410 PolarHBondContact O-N 3.41Å; L410-Y414 WeakPolarHBondContact O-CB 3.43Å; L410-Y414 PolarHBondContact O-N 3.15Å
411	N	47.9	Very low	46.4	Very low	52 Å²	52	114.1 Å²	114.1	28%	0.278	55%	0.55	S	S	.	.	H	α-helix	trans	-69.2	-40.8	179.2	-160.4	32.3	0	0	0	112.1	L407 R408 Y414 Q415	L407-N411 WeakPolarHBondContact O-CB 3.3Å; L407-N411 PolarHBondContact O-N 3Å; R408-N411 PolarHBondContact O-N 3.49Å; N411-Y414 PolarHBondContact O-N 2.95Å; N411-Q415 WeakPolarHBondContact O-CG 3.48Å; N411-Q415 PolarHBondContact O-N 2.95Å
412	L	54.8	Low	47	Very low	97 Å²	97	109.5 Å²	109.5	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-59.6	-48.2	173.2	-101.4	78.1	0	0	0	111.6	R408 Y414 Q415 Q416	R408-L412 WeakPolarHBondContact O-CD1 3.42Å; R408-L412 PolarHBondContact O-N 2.76Å; L412-Y414 VanDerWaalsContact C-N 3.3Å; L412-Y414 PolarHBondContact O-N 3.12Å; L412-Q415 PolarHBondContact O-N 2.91Å; L412-Q416 WeakPolarHBondContact O-CG 3.49Å; L412-Q416 PolarHBondContact O-N 3.16Å
413	R	52.7	Low	47.4	Very low	162 Å²	162	111.7 Å²	111.7	61%	0.611	55%	0.545	S	S	*	.	H	α-helix	trans	-63	-37.1	178.2	-70.3	-179.7	-167.6	-153.4	5.4	111.9	E409 Q416 Q417	E409-R413 WeakPolarHBondContact O-CG 3.32Å; E409-R413 PolarHBondContact O-N 3.44Å; E409-R413 VanDerWaalsContact O-N 3.09Å; R413-Q416 PolarHBondContact O-N 3.36Å; R413-Q417 WeakPolarHBondContact O-CG 3.24Å; R413-Q417 PolarHBondContact O-N 2.93Å; R413-Q417 VanDerWaalsContact O-N 3.16Å
414	Y	48.3	Very low	47.3	Very low	52 Å²	52	109.1 Å²	109.1	20%	0.204	54%	0.543	C	S	.	.	H	α-helix	trans	-64.8	-42.8	174.9	-166.9	-83	0	0	0	111.6	L306 L410 N411 L412 Q417 Y418	L306-Y414 WeakPolarHBondContact O-CE2 3.06Å; L306-Y414 PolarHBondContact O-OH 3.16Å; L410-Y414 WeakPolarHBondContact O-CB 3.43Å; L410-Y414 PolarHBondContact O-N 3.15Å; N411-Y414 PolarHBondContact O-N 2.95Å; L412-Y414 VanDerWaalsContact C-N 3.3Å; L412-Y414 PolarHBondContact O-N 3.12Å; Y414-Q417 PolarHBondContact O-N 3.12Å; Y414-Y418 HydrophobicContact CD1-CD2 4.26Å; Y414-Y418 AromaticContact CE1-CD2 3.98Å; Y414-Y418 HydrophobicContact CE1-CD2 3.98Å; Y414-Y418 HydrophobicContact CE1-CE2 4.08Å; Y414-Y418 HydrophobicContact CE2-CE2 4.15Å; Y414-Y418 AromaticContact CZ-CE2 3.86Å; Y414-Y418 WeakPolarHBondContact O-CD2 3.39Å
415	Q	43.9	Very low	47.7	Very low	104 Å²	104	110.9 Å²	110.9	49%	0.486	55%	0.553	S	S	.	*	H	α-helix	trans	-60.6	-46.6	174.3	-72.1	172.2	-15.9	0	0	111.5	N411 L412 Q417 Y418 T419	N411-Q415 WeakPolarHBondContact O-CG 3.48Å; N411-Q415 PolarHBondContact O-N 2.95Å; L412-Q415 PolarHBondContact O-N 2.91Å; Q415-Q417 PolarHBondContact O-N 3.25Å; Q415-Y418 CarbonylContact O-C 3.45Å; Q415-Y418 PolarHBondContact O-N 3.15Å; Q415-T419 PolarHBondContact O-N 3.38Å; Q415-T419 PolarHBondContact O-OG1 3.02Å
416	Q	54.3	Low	47.9	Very low	135 Å²	135	107.2 Å²	107.2	63%	0.631	55%	0.548	S	S	*	.	H	α-helix	trans	-61	-24.7	178.3	-72	169.7	-24.5	0	0	114.2	L412 R413	L412-Q416 WeakPolarHBondContact O-CG 3.49Å; L412-Q416 PolarHBondContact O-N 3.16Å; R413-Q416 PolarHBondContact O-N 3.36Å
417	Q	41.7	Very low	47.8	Very low	144 Å²	144	108.3 Å²	108.3	67%	0.673	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-6.6	175.9	-71.4	-163.1	-79.2	0	0	114.5	R413 Y414 Q415	R413-Q417 WeakPolarHBondContact O-CG 3.24Å; R413-Q417 PolarHBondContact O-N 2.93Å; R413-Q417 VanDerWaalsContact O-N 3.16Å; Y414-Q417 PolarHBondContact O-N 3.12Å; Q415-Q417 PolarHBondContact O-N 3.25Å
418	Y	42.3	Very low	48	Very low	169 Å²	169	110.5 Å²	110.5	66%	0.663	57%	0.567	S	S	*	*	S	Bend	trans	-135.3	23.7	-177.3	-68	-84.1	0	0	0	112.9	Y414 Q415	Y414-Y418 HydrophobicContact CD1-CD2 4.26Å; Y414-Y418 AromaticContact CE1-CD2 3.98Å; Y414-Y418 HydrophobicContact CE1-CD2 3.98Å; Y414-Y418 HydrophobicContact CE1-CE2 4.08Å; Y414-Y418 HydrophobicContact CE2-CE2 4.15Å; Y414-Y418 AromaticContact CZ-CE2 3.86Å; Y414-Y418 WeakPolarHBondContact O-CD2 3.39Å; Q415-Y418 CarbonylContact O-C 3.45Å; Q415-Y418 PolarHBondContact O-N 3.15Å
419	T	39.3	Very low	47.5	Very low	117 Å²	117	108.4 Å²	108.4	72%	0.718	57%	0.572	S	S	*	*			trans	-138.3	36.5	172.8	66.9	0	0	0	0	112	Q415	Q415-T419 PolarHBondContact O-N 3.38Å; Q415-T419 PolarHBondContact O-OG1 3.02Å
420	G	37.9	Very low	46.8	Very low	143 Å²	143	111.5 Å²	111.5	100%	1.474	59%	0.593	S	S	*	*			trans	-126.3	0	168.1	0	0	0	0	0	108.5

Retrieved 420 of 420 residues in 601.3 ms (Link to these results)

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