A0A096NX42_PAPAN Loading...

Deoxynucleotidyltransferase terminal-interacting protein 1

Increases DNTT terminal deoxynucleotidyltransferase activity (in vitro). Also acts as a transcriptional regulator, binding to the consensus sequence 5'-GNTGCATG-3' following an AT-tract. Associates with RAB20 promoter and positively regulates its transcription. Binds DNA and nucleosomes; may recruit HDAC1 complexes to nucleosomes or naked DNA.

AlphaFold DB , UniProt , Accession A0A096NX42, Species PAPAN (Papio anubis, Olive baboon), Gene DNTTIP1, Length 329 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	38.3	Very low	37	Very low	247 Å²	247	138.7 Å²	138.7	100%	1.217	81%	0.808	S	S	*	*				0	132	0	-70.3	175.5	173.6	0	0	107
2	G	37	Very low	36.4	Very low	73 Å²	73	132.7 Å²	132.7	75%	0.753	80%	0.797	S	S	*	*			trans	70.6	122.5	-176.8	0	0	0	0	0	113.5
3	A	37.2	Very low	36.9	Very low	103 Å²	103	131.6 Å²	131.6	85%	0.851	80%	0.795	S	S	*	*			cis	60.3	133	26.1	0	0	0	0	0	112.5
4	T	40.3	Very low	36.3	Very low	133 Å²	133	131.3 Å²	131.3	82%	0.816	80%	0.802	S	S	*	*			cis	-135.5	166.2	15.9	49.6	0	0	0	0	109.2
5	G	34.6	Very low	35.8	Very low	62 Å²	62	127.2 Å²	127.2	64%	0.639	80%	0.797	S	S	*	*			cis	166.8	-174.3	13.3	0	0	0	0	0	108.6
6	D	35.8	Very low	35.6	Very low	146 Å²	146	125.5 Å²	125.5	78%	0.781	80%	0.798	S	S	*	*			cis	-159.9	164.5	-18	-78.2	-43.6	0	0	0	110.4
7	A	36.3	Very low	35.4	Very low	85 Å²	85	128.1 Å²	128.1	70%	0.702	80%	0.798	S	S	*	*			trans	6.8	151.4	145.3	0	0	0	0	0	121.8
8	E	33.1	Very low	35.2	Very low	175 Å²	175	133.9 Å²	133.9	82%	0.818	80%	0.803	S	S	*	*			cis	-156.6	145.4	-4	-102.4	168.5	74.8	0	0	106.2
9	Q	38.2	Very low	34.8	Very low	174 Å²	174	131.3 Å²	131.3	81%	0.813	81%	0.806	S	S	*	*				50.1	165.7	80.5	-93.9	-149.3	20.1	0	0	117
10	P	45.4	Very low	34.5	Very low	95 Å²	95	128 Å²	128	62%	0.617	80%	0.8	S	S	*	*			cis	-112.2	-160.5	-0.3	28.3	-5.1	0	0	0	111
11	R	30.7	Very low	34.3	Very low	233 Å²	233	130 Å²	130	88%	0.879	80%	0.804	S	S	*	*			cis	-148.9	167.1	16.1	-61.2	173.4	173.6	178.3	-1.9	111.5
12	G	30.6	Very low	34.1	Very low	66 Å²	66	125.2 Å²	125.2	68%	0.68	78%	0.778	S	S	*	*			trans	-95.6	-147.8	153.9	0	0	0	0	0	111.4
13	P	42.8	Very low	33.9	Very low	119 Å²	119	128.8 Å²	128.8	77%	0.773	78%	0.78	S	S	*	*			cis	-140	-177	9.9	43.9	-26.5	0	0	0	116
14	S	28.1	Very low	33.8	Very low	127 Å²	127	127.8 Å²	127.8	89%	0.888	78%	0.779	S	S	*	*			trans	57.4	155.2	153.2	-62.3	0	0	0	0	120.3
15	G	29	Very low	33.4	Very low	70 Å²	70	129.4 Å²	129.4	72%	0.722	78%	0.783	S	S	*	*			cis	162.8	134.7	-7.5	0	0	0	0	0	112.2
16	A	31.8	Very low	33.4	Very low	100 Å²	100	131 Å²	131	83%	0.826	79%	0.79	S	S	*	*			trans	52.1	146.6	153.4	0	0	0	0	0	124.2
17	E	32.8	Very low	33.1	Very low	170 Å²	170	127.3 Å²	127.3	79%	0.794	79%	0.787	S	S	*	*			trans	87.4	100.9	149.4	-54.8	-135.7	78	0	0	123.7
18	R	32.5	Very low	33.2	Very low	232 Å²	232	128.4 Å²	128.4	88%	0.875	80%	0.796	S	S	*	*				72.3	104.7	106.7	-152.5	179.5	-143	-95.2	2.7	122.2
19	G	27.8	Very low	33.3	Very low	85 Å²	85	124.2 Å²	124.2	88%	0.876	79%	0.791	S	S	*	*			trans	90	148.6	150.3	0	0	0	0	0	116.9
20	G	27.7	Very low	33.6	Very low	65 Å²	65	119.8 Å²	119.8	67%	0.67	79%	0.792	S	S	*	*			cis	169.6	153.4	-8	0	0	0	0	0	111.8
21	L	31.5	Very low	32.9	Very low	170 Å²	170	123 Å²	123	89%	0.89	80%	0.799	S	S	*	*			trans	64.4	143.6	176.6	-69.2	90.7	0	0	0	115.2
22	E	32.6	Very low	33.3	Very low	146 Å²	146	119.9 Å²	119.9	68%	0.682	80%	0.798	S	S	*	*			cis	-160.8	167.3	4.8	-109.5	-90.1	83.8	0	0	110.4
23	L	33.6	Very low	33.7	Very low	149 Å²	149	121.3 Å²	121.3	78%	0.78	79%	0.794	S	S	*	*			trans	60.7	96.6	153.5	-69.7	158.5	0	0	0	121.6
24	G	34.1	Very low	33.8	Very low	82 Å²	82	123.3 Å²	123.3	85%	0.845	80%	0.797	S	S	*	*				83.8	99.5	115.1	0	0	0	0	0	121
25	D	32	Very low	34.6	Very low	166 Å²	166	121.6 Å²	121.6	89%	0.888	78%	0.781	S	S	*	*				-157.1	142.1	113.5	-168.4	19.9	0	0	0	110.4	G27	D25-G27 PolarHBondContact O-N 3.21Å
26	A	35.1	Very low	35.5	Very low	95 Å²	95	123 Å²	123	79%	0.785	77%	0.773	S	S	*	*			trans	-99.2	89.4	-168.3	0	0	0	0	0	112.8
27	G	30	Very low	36.3	Very low	69 Å²	69	121.4 Å²	121.4	71%	0.711	75%	0.754	S	S	*	*			trans	58.4	63.5	143.5	0	0	0	0	0	117.9	D25 A29	D25-G27 PolarHBondContact O-N 3.21Å; G27-A29 PolarHBondContact O-N 3.29Å
28	A	38.3	Very low	37	Very low	108 Å²	108	120.5 Å²	120.5	89%	0.893	74%	0.743	S	S	*	*			trans	-75.1	51.5	160.3	0	0	0	0	0	112.2	G30	A28-G30 PolarHBondContact O-N 2.97Å
29	A	34.8	Very low	37.9	Very low	88 Å²	88	113.6 Å²	113.6	73%	0.727	72%	0.723	S	S	*	*			trans	-73.1	120.2	173.6	0	0	0	0	0	109.4	G27 Q31	G27-A29 PolarHBondContact O-N 3.29Å; A29-Q31 PolarHBondContact O-N 2.74Å
30	G	44.3	Very low	39.2	Very low	80 Å²	80	115.7 Å²	115.7	83%	0.825	71%	0.713	S	S	*	*			trans	-64.2	95.4	-174.7	0	0	0	0	0	113.2	A28 L32	A28-G30 PolarHBondContact O-N 2.97Å; G30-L32 PolarHBondContact O-N 2.81Å
31	Q	31.8	Very low	40.5	Very low	164 Å²	164	116 Å²	116	77%	0.766	70%	0.698	S	S	*	*			trans	-85	86.3	161.5	-151.5	81.7	72.6	0	0	108.2	A29 V33	A29-Q31 PolarHBondContact O-N 2.74Å; Q31-V33 HydrophobicContact CB-CG2 4.25Å; Q31-V33 HydrophobicContact CG-CG2 3.76Å; Q31-V33 PolarHBondContact O-N 2.93Å
32	L	38.7	Very low	41.5	Very low	166 Å²	166	115.2 Å²	115.2	87%	0.869	69%	0.693	S	S	*	*			trans	-62.9	85.8	153.9	-95.6	169.3	0	0	0	106.6	G30 L34	G30-L32 PolarHBondContact O-N 2.81Å; L32-L34 VanDerWaalsContact C-N 3.3Å; L32-L34 PolarHBondContact O-N 2.81Å
33	V	39.4	Very low	42.2	Very low	97 Å²	97	115.1 Å²	115.1	59%	0.588	69%	0.691	S	S	*	*			trans	-64.4	101.1	169.3	-177.5	0	0	0	0	105.2	Q31 T35	Q31-V33 HydrophobicContact CB-CG2 4.25Å; Q31-V33 HydrophobicContact CG-CG2 3.76Å; Q31-V33 PolarHBondContact O-N 2.93Å; V33-T35 HydrophobicContact CB-CG2 4.46Å; V33-T35 HydrophobicContact CG1-CG2 3.77Å; V33-T35 PolarHBondContact O-N 2.59Å
34	L	45.1	Very low	43.1	Very low	160 Å²	160	116.5 Å²	116.5	84%	0.838	69%	0.693	S	S	*	*			trans	-59.3	82.7	158.2	-85.3	160	0	0	0	106.6	L32 N36	L32-L34 VanDerWaalsContact C-N 3.3Å; L32-L34 PolarHBondContact O-N 2.81Å; L34-N36 PolarHBondContact O-N 2.94Å
35	T	44.7	Very low	43.6	Very low	91 Å²	91	123.1 Å²	123.1	56%	0.558	69%	0.692	S	S	*	*			trans	-65.9	94.6	168.5	45.2	0	0	0	0	105.5	V33 P37	V33-T35 HydrophobicContact CB-CG2 4.46Å; V33-T35 HydrophobicContact CG1-CG2 3.77Å; V33-T35 PolarHBondContact O-N 2.59Å; T35-P37 VanDerWaalsContact O-N 3.13Å
36	N	46.7	Very low	44	Very low	100 Å²	100	123.1 Å²	123.1	54%	0.535	69%	0.687	S	S	.	*			trans	-39.1	123.3	167.8	-79.5	-22.8	0	0	0	107.6	L34 W38 N39	L34-N36 PolarHBondContact O-N 2.94Å; N36-W38 PolarHBondContact O-N 3.21Å; N36-N39 VanDerWaalsContact O-CB 3.26Å; N36-N39 WeakPolarHBondContact O-CB 3.39Å; N36-N39 PolarHBondContact O-N 3.15Å
37	P	49.2	Very low	44.8	Very low	66 Å²	66	123.1 Å²	123.1	43%	0.429	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.7	-29.7	-172.4	19.3	-31.3	0	0	0	111.9	T35 N39 I40 V73	T35-P37 VanDerWaalsContact O-N 3.13Å; P37-N39 PolarHBondContact O-N 3.03Å; P37-I40 WeakPolarHBondContact O-CB 3.42Å; P37-I40 PolarHBondContact O-N 3.39Å; P37-I40 VanDerWaalsContact O-N 3.15Å; P37-V73 HydrophobicContact CB-CG1 4.28Å
38	W	46.9	Very low	45.3	Very low	152 Å²	152	127.8 Å²	127.8	58%	0.576	68%	0.68	S	S	*	*	H	α-helix	trans	-46.8	-35.2	166.7	-55.7	108.5	0	0	0	115.6	N36 I40 M41 L70 L74	N36-W38 PolarHBondContact O-N 3.21Å; W38-I40 VanDerWaalsContact C-N 3.26Å; W38-I40 PolarHBondContact O-N 2.87Å; W38-M41 PolarHBondContact O-N 3.11Å; W38-L70 HydrophobicContact CH2-CD1 4.44Å; W38-L70 HydrophobicContact CZ3-CD1 4.2Å; W38-L74 HydrophobicContact CH2-CD2 4.06Å; W38-L74 HydrophobicContact CZ2-CD2 4.17Å
39	N	51.2	Low	45.5	Very low	86 Å²	86	133.2 Å²	133.2	46%	0.46	68%	0.678	S	S	.	*	H	α-helix	trans	-78.1	-9	-174.9	-130.1	-25.2	0	0	0	113.2	N36 P37 K43	N36-N39 VanDerWaalsContact O-CB 3.26Å; N36-N39 WeakPolarHBondContact O-CB 3.39Å; N36-N39 PolarHBondContact O-N 3.15Å; P37-N39 PolarHBondContact O-N 3.03Å; N39-K43 WeakPolarHBondContact OD1-CE 3.48Å; N39-K43 PolarHBondContact OD1-NZ 2.83Å
40	I	54.9	Low	45.8	Very low	129 Å²	129	141.4 Å²	141.4	66%	0.662	69%	0.689	S	S	*	*	H	α-helix	trans	-86.5	-31	172.7	-57.7	175.5	0	0	0	110.5	P37 W38	P37-I40 WeakPolarHBondContact O-CB 3.42Å; P37-I40 PolarHBondContact O-N 3.39Å; P37-I40 VanDerWaalsContact O-N 3.15Å; W38-I40 VanDerWaalsContact C-N 3.26Å; W38-I40 PolarHBondContact O-N 2.87Å
41	M	55.1	Low	45.8	Very low	73 Å²	73	141 Å²	141	36%	0.36	69%	0.685	S	S	.	*	H	α-helix	trans	-77.1	-24.5	-167	-71.3	-179.5	70.1	0	0	115.2	W38 L70	W38-M41 PolarHBondContact O-N 3.11Å; M41-L70 HydrophobicContact CE-CB 4.01Å; M41-L70 HydrophobicContact CE-CD1 3.99Å; M41-L70 HydrophobicContact SD-CD1 4.49Å
42	I	54	Low	46.2	Very low	152 Å²	152	144.9 Å²	144.9	78%	0.779	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.2	64.5	-179.1	-42.1	-179.2	0	0	0	111.2
43	K	46.2	Very low	47.1	Very low	145 Å²	145	149 Å²	149	63%	0.63	70%	0.697	S	S	*	*			trans	-129.6	110.8	158.9	-69.9	-173.5	-177.5	170.8	0	109.6	N39 R45	N39-K43 WeakPolarHBondContact OD1-CE 3.48Å; N39-K43 PolarHBondContact OD1-NZ 2.83Å; K43-R45 PolarHBondContact O-N 2.79Å
44	H	53.1	Low	47.2	Very low	177 Å²	177	149.6 Å²	149.6	82%	0.819	71%	0.706	S	S	*	*			trans	-52.8	107.7	165.8	-75.3	-86.7	0	0	0	108.4	Q46	H44-Q46 VanDerWaalsContact C-N 3.29Å; H44-Q46 PolarHBondContact O-N 2.66Å
45	R	45.1	Very low	46.9	Very low	221 Å²	221	149.9 Å²	149.9	83%	0.834	70%	0.702	S	S	*	*			trans	-63.2	94.6	169.3	-175.9	-174.3	-177.2	-168.7	2.9	107.1	K43 V47	K43-R45 PolarHBondContact O-N 2.79Å; R45-V47 HydrophobicContact CG-CG2 4.08Å; R45-V47 PolarHBondContact O-N 2.97Å
46	Q	39.9	Very low	47	Very low	167 Å²	167	154.1 Å²	154.1	78%	0.78	72%	0.718	S	S	*	*			trans	-65.6	87.9	173.2	-88.3	-169.4	-13.1	0	0	109	H44 Q48	H44-Q46 VanDerWaalsContact C-N 3.29Å; H44-Q46 PolarHBondContact O-N 2.66Å; Q46-Q48 VanDerWaalsContact C-N 3.29Å; Q46-Q48 PolarHBondContact O-N 2.65Å
47	V	51.5	Low	46.6	Very low	94 Å²	94	154.6 Å²	154.6	57%	0.57	73%	0.725	S	S	*	*			trans	-72.5	91.8	164.9	178.2	0	0	0	0	106.8	R45 R49	R45-V47 HydrophobicContact CG-CG2 4.08Å; R45-V47 PolarHBondContact O-N 2.97Å; V47-R49 HydrophobicContact CG1-CG 4.08Å; V47-R49 PolarHBondContact O-N 2.75Å
48	Q	40.6	Very low	46.6	Very low	168 Å²	168	157 Å²	157	79%	0.785	74%	0.739	S	S	*	*			trans	-57.8	103.5	167.1	-83.8	-77.3	-15.8	0	0	109.2	Q46	Q46-Q48 VanDerWaalsContact C-N 3.29Å; Q46-Q48 PolarHBondContact O-N 2.65Å
49	R	42.5	Very low	46.8	Very low	222 Å²	222	154.2 Å²	154.2	84%	0.838	74%	0.742	S	S	*	*			trans	-134.3	128.7	163.1	-76.6	-168.5	177.9	-156.3	-0.8	110.4	V47	V47-R49 HydrophobicContact CG1-CG 4.08Å; V47-R49 PolarHBondContact O-N 2.75Å
50	R	42	Very low	46.9	Very low	259 Å²	259	159.6 Å²	159.6	98%	0.977	76%	0.762	S	S	*	*			trans	-53.2	139.3	169.6	-79.2	176	160.5	-168.4	-4.7	110.4
51	G	44.2	Very low	47.5	Very low	72 Å²	72	157.2 Å²	157.2	74%	0.742	75%	0.753	S	S	*	*			trans	123	113.5	145.1	0	0	0	0	0	116.7
52	R	40.2	Very low	48.9	Very low	246 Å²	246	158 Å²	158	93%	0.928	76%	0.759	S	S	*	*			trans	65.5	95.9	149.8	-145.1	167.3	-165.8	-96.5	2.7	117.6	S54	R52-S54 PolarHBondContact O-N 3.16Å
53	R	57.4	Low	50.5	Low	253 Å²	253	155.6 Å²	155.6	96%	0.955	75%	0.754	S	S	*	*			trans	-38.6	118.3	164	-173.1	-174.7	-165.3	-162.5	5.5	112.8
54	S	41.3	Very low	52.5	Low	109 Å²	109	151.2 Å²	151.2	76%	0.762	74%	0.744	S	S	*	*			trans	-136.2	158.2	150.7	-163.9	0	0	0	0	108.8	R52	R52-S54 PolarHBondContact O-N 3.16Å
55	Q	38.5	Very low	54.2	Low	165 Å²	165	147.8 Å²	147.8	77%	0.771	73%	0.731	S	S	*	*			trans	-24.6	139.2	-173.1	-65.6	-73.5	6.3	0	0	118.1	T57	Q55-T57 PolarHBondContact O-N 3.49Å
56	M	46	Very low	56.4	Low	180 Å²	180	139.6 Å²	139.6	89%	0.887	71%	0.708	S	S	*	*			trans	-52.7	112.5	167.7	-177.8	93.8	161.3	0	0	111.7
57	T	38.8	Very low	59	Low	111 Å²	111	137.6 Å²	137.6	68%	0.681	70%	0.7	S	S	*	*			trans	-135.1	141.1	160.7	49.5	0	0	0	0	111.3	Q55	Q55-T57 PolarHBondContact O-N 3.49Å
58	T	48.8	Very low	60.9	Low	117 Å²	117	136.7 Å²	136.7	72%	0.718	69%	0.692	S	S	*	*			trans	-76.3	168.3	-172.3	44	0	0	0	0	112.9	F60	T58-F60 PolarHBondContact O-N 3.14Å
59	S	51.3	Low	63.3	Low	93 Å²	93	133.7 Å²	133.7	65%	0.65	68%	0.68	S	S	*	*			trans	-43.3	126.4	-180	42.6	0	0	0	0	115.2	T61	S59-T61 PolarHBondContact O-N 2.89Å
60	F	53.2	Low	65.8	Low	198 Å²	198	125.2 Å²	125.2	87%	0.868	65%	0.652	S	S	*	*	S	Bend	trans	-77.2	54.9	174.5	-66.1	-85.6	0	0	0	113.2	T58	T58-F60 PolarHBondContact O-N 3.14Å
61	T	68.9	Low	68.4	Low	79 Å²	79	119 Å²	119	49%	0.485	63%	0.628	S	S	.	*	S	Bend	trans	-123.2	121.9	165.8	51.3	0	0	0	0	108.1	S59 S66	S59-T61 PolarHBondContact O-N 2.89Å; T61-S66 PolarHBondContact OG1-OG 3.36Å
62	D	83.6	Confident	70.8	Confident	89 Å²	89	118.1 Å²	118.1	48%	0.476	61%	0.613	S	S	.	*			trans	-51.8	126	170.6	169.8	10.1	0	0	0	109.3	A64 I65 S66	D62-A64 PolarHBondContact O-N 3.02Å; D62-A64 VanDerWaalsContact O-N 3.11Å; D62-A64 PolarHBondContact OD1-N 3.1Å; D62-I65 HydrophobicContact CB-CB 4.26Å; D62-I65 HydrophobicContact CB-CD1 3.84Å; D62-I65 HydrophobicContact CB-CG1 3.87Å; D62-I65 WeakPolarHBondContact O-CB 3.45Å; D62-I65 PolarHBondContact O-N 2.96Å; D62-S66 PolarHBondContact O-N 3.17Å; D62-S66 VanDerWaalsContact O-N 3.14Å
63	P	88.2	Confident	73.4	Confident	103 Å²	103	109.2 Å²	109.2	67%	0.669	59%	0.586	S	S	*	*	H	α-helix	trans	-50.5	-33.6	177.8	-29.5	36.2	0	0	0	113.9	S66 M67	P63-S66 PolarHBondContact O-N 3.41Å; P63-M67 WeakPolarHBondContact O-CG 3.23Å; P63-M67 PolarHBondContact O-N 2.61Å
64	A	87.6	Confident	75.2	Confident	53 Å²	53	100 Å²	100	44%	0.438	56%	0.556	S	S	.	*	H	α-helix	trans	-65.4	-45.3	176.1	0	0	0	0	0	111.8	D62 S66 M67 D68	D62-A64 PolarHBondContact O-N 3.02Å; D62-A64 VanDerWaalsContact O-N 3.11Å; D62-A64 PolarHBondContact OD1-N 3.1Å; A64-S66 VanDerWaalsContact C-N 3.3Å; A64-S66 PolarHBondContact O-N 3.34Å; A64-M67 PolarHBondContact O-N 3.24Å; A64-M67 VanDerWaalsContact O-N 3.09Å; A64-D68 PolarHBondContact O-N 2.94Å
65	I	89.3	Confident	77.8	Confident	104 Å²	104	98.2 Å²	98.2	53%	0.533	54%	0.535	S	S	.	.	H	α-helix	trans	-61.3	-39.3	177.5	-61.7	178.8	0	0	0	111.1	D62 M67 D68 L69	D62-I65 HydrophobicContact CB-CB 4.26Å; D62-I65 HydrophobicContact CB-CD1 3.84Å; D62-I65 HydrophobicContact CB-CG1 3.87Å; D62-I65 WeakPolarHBondContact O-CB 3.45Å; D62-I65 PolarHBondContact O-N 2.96Å; I65-M67 VanDerWaalsContact C-N 3.3Å; I65-M67 PolarHBondContact O-N 3.07Å; I65-D68 PolarHBondContact O-N 3.43Å; I65-L69 PolarHBondContact O-N 2.95Å; I65-L69 VanDerWaalsContact O-N 3.09Å
66	S	91.6	Very high	80.6	Confident	50 Å²	50	93.9 Å²	93.9	35%	0.35	52%	0.522	S	S	.	.	H	α-helix	trans	-61.9	-37.3	175.1	-63.2	0	0	0	0	112.5	T61 D62 P63 A64 L70	T61-S66 PolarHBondContact OG1-OG 3.36Å; D62-S66 PolarHBondContact O-N 3.17Å; D62-S66 VanDerWaalsContact O-N 3.14Å; P63-S66 PolarHBondContact O-N 3.41Å; A64-S66 VanDerWaalsContact C-N 3.3Å; A64-S66 PolarHBondContact O-N 3.34Å; S66-L70 PolarHBondContact O-N 2.98Å
67	M	93.6	Very high	83	Confident	124 Å²	124	88.6 Å²	88.6	61%	0.611	50%	0.502	S	S	*	.	H	α-helix	trans	-74.9	-38.8	176.3	-68.4	-58.2	-62.7	0	0	112.8	P63 A64 I65 L69 L70 R71	P63-M67 WeakPolarHBondContact O-CG 3.23Å; P63-M67 PolarHBondContact O-N 2.61Å; A64-M67 PolarHBondContact O-N 3.24Å; A64-M67 VanDerWaalsContact O-N 3.09Å; I65-M67 VanDerWaalsContact C-N 3.3Å; I65-M67 PolarHBondContact O-N 3.07Å; M67-L69 VanDerWaalsContact C-N 3.27Å; M67-L69 PolarHBondContact O-N 3.41Å; M67-L70 HydrophobicContact CE-CD2 4.27Å; M67-L70 PolarHBondContact O-N 3.14Å; M67-R71 PolarHBondContact O-N 2.87Å
68	D	91	Very high	85.8	Confident	76 Å²	76	86.9 Å²	86.9	41%	0.406	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-33.1	176.1	-98.9	-37.2	0	0	0	112.8	A64 I65 R71 A72	A64-D68 PolarHBondContact O-N 2.94Å; I65-D68 PolarHBondContact O-N 3.43Å; D68-R71 PolarHBondContact O-NH2 3.41Å; D68-R71 IonicContact OD1-CZ 2.69Å; D68-R71 IonicContact OD1-NE 3.4Å; D68-R71 IonicContact OD1-NH1 2.78Å; D68-R71 PolarHBondContact OD1-NH1 3.07Å; D68-R71 IonicContact OD1-NH2 2.67Å; D68-R71 PolarHBondContact OD1-NH2 3.08Å; D68-A72 WeakPolarHBondContact O-CB 3.01Å; D68-A72 PolarHBondContact O-N 3.43Å
69	L	92.4	Very high	88	Confident	104 Å²	104	85.2 Å²	85.2	55%	0.545	48%	0.475	S	S	.	.	H	α-helix	trans	-68.3	-45.3	172.8	-178	63	0	0	0	111.5	I65 M67 R71 A72 V73	I65-L69 PolarHBondContact O-N 2.95Å; I65-L69 VanDerWaalsContact O-N 3.09Å; M67-L69 VanDerWaalsContact C-N 3.27Å; M67-L69 PolarHBondContact O-N 3.41Å; L69-R71 VanDerWaalsContact C-N 3.35Å; L69-R71 PolarHBondContact O-N 3.04Å; L69-A72 PolarHBondContact O-N 3.03Å; L69-V73 WeakPolarHBondContact O-CG2 3.4Å; L69-V73 PolarHBondContact O-N 3.38Å
70	L	94	Very high	90.2	Very high	44 Å²	44	87.4 Å²	87.4	23%	0.23	48%	0.475	C	S	.	.	H	α-helix	trans	-59.3	-45.7	174.4	173.8	60.6	0	0	0	111.2	W38 M41 S66 M67 A72 V73 L74	W38-L70 HydrophobicContact CH2-CD1 4.44Å; W38-L70 HydrophobicContact CZ3-CD1 4.2Å; M41-L70 HydrophobicContact CE-CB 4.01Å; M41-L70 HydrophobicContact CE-CD1 3.99Å; M41-L70 HydrophobicContact SD-CD1 4.49Å; S66-L70 PolarHBondContact O-N 2.98Å; M67-L70 HydrophobicContact CE-CD2 4.27Å; M67-L70 PolarHBondContact O-N 3.14Å; L70-A72 VanDerWaalsContact C-N 3.34Å; L70-A72 PolarHBondContact O-N 2.97Å; L70-V73 PolarHBondContact O-N 3.46Å; L70-L74 HydrophobicContact CD1-CD1 3.79Å; L70-L74 HydrophobicContact CD1-CG 4.09Å; L70-L74 HydrophobicContact CG-CD1 4.12Å; L70-L74 WeakPolarHBondContact O-CG 3.46Å; L70-L74 PolarHBondContact O-N 2.83Å; L70-L74 VanDerWaalsContact O-N 3.08Å
71	R	96.1	Very high	92.3	Very high	130 Å²	130	84.4 Å²	84.4	49%	0.491	46%	0.464	S	S	.	.	H	α-helix	trans	-55.5	-48.2	173.2	176.9	-139	57.5	-153.8	-19.7	110.9	M67 D68 L69 V73 L74 Q75	M67-R71 PolarHBondContact O-N 2.87Å; D68-R71 PolarHBondContact O-NH2 3.41Å; D68-R71 IonicContact OD1-CZ 2.69Å; D68-R71 IonicContact OD1-NE 3.4Å; D68-R71 IonicContact OD1-NH1 2.78Å; D68-R71 PolarHBondContact OD1-NH1 3.07Å; D68-R71 IonicContact OD1-NH2 2.67Å; D68-R71 PolarHBondContact OD1-NH2 3.08Å; L69-R71 VanDerWaalsContact C-N 3.35Å; L69-R71 PolarHBondContact O-N 3.04Å; R71-V73 VanDerWaalsContact C-N 3.3Å; R71-V73 PolarHBondContact O-N 2.98Å; R71-L74 PolarHBondContact O-N 3.34Å; R71-Q75 WeakPolarHBondContact O-CB 3.34Å; R71-Q75 PolarHBondContact O-N 3.06Å
72	A	95	Very high	93.6	Very high	52 Å²	52	83.3 Å²	83.3	43%	0.43	45%	0.454	S	S	.	.	H	α-helix	trans	-60.8	-36.3	-179.7	0	0	0	0	0	113.3	D68 L69 L70	D68-A72 WeakPolarHBondContact O-CB 3.01Å; D68-A72 PolarHBondContact O-N 3.43Å; L69-A72 PolarHBondContact O-N 3.03Å; L70-A72 VanDerWaalsContact C-N 3.34Å; L70-A72 PolarHBondContact O-N 2.97Å
73	V	95.9	Very high	94.2	Very high	59 Å²	59	84 Å²	84	36%	0.358	46%	0.455	S	S	.	.	H	α-helix	trans	-69.7	-36.9	175.9	172.4	0	0	0	0	112.2	P37 L69 L70 R71 P76	P37-V73 HydrophobicContact CB-CG1 4.28Å; L69-V73 WeakPolarHBondContact O-CG2 3.4Å; L69-V73 PolarHBondContact O-N 3.38Å; L70-V73 PolarHBondContact O-N 3.46Å; R71-V73 VanDerWaalsContact C-N 3.3Å; R71-V73 PolarHBondContact O-N 2.98Å; V73-P76 WeakPolarHBondContact O-CD 3.13Å
74	L	94.8	Very high	94.7	Very high	61 Å²	61	82.7 Å²	82.7	32%	0.319	45%	0.445	S	S	.	.	H	α-helix	trans	-84.7	-21.7	-179	-64.3	177.4	0	0	0	113.9	W38 L70 R71 P76 S77 I78	W38-L74 HydrophobicContact CH2-CD2 4.06Å; W38-L74 HydrophobicContact CZ2-CD2 4.17Å; L70-L74 HydrophobicContact CD1-CD1 3.79Å; L70-L74 HydrophobicContact CD1-CG 4.09Å; L70-L74 HydrophobicContact CG-CD1 4.12Å; L70-L74 WeakPolarHBondContact O-CG 3.46Å; L70-L74 PolarHBondContact O-N 2.83Å; L70-L74 VanDerWaalsContact O-N 3.08Å; R71-L74 PolarHBondContact O-N 3.34Å; L74-P76 VanDerWaalsContact C-CD 3.42Å; L74-S77 PolarHBondContact O-N 3.33Å; L74-I78 HydrophobicContact CB-CD1 3.9Å; L74-I78 WeakPolarHBondContact O-CG1 3.29Å; L74-I78 PolarHBondContact O-N 3.36Å; L74-I78 VanDerWaalsContact O-N 3.13Å
75	Q	95.7	Very high	95.1	Very high	70 Å²	70	83.7 Å²	83.7	33%	0.327	45%	0.445	S	S	.	.	H	α-helix	trans	-51.8	-41.4	-175	-164.6	68.5	62.7	0	0	114.6	R71 I78 N79	R71-Q75 WeakPolarHBondContact O-CB 3.34Å; R71-Q75 PolarHBondContact O-N 3.06Å; Q75-I78 PolarHBondContact O-N 3.46Å; Q75-N79 PolarHBondContact NE2-OD1 2.98Å; Q75-N79 WeakPolarHBondContact O-CB 3.39Å; Q75-N79 PolarHBondContact O-N 3.1Å; Q75-N79 PolarHBondContact O-OD1 3.39Å
76	P	96.6	Very high	95.5	Very high	75 Å²	75	80.1 Å²	80.1	49%	0.487	43%	0.426	S	S	.	.	H	α-helix	trans	-62.7	-47.2	179.8	-22.9	35.1	0	0	0	112.9	V73 L74 I78 N79 E80	V73-P76 WeakPolarHBondContact O-CD 3.13Å; L74-P76 VanDerWaalsContact C-CD 3.42Å; P76-I78 VanDerWaalsContact C-N 3.34Å; P76-I78 PolarHBondContact O-N 2.94Å; P76-N79 WeakPolarHBondContact O-CB 3.41Å; P76-N79 PolarHBondContact O-N 3.35Å; P76-E80 PolarHBondContact O-N 3.11Å; P76-E80 VanDerWaalsContact O-N 3.14Å
77	S	96.9	Very high	95.7	Very high	68 Å²	68	82.2 Å²	82.2	48%	0.476	43%	0.433	S	S	.	.	H	α-helix	trans	-62.4	-42.5	178.4	-167.8	0	0	0	0	111.4	L74 N79 E80 E81	L74-S77 PolarHBondContact O-N 3.33Å; S77-N79 VanDerWaalsContact C-N 3.32Å; S77-N79 PolarHBondContact O-N 2.91Å; S77-E80 PolarHBondContact O-N 3.2Å; S77-E81 PolarHBondContact O-N 3.04Å
78	I	96.8	Very high	95.8	Very high	76 Å²	76	82.4 Å²	82.4	39%	0.39	43%	0.43	S	S	.	.	H	α-helix	trans	-64.7	-38.5	177.6	-66.9	169	0	0	0	110.7	L74 Q75 P76 E81 I82	L74-I78 HydrophobicContact CB-CD1 3.9Å; L74-I78 WeakPolarHBondContact O-CG1 3.29Å; L74-I78 PolarHBondContact O-N 3.36Å; L74-I78 VanDerWaalsContact O-N 3.13Å; Q75-I78 PolarHBondContact O-N 3.46Å; P76-I78 VanDerWaalsContact C-N 3.34Å; P76-I78 PolarHBondContact O-N 2.94Å; I78-E81 PolarHBondContact O-N 3.06Å; I78-I82 HydrophobicContact CG2-CD1 3.66Å; I78-I82 HydrophobicContact CG2-CG1 4.27Å; I78-I82 WeakPolarHBondContact O-CB 3.12Å; I78-I82 VanDerWaalsContact O-CG1 3.26Å; I78-I82 WeakPolarHBondContact O-CG1 3.36Å; I78-I82 PolarHBondContact O-N 3.41Å
79	N	96.5	Very high	96.1	Very high	82 Å²	82	85 Å²	85	44%	0.439	44%	0.436	S	S	.	.	H	α-helix	trans	-64.4	-39.6	177.9	-72.6	-5.1	0	0	0	112.4	Q75 P76 S77 I82 Q83	Q75-N79 PolarHBondContact NE2-OD1 2.98Å; Q75-N79 WeakPolarHBondContact O-CB 3.39Å; Q75-N79 PolarHBondContact O-N 3.1Å; Q75-N79 PolarHBondContact O-OD1 3.39Å; P76-N79 WeakPolarHBondContact O-CB 3.41Å; P76-N79 PolarHBondContact O-N 3.35Å; S77-N79 VanDerWaalsContact C-N 3.32Å; S77-N79 PolarHBondContact O-N 2.91Å; N79-I82 PolarHBondContact O-N 2.69Å; N79-Q83 WeakPolarHBondContact O-CB 3.29Å; N79-Q83 PolarHBondContact O-N 3.06Å
80	E	97.4	Very high	96.2	Very high	139 Å²	139	81.9 Å²	81.9	65%	0.65	42%	0.419	S	S	*	.	H	α-helix	trans	-63.6	-41.6	176.4	-70.7	179.9	-174.1	0	0	112.1	P76 S77 T84	P76-E80 PolarHBondContact O-N 3.11Å; P76-E80 VanDerWaalsContact O-N 3.14Å; S77-E80 PolarHBondContact O-N 3.2Å; E80-T84 WeakPolarHBondContact O-CB 3.48Å; E80-T84 PolarHBondContact O-N 3.2Å; E80-T84 PolarHBondContact O-OG1 2.89Å
81	E	97	Very high	96.2	Very high	135 Å²	135	86.1 Å²	86.1	63%	0.631	44%	0.435	S	S	*	.	H	α-helix	trans	-66.3	-44.7	174.7	-72	-169.8	-131.2	0	0	112	S77 I78 Q83 T84 V85	S77-E81 PolarHBondContact O-N 3.04Å; I78-E81 PolarHBondContact O-N 3.06Å; E81-Q83 PolarHBondContact O-N 3.5Å; E81-T84 WeakPolarHBondContact O-CB 3.36Å; E81-T84 PolarHBondContact O-N 3.17Å; E81-V85 WeakPolarHBondContact O-CG2 3.49Å; E81-V85 PolarHBondContact O-N 2.94Å
82	I	96.7	Very high	96.3	Very high	56 Å²	56	86.2 Å²	86.2	29%	0.287	44%	0.439	S	S	.	.	H	α-helix	trans	-58.5	-47.2	175.2	-72.9	171.8	0	0	0	110.7	I78 N79 T84 V85 F86 L122	I78-I82 HydrophobicContact CG2-CD1 3.66Å; I78-I82 HydrophobicContact CG2-CG1 4.27Å; I78-I82 WeakPolarHBondContact O-CB 3.12Å; I78-I82 VanDerWaalsContact O-CG1 3.26Å; I78-I82 WeakPolarHBondContact O-CG1 3.36Å; I78-I82 PolarHBondContact O-N 3.41Å; N79-I82 PolarHBondContact O-N 2.69Å; I82-T84 VanDerWaalsContact C-N 3.3Å; I82-T84 PolarHBondContact O-N 2.83Å; I82-V85 WeakPolarHBondContact O-CB 3.25Å; I82-V85 PolarHBondContact O-N 3.32Å; I82-V85 VanDerWaalsContact O-N 3.1Å; I82-F86 HydrophobicContact CG2-CD2 3.73Å; I82-F86 HydrophobicContact CG2-CE2 3.8Å; I82-F86 WeakPolarHBondContact O-CD2 3.24Å; I82-F86 PolarHBondContact O-N 2.69Å; I82-L122 HydrophobicContact CD1-CD2 4.4Å; I82-L122 HydrophobicContact CG2-CD2 4.14Å
83	Q	96.1	Very high	96.3	Very high	103 Å²	103	86.2 Å²	86.2	48%	0.481	43%	0.43	S	S	.	.	H	α-helix	trans	-60.1	-42.1	177	-172	63.9	52.5	0	0	111.2	N79 E81 V85 F86 N87	N79-Q83 WeakPolarHBondContact O-CB 3.29Å; N79-Q83 PolarHBondContact O-N 3.06Å; E81-Q83 PolarHBondContact O-N 3.5Å; Q83-V85 VanDerWaalsContact C-N 3.29Å; Q83-V85 PolarHBondContact O-N 2.96Å; Q83-F86 PolarHBondContact O-N 2.87Å; Q83-N87 PolarHBondContact NE2-OD1 2.8Å; Q83-N87 WeakPolarHBondContact O-CB 3.33Å; Q83-N87 PolarHBondContact O-N 3.01Å; Q83-N87 PolarHBondContact O-ND2 2.8Å; Q83-N87 PolarHBondContact O-OD1 2.8Å
84	T	97.1	Very high	96.3	Very high	76 Å²	76	88 Å²	88	47%	0.466	43%	0.434	S	S	.	.	H	α-helix	trans	-63.1	-33.3	176	-61.2	0	0	0	0	112.5	E80 E81 I82 K88	E80-T84 WeakPolarHBondContact O-CB 3.48Å; E80-T84 PolarHBondContact O-N 3.2Å; E80-T84 PolarHBondContact O-OG1 2.89Å; E81-T84 WeakPolarHBondContact O-CB 3.36Å; E81-T84 PolarHBondContact O-N 3.17Å; I82-T84 VanDerWaalsContact C-N 3.3Å; I82-T84 PolarHBondContact O-N 2.83Å; T84-K88 WeakPolarHBondContact O-CE 3.45Å; T84-K88 WeakPolarHBondContact O-CG 3.5Å
85	V	97.3	Very high	96.3	Very high	73 Å²	73	90.4 Å²	90.4	44%	0.442	44%	0.442	S	S	.	.	H	α-helix	trans	-69.4	-51.2	171.9	172.9	0	0	0	0	110.9	E81 I82 Q83 N87 K88 Y89	E81-V85 WeakPolarHBondContact O-CG2 3.49Å; E81-V85 PolarHBondContact O-N 2.94Å; I82-V85 WeakPolarHBondContact O-CB 3.25Å; I82-V85 PolarHBondContact O-N 3.32Å; I82-V85 VanDerWaalsContact O-N 3.1Å; Q83-V85 VanDerWaalsContact C-N 3.29Å; Q83-V85 PolarHBondContact O-N 2.96Å; V85-N87 VanDerWaalsContact C-N 3.33Å; V85-N87 PolarHBondContact O-N 3.36Å; V85-K88 WeakPolarHBondContact O-CB 3.08Å; V85-K88 PolarHBondContact O-N 2.88Å; V85-K88 VanDerWaalsContact O-N 3.17Å; V85-Y89 HydrophobicContact CG1-CE2 4.23Å; V85-Y89 VanDerWaalsContact O-CD2 3.3Å; V85-Y89 WeakPolarHBondContact O-CD2 3.32Å
86	F	96.5	Very high	96.3	Very high	29 Å²	29	89.7 Å²	89.7	13%	0.127	45%	0.448	C	S	.	.	H	α-helix	trans	-60.7	-39.7	-179.7	-86.4	-76.3	0	0	0	112.9	I82 Q83 K88 Y89 M90 C118 C121 L122	I82-F86 HydrophobicContact CG2-CD2 3.73Å; I82-F86 HydrophobicContact CG2-CE2 3.8Å; I82-F86 WeakPolarHBondContact O-CD2 3.24Å; I82-F86 PolarHBondContact O-N 2.69Å; Q83-F86 PolarHBondContact O-N 2.87Å; F86-K88 PolarHBondContact O-N 3.05Å; F86-K88 VanDerWaalsContact O-N 3.12Å; F86-Y89 CarbonylContact O-C 3.52Å; F86-Y89 PolarHBondContact O-N 2.75Å; F86-M90 HydrophobicContact CB-CE 4.44Å; F86-M90 PolarHBondContact O-N 3.36Å; F86-C118 HydrophobicContact CD1-CB 4.21Å; F86-C118 VanDerWaalsContact CD1-SG 3.56Å; F86-C118 HydrophobicContact CE1-CB 3.79Å; F86-C118 HydrophobicContact CZ-CB 4.2Å; F86-C121 HydrophobicContact CE1-CB 4.12Å; F86-C121 HydrophobicContact CZ-CB 3.93Å; F86-L122 HydrophobicContact CE2-CD1 4.34Å; F86-L122 HydrophobicContact CE2-CD2 3.96Å; F86-L122 HydrophobicContact CE2-CG 3.99Å; F86-L122 HydrophobicContact CZ-CD2 4.41Å; F86-L122 HydrophobicContact CZ-CG 4.11Å
87	N	95.9	Very high	96.3	Very high	94 Å²	94	86.4 Å²	86.4	50%	0.503	43%	0.427	S	S	.	.	H	α-helix	trans	-56	-31.1	177.6	-73.2	-8.8	0	0	0	113.1	Q83 V85 Y89	Q83-N87 PolarHBondContact NE2-OD1 2.8Å; Q83-N87 WeakPolarHBondContact O-CB 3.33Å; Q83-N87 PolarHBondContact O-N 3.01Å; Q83-N87 PolarHBondContact O-ND2 2.8Å; Q83-N87 PolarHBondContact O-OD1 2.8Å; V85-N87 VanDerWaalsContact C-N 3.33Å; V85-N87 PolarHBondContact O-N 3.36Å; N87-Y89 VanDerWaalsContact C-N 3.29Å; N87-Y89 PolarHBondContact O-N 3.42Å
88	K	96.8	Very high	96.1	Very high	128 Å²	128	86 Å²	86	56%	0.557	42%	0.419	S	S	*	.	H	α-helix	trans	-67.6	-28.9	176.9	-64.6	164.9	-172.8	171.4	0	112.8	T84 V85 F86	T84-K88 WeakPolarHBondContact O-CE 3.45Å; T84-K88 WeakPolarHBondContact O-CG 3.5Å; V85-K88 WeakPolarHBondContact O-CB 3.08Å; V85-K88 PolarHBondContact O-N 2.88Å; V85-K88 VanDerWaalsContact O-N 3.17Å; F86-K88 PolarHBondContact O-N 3.05Å; F86-K88 VanDerWaalsContact O-N 3.12Å
89	Y	96.1	Very high	96.1	Very high	131 Å²	131	85.6 Å²	85.6	51%	0.514	42%	0.418	S	S	.	.	H	α-helix	trans	-106.5	-13.6	-176.8	-58.6	-75.8	0	0	0	113.7	V85 F86 N87 K91 F92	V85-Y89 HydrophobicContact CG1-CE2 4.23Å; V85-Y89 VanDerWaalsContact O-CD2 3.3Å; V85-Y89 WeakPolarHBondContact O-CD2 3.32Å; F86-Y89 CarbonylContact O-C 3.52Å; F86-Y89 PolarHBondContact O-N 2.75Å; N87-Y89 VanDerWaalsContact C-N 3.29Å; N87-Y89 PolarHBondContact O-N 3.42Å; Y89-K91 VanDerWaalsContact C-N 3.26Å; Y89-K91 PolarHBondContact O-N 3.49Å; Y89-K91 VanDerWaalsContact O-N 3.09Å; Y89-F92 HydrophobicContact CD1-CD2 4.33Å; Y89-F92 HydrophobicContact CD1-CE2 4.35Å; Y89-F92 WeakPolarHBondContact O-CB 3.46Å; Y89-F92 WeakPolarHBondContact O-CD2 3.37Å; Y89-F92 PolarHBondContact O-N 3Å
90	M	95.9	Very high	96	Very high	38 Å²	38	84.8 Å²	84.8	19%	0.187	42%	0.416	C	S	.	.	H	α-helix	trans	-50.3	-40.7	-172.9	-169	56.6	70.6	0	0	114.1	F86 F92 F93 Q94 I114	F86-M90 HydrophobicContact CB-CE 4.44Å; F86-M90 PolarHBondContact O-N 3.36Å; M90-F92 PolarHBondContact O-N 2.85Å; M90-F92 VanDerWaalsContact O-N 3.12Å; M90-F93 PolarHBondContact O-N 3.2Å; M90-F93 VanDerWaalsContact O-N 3.08Å; M90-Q94 HydrophobicContact CG-CG 4.25Å; M90-Q94 WeakPolarHBondContact O-CG 3.24Å; M90-Q94 PolarHBondContact O-N 3.19Å; M90-I114 HydrophobicContact CE-CG2 4.42Å; M90-I114 HydrophobicContact SD-CG2 3.58Å; M90-I114 VanDerWaalsContact SD-CG2 3.58Å
91	K	94.1	Very high	95.9	Very high	134 Å²	134	81.8 Å²	81.8	58%	0.583	40%	0.399	S	S	*	.	H	α-helix	trans	-54.5	-30	175.8	64.4	-174.6	177.1	-175.8	0	114.5	Y89 K95	Y89-K91 VanDerWaalsContact C-N 3.26Å; Y89-K91 PolarHBondContact O-N 3.49Å; Y89-K91 VanDerWaalsContact O-N 3.09Å; K91-K95 WeakPolarHBondContact O-CB 3.28Å; K91-K95 PolarHBondContact O-N 3.05Å; K91-K95 VanDerWaalsContact O-N 3.16Å
92	F	96.3	Very high	95.7	Very high	131 Å²	131	80.4 Å²	80.4	58%	0.575	40%	0.396	S	S	*	.	H	α-helix	trans	-77.7	-42.2	177.5	-58.9	-65.1	0	0	0	111.3	Y89 M90 K95 A96	Y89-F92 HydrophobicContact CD1-CD2 4.33Å; Y89-F92 HydrophobicContact CD1-CE2 4.35Å; Y89-F92 WeakPolarHBondContact O-CB 3.46Å; Y89-F92 WeakPolarHBondContact O-CD2 3.37Å; Y89-F92 PolarHBondContact O-N 3Å; M90-F92 PolarHBondContact O-N 2.85Å; M90-F92 VanDerWaalsContact O-N 3.12Å; F92-K95 PolarHBondContact O-N 3.35Å; F92-A96 WeakPolarHBondContact O-CB 3.49Å; F92-A96 PolarHBondContact O-N 2.95Å
93	F	95.9	Very high	95.6	Very high	53 Å²	53	84.6 Å²	84.6	23%	0.232	42%	0.419	C	S	.	.	H	α-helix	trans	-63.2	-46.3	174.5	-65.5	-75.6	0	0	0	111.3	M90 K95 A96 A97 I114 A117	M90-F93 PolarHBondContact O-N 3.2Å; M90-F93 VanDerWaalsContact O-N 3.08Å; F93-K95 PolarHBondContact O-N 3.24Å; F93-A96 PolarHBondContact O-N 2.86Å; F93-A97 WeakPolarHBondContact O-CB 3.36Å; F93-A97 PolarHBondContact O-N 3.46Å; F93-I114 HydrophobicContact CB-CG1 4.19Å; F93-I114 HydrophobicContact CB-CG2 4.14Å; F93-A117 HydrophobicContact CD1-CB 3.89Å; F93-A117 HydrophobicContact CE1-CB 3.91Å
94	Q	95.4	Very high	95.4	Very high	95 Å²	95	84 Å²	84	44%	0.444	42%	0.422	S	S	.	.	H	α-helix	trans	-56.3	-48.3	174.2	-73.1	173.5	-21.7	0	0	112	M90 A96 A97 L98 I114	M90-Q94 HydrophobicContact CG-CG 4.25Å; M90-Q94 WeakPolarHBondContact O-CG 3.24Å; M90-Q94 PolarHBondContact O-N 3.19Å; Q94-A96 VanDerWaalsContact C-N 3.34Å; Q94-A96 PolarHBondContact O-N 3.04Å; Q94-A97 PolarHBondContact O-N 2.96Å; Q94-L98 WeakPolarHBondContact O-CB 3.34Å; Q94-L98 VanDerWaalsContact O-CG 3.28Å; Q94-L98 WeakPolarHBondContact O-CG 3.23Å; Q94-L98 PolarHBondContact O-N 3.3Å; Q94-I114 HydrophobicContact CB-CD1 4.42Å; Q94-I114 HydrophobicContact CG-CD1 3.86Å
95	K	95.3	Very high	94.9	Very high	113 Å²	113	81.4 Å²	81.4	49%	0.491	41%	0.41	S	S	.	.	H	α-helix	trans	-68.3	-33.7	179.6	-170.8	50.8	177.5	147.6	0	112.6	K91 F92 F93 N99	K91-K95 WeakPolarHBondContact O-CB 3.28Å; K91-K95 PolarHBondContact O-N 3.05Å; K91-K95 VanDerWaalsContact O-N 3.16Å; F92-K95 PolarHBondContact O-N 3.35Å; F93-K95 PolarHBondContact O-N 3.24Å; K95-N99 VanDerWaalsContact CE-OD1 3.25Å; K95-N99 WeakPolarHBondContact CE-OD1 3.29Å; K95-N99 PolarHBondContact NZ-OD1 3.26Å; K95-N99 WeakPolarHBondContact O-CB 3.47Å; K95-N99 PolarHBondContact O-N 2.94Å; K95-N99 VanDerWaalsContact O-N 3.1Å; K95-N99 PolarHBondContact O-ND2 2.84Å; K95-N99 PolarHBondContact O-OD1 3.31Å
96	A	96.3	Very high	94.4	Very high	54 Å²	54	86.2 Å²	86.2	45%	0.446	43%	0.428	S	S	.	.	H	α-helix	trans	-66.4	-48	174.1	0	0	0	0	0	111.9	F92 F93 Q94 N99 V100	F92-A96 WeakPolarHBondContact O-CB 3.49Å; F92-A96 PolarHBondContact O-N 2.95Å; F93-A96 PolarHBondContact O-N 2.86Å; Q94-A96 VanDerWaalsContact C-N 3.34Å; Q94-A96 PolarHBondContact O-N 3.04Å; A96-N99 WeakPolarHBondContact O-CB 3.49Å; A96-N99 PolarHBondContact O-N 2.99Å; A96-V100 WeakPolarHBondContact O-CG2 3.18Å; A96-V100 PolarHBondContact O-N 3.22Å
97	A	95	Very high	94.1	Very high	6 Å²	6	91.9 Å²	91.9	5%	0.05	46%	0.455	C	S	.	.	H	α-helix	trans	-63	-44	179.7	0	0	0	0	0	112.1	F93 Q94 N99 V100 R101 T110 L113 I114	F93-A97 WeakPolarHBondContact O-CB 3.36Å; F93-A97 PolarHBondContact O-N 3.46Å; Q94-A97 PolarHBondContact O-N 2.96Å; A97-N99 PolarHBondContact O-N 2.77Å; A97-V100 PolarHBondContact O-N 3.3Å; A97-V100 VanDerWaalsContact O-N 3.12Å; A97-R101 PolarHBondContact O-N 2.75Å; A97-T110 HydrophobicContact CB-CG2 4.14Å; A97-L113 HydrophobicContact CB-CB 4.46Å; A97-I114 HydrophobicContact CB-CD1 4.05Å; A97-I114 HydrophobicContact CB-CG1 3.81Å
98	L	93.9	Very high	93.9	Very high	60 Å²	60	88.7 Å²	88.7	31%	0.314	44%	0.439	S	S	.	.	H	α-helix	trans	-57.3	-47.6	172.5	-71.6	170.4	0	0	0	111.3	Q94 V100 R101 D102 T110	Q94-L98 WeakPolarHBondContact O-CB 3.34Å; Q94-L98 VanDerWaalsContact O-CG 3.28Å; Q94-L98 WeakPolarHBondContact O-CG 3.23Å; Q94-L98 PolarHBondContact O-N 3.3Å; L98-V100 VanDerWaalsContact C-N 3.25Å; L98-V100 PolarHBondContact O-N 3.08Å; L98-R101 PolarHBondContact O-N 2.81Å; L98-D102 WeakPolarHBondContact O-CB 3.17Å; L98-D102 PolarHBondContact O-N 3.39Å; L98-T110 HydrophobicContact CD2-CG2 4.43Å
99	N	95.8	Very high	93.8	Very high	67 Å²	67	86.6 Å²	86.6	36%	0.358	43%	0.434	S	S	.	.	H	α-helix	trans	-61	-32.6	177	-66.8	-8.7	0	0	0	112.6	K95 A96 A97 N103	K95-N99 VanDerWaalsContact CE-OD1 3.25Å; K95-N99 WeakPolarHBondContact CE-OD1 3.29Å; K95-N99 PolarHBondContact NZ-OD1 3.26Å; K95-N99 WeakPolarHBondContact O-CB 3.47Å; K95-N99 PolarHBondContact O-N 2.94Å; K95-N99 VanDerWaalsContact O-N 3.1Å; K95-N99 PolarHBondContact O-ND2 2.84Å; K95-N99 PolarHBondContact O-OD1 3.31Å; A96-N99 WeakPolarHBondContact O-CB 3.49Å; A96-N99 PolarHBondContact O-N 2.99Å; A97-N99 PolarHBondContact O-N 2.77Å; N99-N103 PolarHBondContact O-N 2.74Å; N99-N103 PolarHBondContact O-ND2 3.42Å
100	V	94.9	Very high	93.6	Very high	66 Å²	66	81.8 Å²	81.8	40%	0.4	42%	0.418	S	S	.	.	H	α-helix	trans	-67.5	-49.6	174.6	172.8	0	0	0	0	110.1	A96 A97 L98 D102 N103 V104 V108 L113	A96-V100 WeakPolarHBondContact O-CG2 3.18Å; A96-V100 PolarHBondContact O-N 3.22Å; A97-V100 PolarHBondContact O-N 3.3Å; A97-V100 VanDerWaalsContact O-N 3.12Å; L98-V100 VanDerWaalsContact C-N 3.25Å; L98-V100 PolarHBondContact O-N 3.08Å; V100-D102 VanDerWaalsContact C-N 3.32Å; V100-D102 PolarHBondContact O-N 3.12Å; V100-N103 PolarHBondContact O-N 2.78Å; V100-N103 VanDerWaalsContact O-N 3.09Å; V100-V104 HydrophobicContact CG1-CG2 4.11Å; V100-V104 WeakPolarHBondContact O-CG2 3.26Å; V100-V104 PolarHBondContact O-N 3.37Å; V100-V108 HydrophobicContact CG1-CG1 4.29Å; V100-L113 HydrophobicContact CB-CD1 4.43Å; V100-L113 HydrophobicContact CG1-CD1 4.11Å
101	R	95	Very high	93.5	Very high	76 Å²	76	84.5 Å²	84.5	29%	0.287	43%	0.43	S	S	.	.	H	α-helix	trans	-56.8	-44.7	176	-170.2	-174.4	65.6	-166.8	7.6	111.8	A97 L98 N103 V104 G105 V108 T110	A97-R101 PolarHBondContact O-N 2.75Å; L98-R101 PolarHBondContact O-N 2.81Å; R101-N103 PolarHBondContact O-N 3.28Å; R101-N103 VanDerWaalsContact O-N 3.14Å; R101-V104 PolarHBondContact O-N 3.27Å; R101-G105 WeakPolarHBondContact CG-O 3.43Å; R101-G105 CarbonylContact O-C 3.19Å; R101-G105 PolarHBondContact O-N 3.36Å; R101-V108 HydrophobicContact CB-CB 4.18Å; R101-V108 HydrophobicContact CB-CG1 4.48Å; R101-V108 HydrophobicContact CG-CB 4.17Å; R101-T110 HydrophobicContact CB-CG2 3.81Å; R101-T110 HydrophobicContact CG-CG2 4.4Å
102	D	93.9	Very high	93.6	Very high	106 Å²	106	83.5 Å²	83.5	57%	0.567	43%	0.427	S	S	*	.	H	α-helix	trans	-61.6	-21.6	178.8	-62.2	-15.7	0	0	0	113.6	L98 V100	L98-D102 WeakPolarHBondContact O-CB 3.17Å; L98-D102 PolarHBondContact O-N 3.39Å; V100-D102 VanDerWaalsContact C-N 3.32Å; V100-D102 PolarHBondContact O-N 3.12Å
103	N	93.7	Very high	93.5	Very high	143 Å²	143	80.4 Å²	80.4	77%	0.765	42%	0.416	S	S	*	.	H	α-helix	trans	-102.3	-25.1	179.1	-78.6	-87.2	0	0	0	114.2	N99 V100 R101	N99-N103 PolarHBondContact O-N 2.74Å; N99-N103 PolarHBondContact O-ND2 3.42Å; V100-N103 PolarHBondContact O-N 2.78Å; V100-N103 VanDerWaalsContact O-N 3.09Å; R101-N103 PolarHBondContact O-N 3.28Å; R101-N103 VanDerWaalsContact O-N 3.14Å
104	V	92.8	Very high	93.5	Very high	91 Å²	91	78.3 Å²	78.3	55%	0.552	41%	0.408	S	S	*	.	H	α-helix	trans	-97.2	-51.2	-176.7	177.6	0	0	0	0	110.6	V100 R101 V108	V100-V104 HydrophobicContact CG1-CG2 4.11Å; V100-V104 WeakPolarHBondContact O-CG2 3.26Å; V100-V104 PolarHBondContact O-N 3.37Å; R101-V104 PolarHBondContact O-N 3.27Å; V104-V108 HydrophobicContact CB-CG2 3.79Å; V104-V108 HydrophobicContact CG1-CG2 3.62Å
105	G	86.3	Confident	93.5	Very high	22 Å²	22	77.9 Å²	77.9	23%	0.227	41%	0.406	C	S	.	.			trans	145.7	167.8	-174.4	0	0	0	0	0	111.9	R101 E107 V108	R101-G105 WeakPolarHBondContact CG-O 3.43Å; R101-G105 CarbonylContact O-C 3.19Å; R101-G105 PolarHBondContact O-N 3.36Å; G105-E107 WeakPolarHBondContact CA-OE2 3.33Å; G105-E107 PolarHBondContact O-N 2.89Å; G105-V108 PolarHBondContact O-N 2.84Å
106	E	87.4	Confident	93.6	Very high	174 Å²	174	77.8 Å²	77.8	81%	0.813	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-6.6	-178.1	-65.2	-152.9	145.4	0	0	114.2	V108	E106-V108 PolarHBondContact O-N 3.45Å
107	E	89.3	Confident	93.6	Very high	147 Å²	147	76.8 Å²	76.8	69%	0.687	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-12.5	171.2	70.8	-82.3	-169.8	0	0	113.9	G105 D109	G105-E107 WeakPolarHBondContact CA-OE2 3.33Å; G105-E107 PolarHBondContact O-N 2.89Å; E107-D109 PolarHBondContact O-N 3.21Å
108	V	90.6	Very high	93.6	Very high	27 Å²	27	77.4 Å²	77.4	16%	0.164	40%	0.403	C	S	.	.	S	Bend	trans	-82	110.5	179.6	-179.8	0	0	0	0	111.3	V100 R101 V104 G105 E106 T110 L113	V100-V108 HydrophobicContact CG1-CG1 4.29Å; R101-V108 HydrophobicContact CB-CB 4.18Å; R101-V108 HydrophobicContact CB-CG1 4.48Å; R101-V108 HydrophobicContact CG-CB 4.17Å; V104-V108 HydrophobicContact CB-CG2 3.79Å; V104-V108 HydrophobicContact CG1-CG2 3.62Å; G105-V108 PolarHBondContact O-N 2.84Å; E106-V108 PolarHBondContact O-N 3.45Å; V108-T110 PolarHBondContact O-N 3.17Å; V108-T110 VanDerWaalsContact O-N 3.11Å; V108-L113 HydrophobicContact CG1-CD1 3.42Å; V108-L113 VanDerWaalsContact CG1-CD1 3.42Å; V108-L113 HydrophobicContact CG1-CG 4.33Å
109	D	94.7	Very high	93.7	Very high	85 Å²	85	81.2 Å²	81.2	46%	0.455	41%	0.413	S	S	.	.			trans	-68.1	105.5	167.5	-175	-12.4	0	0	0	110.6	E107 E111 Q112 L113	E107-D109 PolarHBondContact O-N 3.21Å; D109-E111 VanDerWaalsContact C-N 3.33Å; D109-E111 PolarHBondContact O-N 2.86Å; D109-E111 WeakPolarHBondContact OD1-CA 3.38Å; D109-E111 WeakPolarHBondContact OD1-CB 3.21Å; D109-E111 PolarHBondContact OD1-N 3.08Å; D109-Q112 HydrophobicContact CB-CB 3.89Å; D109-Q112 PolarHBondContact OD1-N 2.93Å; D109-Q112 VanDerWaalsContact OD1-N 3.09Å; D109-L113 PolarHBondContact O-N 3.27Å
110	T	93.1	Very high	93.8	Very high	29 Å²	29	81.2 Å²	81.2	18%	0.178	42%	0.418	C	S	.	.	H	α-helix	trans	-68.1	-30.4	178.7	51	0	0	0	0	113.3	A97 L98 R101 V108 I114	A97-T110 HydrophobicContact CB-CG2 4.14Å; L98-T110 HydrophobicContact CD2-CG2 4.43Å; R101-T110 HydrophobicContact CB-CG2 3.81Å; R101-T110 HydrophobicContact CG-CG2 4.4Å; V108-T110 PolarHBondContact O-N 3.17Å; V108-T110 VanDerWaalsContact O-N 3.11Å; T110-I114 VanDerWaalsContact O-CD1 3.25Å; T110-I114 WeakPolarHBondContact O-CD1 3.22Å; T110-I114 WeakPolarHBondContact O-CG1 3.43Å; T110-I114 PolarHBondContact O-N 3.4Å
111	E	93.9	Very high	93.8	Very high	95 Å²	95	80.7 Å²	80.7	44%	0.444	42%	0.417	S	S	.	.	H	α-helix	trans	-75.1	-41.9	-179.2	-178.8	55.8	-148	0	0	110.2	D109 L113 I114 Q115	D109-E111 VanDerWaalsContact C-N 3.33Å; D109-E111 PolarHBondContact O-N 2.86Å; D109-E111 WeakPolarHBondContact OD1-CA 3.38Å; D109-E111 WeakPolarHBondContact OD1-CB 3.21Å; D109-E111 PolarHBondContact OD1-N 3.08Å; E111-L113 VanDerWaalsContact C-N 3.33Å; E111-L113 PolarHBondContact O-N 2.96Å; E111-I114 PolarHBondContact O-N 3.07Å; E111-Q115 WeakPolarHBondContact O-CG 3.48Å; E111-Q115 PolarHBondContact O-N 3.05Å; E111-Q115 WeakPolarHBondContact OE1-CG 3.44Å; E111-Q115 PolarHBondContact OE1-NE2 3.09Å
112	Q	95.7	Very high	93.9	Very high	113 Å²	113	80.8 Å²	80.8	53%	0.528	42%	0.422	S	S	.	.	H	α-helix	trans	-56.4	-45.8	173	-173.5	177.6	9.2	0	0	112	D109 I114 Q115 E116	D109-Q112 HydrophobicContact CB-CB 3.89Å; D109-Q112 PolarHBondContact OD1-N 2.93Å; D109-Q112 VanDerWaalsContact OD1-N 3.09Å; Q112-I114 PolarHBondContact O-N 3.23Å; Q112-Q115 PolarHBondContact O-N 3.2Å; Q112-E116 WeakPolarHBondContact O-CB 3.32Å; Q112-E116 PolarHBondContact O-N 3.06Å
113	L	95.2	Very high	93.9	Very high	66 Å²	66	80.6 Å²	80.6	35%	0.346	42%	0.418	S	S	.	.	H	α-helix	trans	-61.4	-41.7	176.8	-73.8	178.6	0	0	0	112.8	A97 V100 V108 D109 E111 E116 A117	A97-L113 HydrophobicContact CB-CB 4.46Å; V100-L113 HydrophobicContact CB-CD1 4.43Å; V100-L113 HydrophobicContact CG1-CD1 4.11Å; V108-L113 HydrophobicContact CG1-CD1 3.42Å; V108-L113 VanDerWaalsContact CG1-CD1 3.42Å; V108-L113 HydrophobicContact CG1-CG 4.33Å; D109-L113 PolarHBondContact O-N 3.27Å; E111-L113 VanDerWaalsContact C-N 3.33Å; E111-L113 PolarHBondContact O-N 2.96Å; L113-E116 PolarHBondContact O-N 2.95Å; L113-A117 WeakPolarHBondContact O-CB 3.29Å; L113-A117 PolarHBondContact O-N 2.93Å
114	I	96.1	Very high	93.9	Very high	9 Å²	9	79.1 Å²	79.1	5%	0.046	41%	0.407	C	S	.	.	H	α-helix	trans	-64.7	-45.4	177.7	-68.1	161.2	0	0	0	110.2	M90 F93 Q94 A97 T110 E111 Q112 E116 A117 C118	M90-I114 HydrophobicContact CE-CG2 4.42Å; M90-I114 HydrophobicContact SD-CG2 3.58Å; M90-I114 VanDerWaalsContact SD-CG2 3.58Å; F93-I114 HydrophobicContact CB-CG1 4.19Å; F93-I114 HydrophobicContact CB-CG2 4.14Å; Q94-I114 HydrophobicContact CB-CD1 4.42Å; Q94-I114 HydrophobicContact CG-CD1 3.86Å; A97-I114 HydrophobicContact CB-CD1 4.05Å; A97-I114 HydrophobicContact CB-CG1 3.81Å; T110-I114 VanDerWaalsContact O-CD1 3.25Å; T110-I114 WeakPolarHBondContact O-CD1 3.22Å; T110-I114 WeakPolarHBondContact O-CG1 3.43Å; T110-I114 PolarHBondContact O-N 3.4Å; E111-I114 PolarHBondContact O-N 3.07Å; Q112-I114 PolarHBondContact O-N 3.23Å; I114-E116 PolarHBondContact O-N 2.85Å; I114-A117 PolarHBondContact O-N 3.47Å; I114-C118 WeakPolarHBondContact O-CB 3.49Å; I114-C118 PolarHBondContact O-N 3.32Å; I114-C118 PolarHBondContact O-SG 2.99Å
115	Q	95.7	Very high	93.9	Very high	86 Å²	86	76.5 Å²	76.5	40%	0.402	40%	0.395	S	S	.	.	H	α-helix	trans	-64.4	-39.3	178.7	-69.3	179.4	17.1	0	0	112.5	E111 Q112 C118 R119	E111-Q115 WeakPolarHBondContact O-CG 3.48Å; E111-Q115 PolarHBondContact O-N 3.05Å; E111-Q115 WeakPolarHBondContact OE1-CG 3.44Å; E111-Q115 PolarHBondContact OE1-NE2 3.09Å; Q112-Q115 PolarHBondContact O-N 3.2Å; Q115-C118 PolarHBondContact O-N 3.16Å; Q115-R119 WeakPolarHBondContact O-CG 3.4Å; Q115-R119 PolarHBondContact O-N 3.34Å
116	E	96.3	Very high	94.3	Very high	112 Å²	112	80.9 Å²	80.9	52%	0.523	41%	0.407	S	S	.	.	H	α-helix	trans	-65.5	-43.4	175.4	-173.1	169.4	-169.4	0	0	112.1	Q112 L113 I114 C118 R119 S120	Q112-E116 WeakPolarHBondContact O-CB 3.32Å; Q112-E116 PolarHBondContact O-N 3.06Å; L113-E116 PolarHBondContact O-N 2.95Å; I114-E116 PolarHBondContact O-N 2.85Å; E116-C118 VanDerWaalsContact C-N 3.35Å; E116-C118 PolarHBondContact O-N 3.47Å; E116-R119 PolarHBondContact O-N 3.19Å; E116-S120 WeakPolarHBondContact O-CB 3.45Å; E116-S120 PolarHBondContact O-N 3.18Å
117	A	95.9	Very high	94.5	Very high	32 Å²	32	76.9 Å²	76.9	26%	0.264	39%	0.391	S	S	.	.	H	α-helix	trans	-60	-43.6	173.4	0	0	0	0	0	112	F93 L113 I114 S120 C121	F93-A117 HydrophobicContact CD1-CB 3.89Å; F93-A117 HydrophobicContact CE1-CB 3.91Å; L113-A117 WeakPolarHBondContact O-CB 3.29Å; L113-A117 PolarHBondContact O-N 2.93Å; I114-A117 PolarHBondContact O-N 3.47Å; A117-S120 PolarHBondContact O-N 3.38Å; A117-C121 PolarHBondContact O-N 2.92Å; A117-C121 PolarHBondContact O-SG 2.95Å
118	C	95.2	Very high	94.5	Very high	20 Å²	20	75.5 Å²	75.5	14%	0.135	39%	0.388	C	S	.	.	H	α-helix	trans	-63	-43.6	176.4	-70.5	0	0	0	0	112.6	F86 I114 Q115 E116 C121 L122	F86-C118 HydrophobicContact CD1-CB 4.21Å; F86-C118 VanDerWaalsContact CD1-SG 3.56Å; F86-C118 HydrophobicContact CE1-CB 3.79Å; F86-C118 HydrophobicContact CZ-CB 4.2Å; I114-C118 WeakPolarHBondContact O-CB 3.49Å; I114-C118 PolarHBondContact O-N 3.32Å; I114-C118 PolarHBondContact O-SG 2.99Å; Q115-C118 PolarHBondContact O-N 3.16Å; E116-C118 VanDerWaalsContact C-N 3.35Å; E116-C118 PolarHBondContact O-N 3.47Å; C118-C121 PolarHBondContact O-N 2.93Å; C118-L122 PolarHBondContact O-N 3.37Å
119	R	96.6	Very high	94.4	Very high	139 Å²	139	82.9 Å²	82.9	53%	0.525	42%	0.418	S	S	.	.	H	α-helix	trans	-60.8	-44.5	173.6	-74.5	-174.2	-68	-105.6	0.1	111.5	Q115 E116 C121 L122 E123	Q115-R119 WeakPolarHBondContact O-CG 3.4Å; Q115-R119 PolarHBondContact O-N 3.34Å; E116-R119 PolarHBondContact O-N 3.19Å; R119-C121 VanDerWaalsContact C-N 3.35Å; R119-C121 PolarHBondContact O-N 2.97Å; R119-L122 PolarHBondContact O-N 3Å; R119-E123 PolarHBondContact O-N 3.22Å
120	S	96.6	Very high	94.2	Very high	67 Å²	67	82.2 Å²	82.2	47%	0.469	42%	0.42	S	S	.	.	H	α-helix	trans	-60.3	-41.2	177.1	-175.1	0	0	0	0	112.4	E116 A117 L122 E123 Q124	E116-S120 WeakPolarHBondContact O-CB 3.45Å; E116-S120 PolarHBondContact O-N 3.18Å; A117-S120 PolarHBondContact O-N 3.38Å; S120-L122 VanDerWaalsContact C-N 3.35Å; S120-L122 PolarHBondContact O-N 3.18Å; S120-E123 PolarHBondContact O-N 2.69Å; S120-Q124 WeakPolarHBondContact O-CG 3.39Å; S120-Q124 PolarHBondContact O-N 3.3Å
121	C	96.3	Very high	92.7	Very high	56 Å²	56	89.2 Å²	89.2	38%	0.378	46%	0.457	S	S	.	.	H	α-helix	trans	-60.4	-40.3	174.1	-69.3	0	0	0	0	113.2	F86 A117 C118 R119 A125	F86-C121 HydrophobicContact CE1-CB 4.12Å; F86-C121 HydrophobicContact CZ-CB 3.93Å; A117-C121 PolarHBondContact O-N 2.92Å; A117-C121 PolarHBondContact O-SG 2.95Å; C118-C121 PolarHBondContact O-N 2.93Å; R119-C121 VanDerWaalsContact C-N 3.35Å; R119-C121 PolarHBondContact O-N 2.97Å; C121-A125 PolarHBondContact O-N 2.69Å; C121-A125 VanDerWaalsContact O-N 3.1Å
122	L	96.3	Very high	91.1	Very high	77 Å²	77	88.4 Å²	88.4	40%	0.403	47%	0.474	S	S	.	.	H	α-helix	trans	-68.7	-36	176	-71.1	173.2	0	0	0	112.2	I82 F86 C118 R119 S120 A125 K126	I82-L122 HydrophobicContact CD1-CD2 4.4Å; I82-L122 HydrophobicContact CG2-CD2 4.14Å; F86-L122 HydrophobicContact CE2-CD1 4.34Å; F86-L122 HydrophobicContact CE2-CD2 3.96Å; F86-L122 HydrophobicContact CE2-CG 3.99Å; F86-L122 HydrophobicContact CZ-CD2 4.41Å; F86-L122 HydrophobicContact CZ-CG 4.11Å; C118-L122 PolarHBondContact O-N 3.37Å; R119-L122 PolarHBondContact O-N 3Å; S120-L122 VanDerWaalsContact C-N 3.35Å; S120-L122 PolarHBondContact O-N 3.18Å; L122-A125 WeakPolarHBondContact O-CB 3.47Å; L122-A125 PolarHBondContact O-N 2.67Å; L122-K126 PolarHBondContact O-N 3.4Å
123	E	94.6	Very high	88.6	Confident	103 Å²	103	89.6 Å²	89.6	48%	0.481	48%	0.479	S	S	.	.	H	α-helix	trans	-63.1	-45.5	175	-160.7	61.8	-144.2	0	0	111.4	R119 S120 A125 K126	R119-E123 PolarHBondContact O-N 3.22Å; S120-E123 PolarHBondContact O-N 2.69Å; E123-A125 VanDerWaalsContact C-N 3.26Å; E123-A125 PolarHBondContact O-N 3.27Å; E123-K126 WeakPolarHBondContact O-CB 3.31Å; E123-K126 PolarHBondContact O-N 3.4Å; E123-K126 WeakPolarHBondContact OE1-CD 3.41Å; E123-K126 WeakPolarHBondContact OE1-CE 3.5Å; E123-K126 IonicContact OE1-NZ 3.82Å; E123-K126 PolarHBondContact OE1-NZ 2.96Å; E123-K126 VanDerWaalsContact OE2-CE 3.22Å; E123-K126 WeakPolarHBondContact OE2-CE 3.34Å; E123-K126 IonicContact OE2-NZ 3.55Å; E123-K126 PolarHBondContact OE2-NZ 3.21Å
124	Q	92.7	Very high	86.1	Confident	112 Å²	112	95.5 Å²	95.5	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-63.2	-31.1	174.7	-65.6	-59.8	-59.8	0	0	112.6	S120 K126 L127	S120-Q124 WeakPolarHBondContact O-CG 3.39Å; S120-Q124 PolarHBondContact O-N 3.3Å; Q124-K126 VanDerWaalsContact C-N 3.27Å; Q124-K126 PolarHBondContact O-N 3.3Å; Q124-L127 WeakPolarHBondContact O-CB 3.32Å; Q124-L127 PolarHBondContact O-N 2.86Å
125	A	94.4	Very high	83.6	Confident	36 Å²	36	101.8 Å²	101.8	30%	0.298	54%	0.54	S	S	.	.	H	α-helix	trans	-67.9	-22.9	177.3	0	0	0	0	0	113.4	C121 L122 E123 L127 L128	C121-A125 PolarHBondContact O-N 2.69Å; C121-A125 VanDerWaalsContact O-N 3.1Å; L122-A125 WeakPolarHBondContact O-CB 3.47Å; L122-A125 PolarHBondContact O-N 2.67Å; E123-A125 VanDerWaalsContact C-N 3.26Å; E123-A125 PolarHBondContact O-N 3.27Å; A125-L127 PolarHBondContact O-N 3.4Å; A125-L128 VanDerWaalsContact O-CB 3.3Å; A125-L128 WeakPolarHBondContact O-CB 3.43Å; A125-L128 WeakPolarHBondContact O-CG 3.49Å; A125-L128 PolarHBondContact O-N 2.85Å
126	K	94	Very high	81.1	Confident	114 Å²	114	101.3 Å²	101.3	50%	0.496	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-60.4	-27.5	175	-62.5	-179.7	-174.8	170.8	0	113	L122 E123 Q124 L128 F129 S130	L122-K126 PolarHBondContact O-N 3.4Å; E123-K126 WeakPolarHBondContact O-CB 3.31Å; E123-K126 PolarHBondContact O-N 3.4Å; E123-K126 WeakPolarHBondContact OE1-CD 3.41Å; E123-K126 WeakPolarHBondContact OE1-CE 3.5Å; E123-K126 IonicContact OE1-NZ 3.82Å; E123-K126 PolarHBondContact OE1-NZ 2.96Å; E123-K126 VanDerWaalsContact OE2-CE 3.22Å; E123-K126 WeakPolarHBondContact OE2-CE 3.34Å; E123-K126 IonicContact OE2-NZ 3.55Å; E123-K126 PolarHBondContact OE2-NZ 3.21Å; Q124-K126 VanDerWaalsContact C-N 3.27Å; Q124-K126 PolarHBondContact O-N 3.3Å; K126-L128 PolarHBondContact O-N 3.43Å; K126-L128 VanDerWaalsContact O-N 3.16Å; K126-F129 PolarHBondContact O-N 2.83Å; K126-S130 PolarHBondContact O-N 3.04Å; K126-S130 PolarHBondContact O-OG 2.85Å
127	L	90.9	Very high	78.5	Confident	90 Å²	90	101.4 Å²	101.4	47%	0.471	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-63.1	-17.1	176.3	-59.8	176.8	0	0	0	113.2	Q124 A125 F129 I136	Q124-L127 WeakPolarHBondContact O-CB 3.32Å; Q124-L127 PolarHBondContact O-N 2.86Å; A125-L127 PolarHBondContact O-N 3.4Å; L127-F129 PolarHBondContact O-N 3.39Å; L127-I136 HydrophobicContact CB-CD1 4.28Å; L127-I136 HydrophobicContact CB-CG1 4.37Å
128	L	89.4	Confident	75.5	Confident	118 Å²	118	110.8 Å²	110.8	62%	0.618	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-74	-15.8	172.9	-61.6	168.4	0	0	0	113	A125 K126 I136	A125-L128 VanDerWaalsContact O-CB 3.3Å; A125-L128 WeakPolarHBondContact O-CB 3.43Å; A125-L128 WeakPolarHBondContact O-CG 3.49Å; A125-L128 PolarHBondContact O-N 2.85Å; K126-L128 PolarHBondContact O-N 3.43Å; K126-L128 VanDerWaalsContact O-N 3.16Å; L128-I136 HydrophobicContact CD2-CD1 3.54Å; L128-I136 HydrophobicContact CG-CD1 4.24Å
129	F	88.4	Confident	72.6	Confident	181 Å²	181	117 Å²	117	79%	0.794	61%	0.61	S	S	*	*	S	Bend	trans	-122.7	7.2	-174.4	-54.4	-76.8	0	0	0	113.1	K126 L127	K126-F129 PolarHBondContact O-N 2.83Å; L127-F129 PolarHBondContact O-N 3.39Å
130	S	90	Very high	69.4	Low	72 Å²	72	115.1 Å²	115.1	50%	0.503	61%	0.614	S	S	.	*	S	Bend	trans	-88.8	140	171.4	-57.5	0	0	0	0	109.5	K126 G132	K126-S130 PolarHBondContact O-N 3.04Å; K126-S130 PolarHBondContact O-OG 2.85Å; S130-G132 PolarHBondContact O-N 3.3Å
131	D	63.5	Low	66.6	Low	176 Å²	176	119.2 Å²	119.2	94%	0.941	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-57.4	135.5	177.2	-91.2	-41.9	0	0	0	111.4	E133	D131-E133 PolarHBondContact O-N 3.05Å
132	G	58.4	Low	63.3	Low	78 Å²	78	124.4 Å²	124.4	80%	0.804	64%	0.644	S	S	*	*	S	Bend	trans	-86.1	117.4	-155	0	0	0	0	0	114.9	S130	S130-G132 PolarHBondContact O-N 3.3Å
133	E	43.5	Very low	60.3	Low	138 Å²	138	127.1 Å²	127.1	65%	0.645	66%	0.658	S	S	*	*	S	Bend	trans	-136.2	2.8	152.1	-142.6	-147.3	146.8	0	0	114.6	D131 R321	D131-E133 PolarHBondContact O-N 3.05Å; E133-R321 IonicContact OE1-CZ 3.73Å; E133-R321 IonicContact OE1-NE 3.66Å; E133-R321 IonicContact OE1-NH2 2.69Å; E133-R321 PolarHBondContact OE1-NH2 2.78Å
134	K	44	Very low	57.2	Low	189 Å²	189	128 Å²	128	82%	0.822	67%	0.673	S	S	*	*	S	Bend	trans	-130.2	92.8	177.3	-67.2	-177.3	-176.1	170.9	0	111	I136	K134-I136 PolarHBondContact O-N 2.95Å
135	V	43.6	Very low	54.2	Low	141 Å²	141	126 Å²	126	86%	0.855	68%	0.683	S	S	*	*			trans	-44	112.4	162.8	174.1	0	0	0	0	108.3	P137	V135-P137 WeakPolarHBondContact O-CD 3.5Å
136	I	43.3	Very low	51.5	Low	77 Å²	77	132 Å²	132	40%	0.395	71%	0.708	S	S	.	*			trans	-52.4	112.9	-176.8	-63.2	168.4	0	0	0	108.9	L127 L128 K134 R138	L127-I136 HydrophobicContact CB-CD1 4.28Å; L127-I136 HydrophobicContact CB-CG1 4.37Å; L128-I136 HydrophobicContact CD2-CD1 3.54Å; L128-I136 HydrophobicContact CG-CD1 4.24Å; K134-I136 PolarHBondContact O-N 2.95Å; I136-R138 PolarHBondContact O-N 2.89Å
137	P	41	Very low	48.6	Very low	113 Å²	113	136.3 Å²	136.3	73%	0.734	73%	0.727	S	S	*	*			trans	-64.1	113.4	166.2	-15.1	30.9	0	0	0	106	V135 L139	V135-P137 WeakPolarHBondContact O-CD 3.5Å; P137-L139 PolarHBondContact O-N 3.29Å
138	R	33.3	Very low	45.7	Very low	229 Å²	229	143.7 Å²	143.7	86%	0.864	75%	0.748	S	S	*	*			trans	-52.4	109.2	167.7	-77.4	-86.1	-177.9	141.7	-3.5	106.6	I136 T140	I136-R138 PolarHBondContact O-N 2.89Å; R138-T140 PolarHBondContact O-N 3.26Å; R138-T140 PolarHBondContact O-OG1 3.36Å
139	L	34.3	Very low	42.8	Very low	152 Å²	152	141.9 Å²	141.9	80%	0.796	76%	0.758	S	S	*	*			trans	-70	88.6	-179.8	-159.3	162.7	0	0	0	107.5	P137 H141	P137-L139 PolarHBondContact O-N 3.29Å; L139-H141 PolarHBondContact O-N 3.13Å; L139-H141 VanDerWaalsContact O-N 3.15Å
140	T	28.9	Very low	40	Very low	99 Å²	99	145.1 Å²	145.1	61%	0.607	77%	0.765	S	S	*	*			trans	-64.9	112.2	175.8	-48.6	0	0	0	0	106.6	R138 E142	R138-T140 PolarHBondContact O-N 3.26Å; R138-T140 PolarHBondContact O-OG1 3.36Å; T140-E142 HydrophobicContact CG2-CG 4.3Å; T140-E142 PolarHBondContact O-N 2.99Å
141	H	36.7	Very low	37.2	Very low	153 Å²	153	151 Å²	151	71%	0.708	79%	0.785	S	S	*	*			trans	-72.4	75.3	-178.7	-177.2	-70.9	0	0	0	110.2	L139 L143	L139-H141 PolarHBondContact O-N 3.13Å; L139-H141 VanDerWaalsContact O-N 3.15Å; H141-L143 VanDerWaalsContact C-N 3.34Å; H141-L143 PolarHBondContact O-N 3.26Å
142	E	28.6	Very low	35.6	Very low	165 Å²	165	146.8 Å²	146.8	77%	0.771	77%	0.774	S	S	*	*			trans	-73.2	84.6	174.6	-71.6	-76.4	110	0	0	109.6	T140	T140-E142 HydrophobicContact CG2-CG 4.3Å; T140-E142 PolarHBondContact O-N 2.99Å
143	L	32.7	Very low	34.3	Very low	134 Å²	134	151.7 Å²	151.7	70%	0.702	78%	0.776	S	S	*	*			trans	-69.6	129.4	162.1	-112.5	172.8	0	0	0	108.3	H141 G145	H141-L143 VanDerWaalsContact C-N 3.34Å; H141-L143 PolarHBondContact O-N 3.26Å; L143-G145 PolarHBondContact O-N 3.2Å
144	P	29	Very low	33.9	Very low	120 Å²	120	154.9 Å²	154.9	78%	0.779	79%	0.791	S	S	*	*			trans	-63.8	89.2	-179.9	-25.8	36.6	0	0	0	113.4	I146	P144-I146 PolarHBondContact O-N 3.42Å; P144-I146 VanDerWaalsContact O-N 3.13Å
145	G	29.3	Very low	33.4	Very low	71 Å²	71	154.7 Å²	154.7	73%	0.732	79%	0.793	S	S	*	*			trans	-66.7	107	176.5	0	0	0	0	0	111.9	L143 K147	L143-G145 PolarHBondContact O-N 3.2Å; G145-K147 PolarHBondContact O-N 3.44Å
146	I	39	Very low	32.6	Very low	162 Å²	162	153.5 Å²	153.5	83%	0.831	79%	0.79	S	S	*	*			trans	-54.6	125.9	176.5	-64.6	164.6	0	0	0	110.3	P144 R148	P144-I146 PolarHBondContact O-N 3.42Å; P144-I146 VanDerWaalsContact O-N 3.13Å; I146-R148 PolarHBondContact O-N 3.36Å
147	K	33.3	Very low	32	Very low	204 Å²	204	153.2 Å²	153.2	89%	0.887	80%	0.799	S	S	*	*			trans	-57.5	108.5	179.9	-64.8	177.3	179.8	177.3	0	111.2	G145	G145-K147 PolarHBondContact O-N 3.44Å
148	R	30	Very low	31.7	Very low	246 Å²	246	156.4 Å²	156.4	93%	0.928	80%	0.804	S	S	*	*			trans	-97.4	94.4	155.6	-94.8	-171.1	-87.8	-172	-6.9	109.1	I146 R150	I146-R148 PolarHBondContact O-N 3.36Å; R148-R150 PolarHBondContact O-N 2.91Å
149	G	28.4	Very low	31.7	Very low	80 Å²	80	157.6 Å²	157.6	83%	0.825	81%	0.808	S	S	*	*			trans	-67.6	124.7	166.3	0	0	0	0	0	109.6
150	R	29.8	Very low	31.4	Very low	248 Å²	248	154.2 Å²	154.2	94%	0.936	81%	0.81	S	S	*	*			trans	-106.7	100.8	169.5	-178.4	-172.3	-91	-114	5.3	106.8	R148	R148-R150 PolarHBondContact O-N 2.91Å
151	Q	30.2	Very low	31.5	Very low	196 Å²	196	155.2 Å²	155.2	92%	0.916	82%	0.821	S	S	*	*			trans	-88.8	139.7	163.6	-82.1	179.7	-42.7	0	0	109.1
152	A	29.4	Very low	31.8	Very low	87 Å²	87	153.3 Å²	153.3	72%	0.719	82%	0.822	S	S	*	*			trans	-125.9	152.3	160.5	0	0	0	0	0	104.1
153	E	32.3	Very low	32.1	Very low	182 Å²	182	153.5 Å²	153.5	85%	0.85	83%	0.828	S	S	*	*			cis	-162	135.4	1.1	-156.6	167.8	168.4	0	0	105.6
154	E	35.6	Very low	32.7	Very low	205 Å²	205	152.4 Å²	152.4	96%	0.958	83%	0.828	S	S	*	*			trans	-155.7	138.8	158.1	-128.4	175.6	143.2	0	0	110.3
155	E	32.8	Very low	33.1	Very low	185 Å²	185	157 Å²	157	86%	0.864	84%	0.836	S	S	*	*			trans	-104.4	134.3	-162.5	-179	-175.4	118.2	0	0	111.4
156	C	27	Very low	33.3	Very low	115 Å²	115	162.9 Å²	162.9	78%	0.777	84%	0.841	S	S	*	*				157.4	159.5	125.1	-165.6	0	0	0	0	112.6
157	A	30.6	Very low	33.2	Very low	71 Å²	71	166.6 Å²	166.6	59%	0.587	85%	0.845	S	S	*	*			trans	80.7	91.7	155.6	0	0	0	0	0	121.1
158	H	33.9	Very low	33.1	Very low	181 Å²	181	167.5 Å²	167.5	84%	0.838	85%	0.849	S	S	*	*			trans	84.9	113.6	132.8	-57.1	110.1	0	0	0	123.1
159	R	33.1	Very low	33.1	Very low	253 Å²	253	159.4 Å²	159.4	96%	0.955	84%	0.842	S	S	*	*			trans	23.5	129.4	147.9	-73.6	-168.1	-179.8	-91.6	4.7	120.9
160	G	27.8	Very low	33.5	Very low	81 Å²	81	166.1 Å²	166.1	84%	0.835	84%	0.842	S	S	*	*			trans	144.8	124.9	142.2	0	0	0	0	0	114.5
161	S	32.7	Very low	34.1	Very low	120 Å²	120	159.9 Å²	159.9	84%	0.839	83%	0.834	S	S	*	*			trans	-108.7	-179.7	179.1	71.9	0	0	0	0	111.2
162	P	42.7	Very low	34.6	Very low	113 Å²	113	155.8 Å²	155.8	73%	0.734	83%	0.825	S	S	*	*				-107.7	175.9	-115.7	37.9	-23.6	0	0	0	114.6
163	L	34	Very low	34.5	Very low	170 Å²	170	155.1 Å²	155.1	89%	0.89	83%	0.826	S	S	*	*			trans	175.6	155.8	140.5	-94.3	167.9	0	0	0	111.8
164	P	45.8	Very low	34.5	Very low	110 Å²	110	155.1 Å²	155.1	71%	0.714	83%	0.826	S	S	*	*			trans	-106.1	160.7	-173.6	39.5	-33.8	0	0	0	115
165	K	37.4	Very low	34.3	Very low	217 Å²	217	152.1 Å²	152.1	94%	0.943	82%	0.815	S	S	*	*			trans	-159	163.2	160.1	-112.8	155.9	-172.6	175.1	0	114.5
166	K	33.7	Very low	34.5	Very low	194 Å²	194	151.5 Å²	151.5	84%	0.843	82%	0.817	S	S	*	*			trans	-101.5	157.3	-159.5	-67.8	-176.8	176.4	178.9	0	115.3
167	R	37.3	Very low	34.6	Very low	240 Å²	240	151.1 Å²	151.1	91%	0.906	82%	0.815	S	S	*	*			trans	30.4	127.4	144.7	-60.5	171.3	87.2	-179.8	9.2	118.7
168	K	31.4	Very low	34.5	Very low	223 Å²	223	153.6 Å²	153.6	97%	0.97	83%	0.828	S	S	*	*				179.1	149	110.1	-163.5	156.4	-177.4	177.1	0	111.4
169	G	29.4	Very low	34.2	Very low	76 Å²	76	151.9 Å²	151.9	78%	0.784	83%	0.825	S	S	*	*			trans	133.5	106	160.9	0	0	0	0	0	116.5
170	R	37.2	Very low	34.2	Very low	221 Å²	221	151.1 Å²	151.1	83%	0.834	82%	0.822	S	S	*	*			trans	-120.5	139.1	158.2	179.2	-173	-164.1	-153.2	9.8	106.9
171	P	41	Very low	34.3	Very low	118 Å²	118	151.3 Å²	151.3	77%	0.766	82%	0.816	S	S	*	*			trans	-115.7	165.9	141.4	-3.7	24.7	0	0	0	112.3
172	P	40.7	Very low	34.3	Very low	110 Å²	110	150.8 Å²	150.8	71%	0.714	82%	0.819	S	S	*	*			trans	-111.4	159.5	-161.3	39.7	-31.8	0	0	0	115.7
173	G	27.5	Very low	33.8	Very low	72 Å²	72	150 Å²	150	74%	0.742	82%	0.822	S	S	*	*			trans	103.2	110.8	147.2	0	0	0	0	0	117.5
174	H	32.1	Very low	33.6	Very low	182 Å²	182	145.3 Å²	145.3	84%	0.843	81%	0.814	S	S	*	*				-155	147.4	96.7	-152.3	-85.4	0	0	0	110.4
175	I	31.5	Very low	33	Very low	143 Å²	143	149 Å²	149	73%	0.733	82%	0.824	S	S	*	*			trans	-96	132.9	177	-64.6	165.8	0	0	0	108
176	L	36.8	Very low	32.8	Very low	172 Å²	172	144.5 Å²	144.5	90%	0.901	82%	0.815	S	S	*	*			trans	-138.9	136.7	144.2	-79.9	-175.5	0	0	0	108.7
177	S	30.8	Very low	32.8	Very low	106 Å²	106	146.7 Å²	146.7	74%	0.741	82%	0.818	S	S	*	*			trans	-95.1	138.6	-170.7	179.2	0	0	0	0	111.3
178	S	27.7	Very low	32.5	Very low	123 Å²	123	144 Å²	144	86%	0.86	81%	0.813	S	S	*	*			trans	-157.5	116.7	140.5	-147.6	0	0	0	0	109.9
179	D	28	Very low	32.6	Very low	145 Å²	145	137.4 Å²	137.4	78%	0.775	80%	0.8	S	S	*	*			trans	-96.7	117.9	176.8	-170.1	-21.8	0	0	0	108.9
180	R	33.3	Very low	32.7	Very low	237 Å²	237	143.4 Å²	143.4	89%	0.894	81%	0.805	S	S	*	*			trans	-154.4	101.2	157.5	-142.8	173	-174.7	171.8	1.4	114.2
181	A	28.4	Very low	32.4	Very low	85 Å²	85	137.6 Å²	137.6	70%	0.702	80%	0.798	S	S	*	*			trans	63.6	122.4	145	0	0	0	0	0	119.3
182	A	33.2	Very low	32.2	Very low	109 Å²	109	137.5 Å²	137.5	90%	0.901	80%	0.798	S	S	*	*			trans	-68.4	137.6	166.6	0	0	0	0	0	112.3
183	A	33	Very low	31.7	Very low	98 Å²	98	139.5 Å²	139.5	81%	0.81	80%	0.798	S	S	*	*			trans	-145.2	116.2	155	0	0	0	0	0	108.2	M185	A183-M185 PolarHBondContact O-N 2.82Å
184	G	29.9	Very low	31.9	Very low	70 Å²	70	141.6 Å²	141.6	72%	0.722	80%	0.799	S	S	*	*			trans	-69.4	131.2	-177.9	0	0	0	0	0	111.5	V186	G184-V186 PolarHBondContact O-N 2.88Å
185	M	32.9	Very low	32.7	Very low	187 Å²	187	135.5 Å²	135.5	92%	0.921	77%	0.772	S	S	*	*			trans	-71.8	84.6	165.1	-80.6	-177.9	178.4	0	0	109.5	A183 W187	A183-M185 PolarHBondContact O-N 2.82Å; M185-W187 PolarHBondContact O-N 2.86Å; M185-W187 VanDerWaalsContact O-N 3.09Å
186	V	32	Very low	33.4	Very low	124 Å²	124	137.2 Å²	137.2	75%	0.752	77%	0.769	S	S	*	*			trans	-55.9	112.9	159.2	174.1	0	0	0	0	106.7	G184 K188	G184-V186 PolarHBondContact O-N 2.88Å; V186-K188 PolarHBondContact O-N 2.99Å
187	W	34.6	Very low	34.4	Very low	239 Å²	239	132.5 Å²	132.5	91%	0.905	74%	0.739	S	S	*	*			trans	-65.8	88.7	167.3	30.2	-66.4	0	0	0	105.9	M185 A189	M185-W187 PolarHBondContact O-N 2.86Å; M185-W187 VanDerWaalsContact O-N 3.09Å; W187-A189 VanDerWaalsContact C-N 3.34Å; W187-A189 PolarHBondContact O-N 2.95Å
188	K	30.5	Very low	35	Very low	184 Å²	184	131.9 Å²	131.9	80%	0.8	73%	0.725	S	S	*	*			trans	-57.4	98.6	-179.2	-174.5	176.8	-175.9	177.2	0	107.6	V186 K190	V186-K188 PolarHBondContact O-N 2.99Å; K188-K190 PolarHBondContact O-N 3.3Å
189	A	33.5	Very low	36.2	Very low	85 Å²	85	127.6 Å²	127.6	70%	0.702	70%	0.7	S	S	*	*			trans	-50	115.8	163.5	0	0	0	0	0	105.7	W187 S191	W187-A189 VanDerWaalsContact C-N 3.34Å; W187-A189 PolarHBondContact O-N 2.95Å; A189-S191 PolarHBondContact O-N 3Å
190	K	33	Very low	37.6	Very low	202 Å²	202	125.6 Å²	125.6	88%	0.878	70%	0.695	S	S	*	*			trans	-56.8	117.8	169.8	-73.4	-174.1	177.5	-176.2	0	104.8	K188 C192	K188-K190 PolarHBondContact O-N 3.3Å; K190-C192 PolarHBondContact O-N 3.37Å; K190-C192 VanDerWaalsContact O-N 3.08Å
191	S	29.7	Very low	38.8	Very low	98 Å²	98	118.1 Å²	118.1	69%	0.685	67%	0.669	S	S	*	*			trans	-50.1	120.9	-177.2	40.2	0	0	0	0	107.9	A189 E193	A189-S191 PolarHBondContact O-N 3Å; S191-E193 PolarHBondContact O-N 3.15Å
192	C	37.3	Very low	40.4	Very low	116 Å²	116	115.6 Å²	115.6	78%	0.784	64%	0.641	S	S	*	*			trans	-66.4	90.3	158.2	-161.8	0	0	0	0	104.3	K190	K190-C192 PolarHBondContact O-N 3.37Å; K190-C192 VanDerWaalsContact O-N 3.08Å
193	E	29.8	Very low	42	Very low	152 Å²	152	113 Å²	113	71%	0.71	61%	0.612	S	S	*	*			trans	-53.5	137	165	-75.1	-172.6	135.1	0	0	106.7	S191 I195	S191-E193 PolarHBondContact O-N 3.15Å; E193-I195 PolarHBondContact O-N 2.83Å
194	P	32.9	Very low	43.5	Very low	116 Å²	116	109.1 Å²	109.1	75%	0.753	58%	0.579	S	S	*	*			trans	-55.6	113.2	170.5	24.2	-31.8	0	0	0	106.7	R196	P194-R196 PolarHBondContact O-N 3.35Å
195	I	48.9	Very low	45.2	Very low	54 Å²	54	109.4 Å²	109.4	28%	0.277	58%	0.575	S	S	.	*			trans	-53.8	104.4	-175	-66.2	150.4	0	0	0	107	E193 R197 P237	E193-I195 PolarHBondContact O-N 2.83Å; I195-R197 HydrophobicContact CG2-CG 4.38Å; I195-R197 WeakPolarHBondContact O-CG 3.33Å; I195-R197 PolarHBondContact O-N 2.79Å; I195-P237 HydrophobicContact CD1-CB 3.63Å; I195-P237 HydrophobicContact CG1-CB 4.1Å
196	R	45.7	Very low	47	Very low	179 Å²	179	102.7 Å²	102.7	68%	0.675	54%	0.539	S	S	*	.			trans	-63.8	104.6	173.9	-62.4	-175.5	70.8	155.3	3.7	106	P194 E198	P194-R196 PolarHBondContact O-N 3.35Å; R196-E198 IonicContact CZ-OE2 3.67Å; R196-E198 IonicContact NE-OE2 3.2Å; R196-E198 PolarHBondContact NE-OE2 2.8Å; R196-E198 IonicContact NH2-OE2 3.7Å; R196-E198 PolarHBondContact NH2-OE2 3.48Å; R196-E198 PolarHBondContact O-N 2.98Å
197	R	56.9	Low	49.1	Very low	74 Å²	74	96.8 Å²	96.8	28%	0.279	50%	0.503	S	S	.	.			trans	-78.1	38.4	177.9	-55.7	-178.8	-167.3	146.5	-1.6	110.3	I195 W202 L314 E317	I195-R197 HydrophobicContact CG2-CG 4.38Å; I195-R197 WeakPolarHBondContact O-CG 3.33Å; I195-R197 PolarHBondContact O-N 2.79Å; R197-W202 HydrophobicContact CB-CD2 4.29Å; R197-W202 HydrophobicContact CB-CE3 4.25Å; R197-W202 HydrophobicContact CG-CZ3 4.47Å; R197-L314 PolarHBondContact NH1-O 3.04Å; R197-E317 IonicContact CZ-OE2 3.74Å; R197-E317 IonicContact NH1-OE2 2.69Å; R197-E317 PolarHBondContact NH1-OE2 3.08Å; R197-E317 IonicContact NH2-OE2 2.75Å
198	E	44.2	Very low	50.8	Low	93 Å²	93	89.3 Å²	89.3	44%	0.435	48%	0.481	S	S	.	.			trans	-116.8	117.5	-172.3	-76.4	162.6	-163.7	0	0	107.6	R196 N318	R196-E198 IonicContact CZ-OE2 3.67Å; R196-E198 IonicContact NE-OE2 3.2Å; R196-E198 PolarHBondContact NE-OE2 2.8Å; R196-E198 IonicContact NH2-OE2 3.7Å; R196-E198 PolarHBondContact NH2-OE2 3.48Å; R196-E198 PolarHBondContact O-N 2.98Å; E198-N318 PolarHBondContact OE1-ND2 2.93Å
199	G	52.9	Low	52.6	Low	33 Å²	33	87.9 Å²	87.9	34%	0.34	48%	0.477	S	S	.	.	S	Bend	trans	151.1	161	179.3	0	0	0	0	0	111.9	K201 W202	G199-K201 PolarHBondContact O-N 2.78Å; G199-W202 PolarHBondContact O-N 2.81Å
200	P	56.1	Low	54.5	Low	102 Å²	102	88.4 Å²	88.4	66%	0.662	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-61.3	-19	-169.2	22.3	-33.8	0	0	0	114.6	W202 D203	P200-W202 PolarHBondContact O-N 3.09Å; P200-D203 WeakPolarHBondContact CA-OD2 3.31Å; P200-D203 PolarHBondContact O-N 3.31Å
201	K	60	Low	57	Low	80 Å²	80	79.8 Å²	79.8	35%	0.348	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-68	-17.3	174.2	-70.6	179.9	174.6	-86.5	0	113.8	G199 R206 D273 D276	G199-K201 PolarHBondContact O-N 2.78Å; K201-R206 VanDerWaalsContact CA-NH1 3.28Å; K201-R206 WeakPolarHBondContact O-CD 3.44Å; K201-R206 PolarHBondContact O-NH1 2.79Å; K201-D273 IonicContact NZ-OD1 2.74Å; K201-D273 PolarHBondContact NZ-OD1 3.26Å; K201-D276 IonicContact NZ-OD2 3.26Å; K201-D276 PolarHBondContact NZ-OD2 3.35Å
202	W	62.1	Low	59.8	Low	32 Å²	32	77 Å²	77	12%	0.121	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-110.1	6.7	179.9	-69.7	74.6	0	0	0	113	R197 G199 P200 H238 F240 L314	R197-W202 HydrophobicContact CB-CD2 4.29Å; R197-W202 HydrophobicContact CB-CE3 4.25Å; R197-W202 HydrophobicContact CG-CZ3 4.47Å; G199-W202 PolarHBondContact O-N 2.81Å; P200-W202 PolarHBondContact O-N 3.09Å; W202-H238 PolarHBondContact NE1-O 3.13Å; W202-F240 HydrophobicContact CD2-CB 4.47Å; W202-F240 HydrophobicContact CD2-CD2 4.27Å; W202-F240 AromaticContact CE3-CD2 3.81Å; W202-F240 HydrophobicContact CE3-CD2 3.81Å; W202-F240 HydrophobicContact CH2-CD2 4.03Å; W202-F240 HydrophobicContact CZ2-CB 4.18Å; W202-F240 HydrophobicContact CZ2-CD2 4.46Å; W202-F240 AromaticContact CZ3-CD2 3.68Å; W202-F240 HydrophobicContact CZ3-CD2 3.68Å; W202-F240 HydrophobicContact CZ3-CE2 4.32Å; W202-L314 HydrophobicContact CZ3-CB 4.43Å; W202-L314 HydrophobicContact CZ3-CD1 3.82Å
203	D	66.1	Low	62.3	Low	54 Å²	54	71.5 Å²	71.5	29%	0.289	38%	0.381	S	S	.	.			trans	-73.2	125.1	178.7	-78.6	-30.4	0	0	0	111.4	P200 A205 R206 R315	P200-D203 WeakPolarHBondContact CA-OD2 3.31Å; P200-D203 PolarHBondContact O-N 3.31Å; D203-A205 PolarHBondContact O-N 3.06Å; D203-A205 VanDerWaalsContact O-N 3.12Å; D203-R206 VanDerWaalsContact O-CG 3.31Å; D203-R206 WeakPolarHBondContact O-CG 3.26Å; D203-R206 PolarHBondContact O-N 3.38Å; D203-R206 VanDerWaalsContact O-N 3.08Å; D203-R315 IonicContact OD1-CZ 3.77Å; D203-R315 IonicContact OD1-NH1 2.69Å; D203-R315 PolarHBondContact OD1-NH1 2.73Å; D203-R315 IonicContact OD1-NH2 3.61Å
204	P	64.9	Low	65.2	Low	17 Å²	17	64.2 Å²	64.2	11%	0.11	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-61.2	-25.3	179.6	23.3	-32.6	0	0	0	112.5	R206 L207 R308	P204-R206 PolarHBondContact O-N 3.38Å; P204-L207 PolarHBondContact O-N 2.95Å; P204-R308 HydrophobicContact CB-CG 3.52Å; P204-R308 PolarHBondContact O-NH1 2.91Å
205	A	64.3	Low	67.9	Low	77 Å²	77	59.4 Å²	59.4	64%	0.636	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-66.9	-16.2	177.6	0	0	0	0	0	114.3	D203 L207	D203-A205 PolarHBondContact O-N 3.06Å; D203-A205 VanDerWaalsContact O-N 3.12Å; A205-L207 VanDerWaalsContact C-N 3.31Å
206	R	72.6	Confident	69.8	Low	45 Å²	45	56.9 Å²	56.9	17%	0.17	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-77.7	-16.5	175.3	87.2	-172	-73.9	-142.2	-1	113.3	K201 D203 P204 N208 T211 E272 D273	K201-R206 VanDerWaalsContact CA-NH1 3.28Å; K201-R206 WeakPolarHBondContact O-CD 3.44Å; K201-R206 PolarHBondContact O-NH1 2.79Å; D203-R206 VanDerWaalsContact O-CG 3.31Å; D203-R206 WeakPolarHBondContact O-CG 3.26Å; D203-R206 PolarHBondContact O-N 3.38Å; D203-R206 VanDerWaalsContact O-N 3.08Å; P204-R206 PolarHBondContact O-N 3.38Å; R206-N208 PolarHBondContact O-N 3.12Å; R206-T211 PolarHBondContact O-OG1 3.3Å; R206-E272 IonicContact CZ-OE2 3.82Å; R206-E272 IonicContact NE-OE2 2.79Å; R206-E272 IonicContact NH2-OE2 3.94Å; R206-E272 PolarHBondContact NH2-OE2 2.86Å; R206-D273 IonicContact CZ-OD1 3.94Å; R206-D273 IonicContact CZ-OD2 2.66Å; R206-D273 VanDerWaalsContact NH1-CG 3.25Å; R206-D273 IonicContact NH1-OD1 2.68Å; R206-D273 PolarHBondContact NH1-OD1 3.19Å; R206-D273 IonicContact NH1-OD2 2.65Å; R206-D273 PolarHBondContact NH1-OD2 3.3Å; R206-D273 IonicContact NH2-OD1 3.71Å; R206-D273 PolarHBondContact NH2-OD1 3.34Å; R206-D273 IonicContact NH2-OD2 2.75Å
207	L	75.6	Confident	71.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.297	C	S	.	.			trans	-85	105.7	177.3	-58.6	-167.5	0	0	0	109.7	P204 A205 T211 F213 I270 V304 M307 R308 M311	P204-L207 PolarHBondContact O-N 2.95Å; A205-L207 VanDerWaalsContact C-N 3.31Å; L207-T211 HydrophobicContact CD2-CG2 4.26Å; L207-F213 HydrophobicContact CD2-CE1 4.14Å; L207-F213 HydrophobicContact CD2-CZ 3.95Å; L207-I270 HydrophobicContact CD2-CD1 3.86Å; L207-I270 HydrophobicContact CD2-CG1 4.24Å; L207-V304 HydrophobicContact CB-CG1 4.12Å; L207-M307 HydrophobicContact CD1-CB 3.91Å; L207-R308 PolarHBondContact O-NH1 3.48Å; L207-R308 PolarHBondContact O-NH2 3.42Å; L207-M311 HydrophobicContact CD1-CE 3.97Å; L207-M311 HydrophobicContact CD1-SD 3.61Å; L207-M311 HydrophobicContact CD2-CE 3.92Å; L207-M311 HydrophobicContact CD2-SD 4.35Å; L207-M311 HydrophobicContact CG-CE 4.03Å; L207-M311 HydrophobicContact CG-SD 3.79Å
208	N	69.3	Low	73.1	Confident	82 Å²	82	52.4 Å²	52.4	44%	0.439	30%	0.298	S	S	.	.			trans	-118.4	168.5	177.1	-67.5	-35.7	0	0	0	110	R206 S210 T211	R206-N208 PolarHBondContact O-N 3.12Å; N208-S210 PolarHBondContact O-N 3.09Å; N208-S210 VanDerWaalsContact O-N 3.17Å; N208-T211 PolarHBondContact N-OG1 3.04Å; N208-T211 VanDerWaalsContact O-CB 3.29Å; N208-T211 WeakPolarHBondContact O-CB 3.49Å; N208-T211 PolarHBondContact O-N 3.49Å; N208-T211 PolarHBondContact O-OG1 2.89Å
209	E	68.8	Low	75.1	Confident	154 Å²	154	48 Å²	48	72%	0.72	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.5	177.3	-61.8	179.2	179.1	0	0	112.8	V298	E209-V298 WeakPolarHBondContact O-CG1 3.42Å
210	S	73.7	Confident	76.8	Confident	97 Å²	97	46.8 Å²	46.8	68%	0.678	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-5.2	172.6	57.5	0	0	0	0	114.2	N208 T212	N208-S210 PolarHBondContact O-N 3.09Å; N208-S210 VanDerWaalsContact O-N 3.17Å; S210-T212 PolarHBondContact O-N 2.85Å
211	T	85.4	Confident	78.1	Confident	20 Å²	20	46.7 Å²	46.7	12%	0.123	25%	0.252	C	S	.	.			trans	-71.1	124.6	-178.9	-56.6	0	0	0	0	110.2	R206 L207 N208 F213 I270	R206-T211 PolarHBondContact O-OG1 3.3Å; L207-T211 HydrophobicContact CD2-CG2 4.26Å; N208-T211 PolarHBondContact N-OG1 3.04Å; N208-T211 VanDerWaalsContact O-CB 3.29Å; N208-T211 WeakPolarHBondContact O-CB 3.49Å; N208-T211 PolarHBondContact O-N 3.49Å; N208-T211 PolarHBondContact O-OG1 2.89Å; T211-F213 HydrophobicContact CG2-CE1 4.26Å; T211-F213 HydrophobicContact CG2-CE2 3.84Å; T211-F213 HydrophobicContact CG2-CZ 3.71Å; T211-F213 VanDerWaalsContact O-CD2 3.26Å; T211-F213 WeakPolarHBondContact O-CD2 3.2Å; T211-F213 WeakPolarHBondContact O-CE2 3.25Å; T211-I270 HydrophobicContact CG2-CG2 4.19Å
212	T	87.5	Confident	79.3	Confident	40 Å²	40	42.9 Å²	42.9	25%	0.245	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	141.8	177.7	45.1	0	0	0	0	111.7	S210 E271 V298	S210-T212 PolarHBondContact O-N 2.85Å; T212-E271 WeakPolarHBondContact CB-OE2 3.47Å; T212-E271 WeakPolarHBondContact O-CB 3.46Å; T212-E271 PolarHBondContact O-N 2.97Å; T212-E271 WeakPolarHBondContact OG1-CB 3.39Å; T212-E271 PolarHBondContact OG1-OE2 3.45Å; T212-V298 HydrophobicContact CG2-CG2 4.08Å
213	F	90.3	Very high	80.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	153.4	-177.5	-62.5	-91.2	0	0	0	111.1	L207 T211 L269 I270 S296 F297 L299 M307	L207-F213 HydrophobicContact CD2-CE1 4.14Å; L207-F213 HydrophobicContact CD2-CZ 3.95Å; T211-F213 HydrophobicContact CG2-CE1 4.26Å; T211-F213 HydrophobicContact CG2-CE2 3.84Å; T211-F213 HydrophobicContact CG2-CZ 3.71Å; T211-F213 VanDerWaalsContact O-CD2 3.26Å; T211-F213 WeakPolarHBondContact O-CD2 3.2Å; T211-F213 WeakPolarHBondContact O-CE2 3.25Å; F213-L269 CarbonylContact C-O 3.5Å; F213-L269 WeakPolarHBondContact CA-O 3.49Å; F213-I270 HydrophobicContact CD1-CG1 4.27Å; F213-I270 HydrophobicContact CE1-CG1 3.89Å; F213-S296 VanDerWaalsContact O-CA 3.24Å; F213-S296 WeakPolarHBondContact O-CA 3.16Å; F213-F297 PolarHBondContact N-O 3.25Å; F213-F297 WeakPolarHBondContact O-CD1 3.4Å; F213-F297 PolarHBondContact O-N 2.78Å; F213-L299 HydrophobicContact CB-CD1 4.19Å; F213-L299 HydrophobicContact CB-CG 4.23Å; F213-L299 HydrophobicContact CD1-CD1 4.07Å; F213-L299 HydrophobicContact CD2-CB 4.05Å; F213-L299 HydrophobicContact CD2-CD1 3.42Å; F213-L299 VanDerWaalsContact CD2-CD1 3.42Å; F213-L299 HydrophobicContact CD2-CG 3.43Å; F213-L299 VanDerWaalsContact CD2-CG 3.43Å; F213-L299 HydrophobicContact CE1-CD1 4.29Å; F213-L299 HydrophobicContact CE2-CB 4.13Å; F213-L299 HydrophobicContact CE2-CD1 3.65Å; F213-L299 HydrophobicContact CE2-CG 3.91Å; F213-L299 HydrophobicContact CG-CD1 3.61Å; F213-L299 HydrophobicContact CG-CG 3.93Å; F213-L299 HydrophobicContact CZ-CD1 4.06Å; F213-M307 HydrophobicContact CD1-CE 3.75Å; F213-M307 HydrophobicContact CD1-SD 4.46Å; F213-M307 HydrophobicContact CE1-CE 3.26Å; F213-M307 HydrophobicContact CE1-SD 4.1Å; F213-M307 HydrophobicContact CZ-CE 3.97Å; F213-M307 HydrophobicContact CZ-SD 4.36Å
214	V	90.5	Very high	80.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.3	177.4	-64.5	0	0	0	0	110.9	A219 L269 E271 I274 L294	V214-A219 HydrophobicContact CG2-CB 4.15Å; V214-L269 HydrophobicContact CG2-CB 4.01Å; V214-L269 PolarHBondContact N-O 3.15Å; V214-L269 PolarHBondContact O-N 3.09Å; V214-E271 HydrophobicContact CG1-CB 4.15Å; V214-E271 HydrophobicContact CG1-CG 4.03Å; V214-I274 HydrophobicContact CG2-CB 4.49Å; V214-I274 HydrophobicContact CG2-CG1 3.79Å; V214-L294 HydrophobicContact CB-CD2 4.42Å; V214-L294 HydrophobicContact CG1-CB 4.16Å; V214-L294 HydrophobicContact CG1-CD2 4.18Å; V214-L294 HydrophobicContact CG2-CD2 4.4Å
215	L	90.1	Very high	81.4	Confident	15 Å²	15	40.9 Å²	40.9	8%	0.079	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	133	174.8	-172	66.4	0	0	0	109.8	S217 R218 A219 M258 A266 L268	L215-S217 VanDerWaalsContact CD2-OG 3.29Å; L215-S217 WeakPolarHBondContact CD2-OG 3.46Å; L215-S217 WeakPolarHBondContact CG-OG 3.42Å; L215-S217 PolarHBondContact O-N 2.81Å; L215-R218 HydrophobicContact CB-CG 4.28Å; L215-R218 WeakPolarHBondContact O-CA 3.48Å; L215-R218 VanDerWaalsContact O-CB 3.28Å; L215-R218 WeakPolarHBondContact O-CB 3.45Å; L215-R218 PolarHBondContact O-N 3Å; L215-A219 PolarHBondContact O-N 3.15Å; L215-M258 HydrophobicContact CD2-CG 3.98Å; L215-A266 HydrophobicContact CD1-CB 4Å; L215-L268 HydrophobicContact CD1-CD2 4.13Å
216	G	88.6	Confident	81.7	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-59.4	-25.1	-175	0	0	0	0	0	115.3	N220 Y267	G216-N220 WeakPolarHBondContact O-CB 3.45Å; G216-N220 PolarHBondContact O-N 2.99Å; G216-N220 PolarHBondContact O-ND2 2.68Å; G216-Y267 PolarHBondContact N-O 3.34Å
217	S	84.5	Confident	81.5	Confident	79 Å²	79	40.9 Å²	40.9	55%	0.552	26%	0.257	S	S	*	.	H	α-helix	trans	-68.1	-33.5	170.5	57.7	0	0	0	0	113.1	L215 K221	L215-S217 VanDerWaalsContact CD2-OG 3.29Å; L215-S217 WeakPolarHBondContact CD2-OG 3.46Å; L215-S217 WeakPolarHBondContact CG-OG 3.42Å; L215-S217 PolarHBondContact O-N 2.81Å; S217-K221 PolarHBondContact O-N 3.37Å
218	R	86.6	Confident	81.1	Confident	79 Å²	79	44.2 Å²	44.2	30%	0.298	28%	0.278	S	S	.	.	H	α-helix	trans	-72	-48	172.7	-64	-70.5	-178.1	173.3	-1.3	110.7	L215 N220 K221 A222	L215-R218 HydrophobicContact CB-CG 4.28Å; L215-R218 WeakPolarHBondContact O-CA 3.48Å; L215-R218 VanDerWaalsContact O-CB 3.28Å; L215-R218 WeakPolarHBondContact O-CB 3.45Å; L215-R218 PolarHBondContact O-N 3Å; R218-N220 PolarHBondContact O-N 3.5Å; R218-K221 WeakPolarHBondContact O-CA 3.37Å; R218-K221 PolarHBondContact O-N 3.24Å; R218-A222 WeakPolarHBondContact O-CB 3.31Å; R218-A222 PolarHBondContact O-N 3.17Å
219	A	88.1	Confident	81.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.3	-43.7	177.4	0	0	0	0	0	112.6	V214 L215 K221 A222 L223 I232 L269 I274 L294	V214-A219 HydrophobicContact CG2-CB 4.15Å; L215-A219 PolarHBondContact O-N 3.15Å; A219-K221 VanDerWaalsContact C-N 3.28Å; A219-K221 PolarHBondContact O-N 3.3Å; A219-A222 PolarHBondContact O-N 3.08Å; A219-L223 WeakPolarHBondContact O-CG 3.37Å; A219-L223 PolarHBondContact O-N 3.4Å; A219-L223 VanDerWaalsContact O-N 3.08Å; A219-I232 HydrophobicContact CB-CD1 4.04Å; A219-L269 HydrophobicContact CB-CD1 3.52Å; A219-I274 HydrophobicContact CB-CD1 4.1Å; A219-I274 HydrophobicContact CB-CG1 4.2Å; A219-I274 HydrophobicContact CB-CG2 4.28Å; A219-L294 HydrophobicContact CB-CD2 4.47Å
220	N	86.9	Confident	81.5	Confident	8 Å²	8	44 Å²	44	4%	0.043	27%	0.269	C	S	.	.	H	α-helix	trans	-59.5	-36.7	173	-82	-82.4	0	0	0	112.3	G216 R218 M225 G226 R231 I232	G216-N220 WeakPolarHBondContact O-CB 3.45Å; G216-N220 PolarHBondContact O-N 2.99Å; G216-N220 PolarHBondContact O-ND2 2.68Å; R218-N220 PolarHBondContact O-N 3.5Å; N220-M225 CarbonylContact O-C 3.6Å; N220-M225 VanDerWaalsContact O-CA 3.23Å; N220-M225 WeakPolarHBondContact O-CA 3.27Å; N220-M225 WeakPolarHBondContact O-CB 3.37Å; N220-M225 PolarHBondContact O-N 3.12Å; N220-G226 PolarHBondContact O-N 3.42Å; N220-G226 VanDerWaalsContact O-N 3.11Å; N220-R231 PolarHBondContact OD1-N 3.01Å; N220-I232 WeakPolarHBondContact ND2-CG2 3.43Å; N220-I232 WeakPolarHBondContact OD1-CB 3.35Å; N220-I232 WeakPolarHBondContact OD1-CG2 3.45Å; N220-I232 PolarHBondContact OD1-N 2.9Å
221	K	84.8	Confident	81.9	Confident	101 Å²	101	45.4 Å²	45.4	44%	0.439	26%	0.259	S	S	.	.	H	α-helix	trans	-74.5	-43.4	178.5	-167.5	-176.6	176.6	-145.4	0	111.9	S217 R218 A219 L223 G224 E293	S217-K221 PolarHBondContact O-N 3.37Å; R218-K221 WeakPolarHBondContact O-CA 3.37Å; R218-K221 PolarHBondContact O-N 3.24Å; A219-K221 VanDerWaalsContact C-N 3.28Å; A219-K221 PolarHBondContact O-N 3.3Å; K221-L223 VanDerWaalsContact C-N 3.3Å; K221-L223 PolarHBondContact O-N 3.21Å; K221-G224 PolarHBondContact O-N 3.27Å; K221-E293 VanDerWaalsContact CD-OE2 3.29Å; K221-E293 WeakPolarHBondContact CD-OE2 3.37Å; K221-E293 WeakPolarHBondContact CE-OE2 3.38Å; K221-E293 IonicContact NZ-OE1 2.95Å; K221-E293 PolarHBondContact NZ-OE1 2.85Å; K221-E293 IonicContact NZ-OE2 3.56Å; K221-E293 PolarHBondContact NZ-OE2 3.09Å
222	A	85.3	Confident	82	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-33.5	-179.4	0	0	0	0	0	113	R218 A219 G224 L289 K290 L294	R218-A222 WeakPolarHBondContact O-CB 3.31Å; R218-A222 PolarHBondContact O-N 3.17Å; A219-A222 PolarHBondContact O-N 3.08Å; A222-G224 VanDerWaalsContact C-N 3.28Å; A222-G224 PolarHBondContact O-N 2.92Å; A222-L289 CarbonylContact O-C 3.58Å; A222-L289 WeakPolarHBondContact O-CA 3.38Å; A222-K290 VanDerWaalsContact CB-O 3.29Å; A222-K290 WeakPolarHBondContact CB-O 3.28Å; A222-K290 PolarHBondContact O-N 3.49Å; A222-L294 HydrophobicContact CB-CD1 4.37Å; A222-L294 HydrophobicContact CB-CD2 3.45Å; A222-L294 VanDerWaalsContact CB-CD2 3.45Å; A222-L294 HydrophobicContact CB-CG 3.62Å
223	L	83.6	Confident	81.9	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.016	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-87.3	22.6	176.3	-61.7	176.9	0	0	0	113.7	A219 K221 M225 I232 I274 A278 Y283 L289	A219-L223 WeakPolarHBondContact O-CG 3.37Å; A219-L223 PolarHBondContact O-N 3.4Å; A219-L223 VanDerWaalsContact O-N 3.08Å; K221-L223 VanDerWaalsContact C-N 3.3Å; K221-L223 PolarHBondContact O-N 3.21Å; L223-M225 HydrophobicContact CB-CE 3.55Å; L223-M225 HydrophobicContact CD1-CE 3.61Å; L223-M225 HydrophobicContact CG-CE 4.25Å; L223-M225 PolarHBondContact O-N 2.98Å; L223-I232 HydrophobicContact CD1-CD1 3.63Å; L223-I232 HydrophobicContact CD1-CG1 4.13Å; L223-I274 HydrophobicContact CD1-CG2 4.34Å; L223-I274 HydrophobicContact CD2-CG2 4.37Å; L223-I274 HydrophobicContact CG-CG2 4.34Å; L223-A278 HydrophobicContact CD2-CB 3.81Å; L223-Y283 HydrophobicContact CB-CD1 4.29Å; L223-Y283 HydrophobicContact CB-CE1 4.04Å; L223-Y283 HydrophobicContact CD2-CD1 4.49Å; L223-L289 HydrophobicContact CD2-CD2 3.91Å
224	G	78.2	Confident	81.6	Confident	39 Å²	39	51.7 Å²	51.7	40%	0.402	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	0	-178.2	0	0	0	0	0	115.9	K221 A222 G226	K221-G224 PolarHBondContact O-N 3.27Å; A222-G224 VanDerWaalsContact C-N 3.28Å; A222-G224 PolarHBondContact O-N 2.92Å; G224-G226 VanDerWaalsContact C-N 3.3Å; G224-G226 PolarHBondContact O-N 3.09Å
225	M	75.8	Confident	81.2	Confident	18 Å²	18	56.9 Å²	56.9	9%	0.089	31%	0.308	C	S	.	.			trans	-87.2	12.2	-174.8	-69.4	-174.2	-78.8	0	0	114.4	N220 L223 G227 T228 R231 I232 Y283	N220-M225 CarbonylContact O-C 3.6Å; N220-M225 VanDerWaalsContact O-CA 3.23Å; N220-M225 WeakPolarHBondContact O-CA 3.27Å; N220-M225 WeakPolarHBondContact O-CB 3.37Å; N220-M225 PolarHBondContact O-N 3.12Å; L223-M225 HydrophobicContact CB-CE 3.55Å; L223-M225 HydrophobicContact CD1-CE 3.61Å; L223-M225 HydrophobicContact CG-CE 4.25Å; L223-M225 PolarHBondContact O-N 2.98Å; M225-G227 PolarHBondContact O-N 2.76Å; M225-T228 PolarHBondContact O-N 3.12Å; M225-R231 HydrophobicContact CB-CB 4.16Å; M225-R231 HydrophobicContact CG-CB 4.43Å; M225-R231 HydrophobicContact SD-CB 4Å; M225-I232 HydrophobicContact CE-CB 3.76Å; M225-I232 HydrophobicContact CE-CD1 4.5Å; M225-I232 HydrophobicContact CE-CG1 3.84Å; M225-Y283 HydrophobicContact CE-CE1 3.86Å; M225-Y283 WeakPolarHBondContact CE-OH 3Å; M225-Y283 HydrophobicContact SD-CE1 4.3Å; M225-Y283 PolarHBondContact SD-OH 2.91Å
226	G	69.1	Low	80.9	Confident	50 Å²	50	57.3 Å²	57.3	52%	0.515	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-19.6	-170	0	0	0	0	0	116.4	N220 G224 T228	N220-G226 PolarHBondContact O-N 3.42Å; N220-G226 VanDerWaalsContact O-N 3.11Å; G224-G226 VanDerWaalsContact C-N 3.3Å; G224-G226 PolarHBondContact O-N 3.09Å; G226-T228 VanDerWaalsContact C-N 3.3Å; G226-T228 PolarHBondContact O-N 2.85Å
227	G	69	Low	80.5	Confident	73 Å²	73	59.4 Å²	59.4	75%	0.753	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.7	-177	0	0	0	0	0	115.9	M225	M225-G227 PolarHBondContact O-N 2.76Å
228	T	67	Low	80.3	Confident	70 Å²	70	61.3 Å²	61.3	43%	0.429	32%	0.323	S	S	.	.	S	Bend	trans	-148.5	129.3	169.8	-44.7	0	0	0	0	110.1	M225 G226 G230 R231	M225-T228 PolarHBondContact O-N 3.12Å; G226-T228 VanDerWaalsContact C-N 3.3Å; G226-T228 PolarHBondContact O-N 2.85Å; T228-G230 PolarHBondContact O-N 2.94Å; T228-R231 VanDerWaalsContact CB-NE 3.3Å; T228-R231 PolarHBondContact OG1-NE 3.16Å; T228-R231 PolarHBondContact OG1-NH2 2.88Å
229	R	69.9	Low	80.2	Confident	216 Å²	216	58.2 Å²	58.2	82%	0.815	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	131.7	-177.1	-67	-176.2	179.4	126.7	7.9	111
230	G	76.4	Confident	80.1	Confident	15 Å²	15	58.2 Å²	58.2	16%	0.155	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	6.3	169.4	0	0	0	0	0	116.2	T228 I232 Y233	T228-G230 PolarHBondContact O-N 2.94Å; G230-I232 PolarHBondContact O-N 3.46Å; G230-Y233 WeakPolarHBondContact O-CD2 3.46Å; G230-Y233 PolarHBondContact O-N 3.22Å
231	R	82.8	Confident	80.2	Confident	127 Å²	127	61.4 Å²	61.4	48%	0.479	33%	0.326	S	S	.	.	H	α-helix	trans	-52.4	-38.3	174.2	-76.9	-177.3	-177.8	-169.7	6.7	112.5	N220 M225 T228 Y233 I234 K235	N220-R231 PolarHBondContact OD1-N 3.01Å; M225-R231 HydrophobicContact CB-CB 4.16Å; M225-R231 HydrophobicContact CG-CB 4.43Å; M225-R231 HydrophobicContact SD-CB 4Å; T228-R231 VanDerWaalsContact CB-NE 3.3Å; T228-R231 PolarHBondContact OG1-NE 3.16Å; T228-R231 PolarHBondContact OG1-NH2 2.88Å; R231-Y233 VanDerWaalsContact C-N 3.25Å; R231-Y233 PolarHBondContact O-N 3.17Å; R231-I234 PolarHBondContact O-N 3.1Å; R231-K235 PolarHBondContact O-N 3.12Å
232	I	86.2	Confident	80.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-54.2	-38.2	177.4	-164.2	178	0	0	0	113.1	A219 N220 L223 M225 G230 I234 H236 L239 L269 I274	A219-I232 HydrophobicContact CB-CD1 4.04Å; N220-I232 WeakPolarHBondContact ND2-CG2 3.43Å; N220-I232 WeakPolarHBondContact OD1-CB 3.35Å; N220-I232 WeakPolarHBondContact OD1-CG2 3.45Å; N220-I232 PolarHBondContact OD1-N 2.9Å; L223-I232 HydrophobicContact CD1-CD1 3.63Å; L223-I232 HydrophobicContact CD1-CG1 4.13Å; M225-I232 HydrophobicContact CE-CB 3.76Å; M225-I232 HydrophobicContact CE-CD1 4.5Å; M225-I232 HydrophobicContact CE-CG1 3.84Å; G230-I232 PolarHBondContact O-N 3.46Å; I232-I234 VanDerWaalsContact C-N 3.28Å; I232-I234 PolarHBondContact O-N 3.44Å; I232-H236 WeakPolarHBondContact O-CB 3.5Å; I232-H236 PolarHBondContact O-N 2.79Å; I232-L239 HydrophobicContact CD1-CD2 3.66Å; I232-L239 HydrophobicContact CG1-CD2 3.79Å; I232-L269 HydrophobicContact CD1-CD1 4.23Å; I232-I274 HydrophobicContact CD1-CD1 3.69Å
233	Y	85.8	Confident	80.7	Confident	48 Å²	48	59.1 Å²	59.1	19%	0.188	32%	0.324	C	S	.	.	H	α-helix	trans	-77.5	-15.1	-177.1	-42.3	-56.8	0	0	0	113.3	G230 R231 K241 Y267 L269	G230-Y233 WeakPolarHBondContact O-CD2 3.46Å; G230-Y233 PolarHBondContact O-N 3.22Å; R231-Y233 VanDerWaalsContact C-N 3.25Å; R231-Y233 PolarHBondContact O-N 3.17Å; Y233-K241 HydrophobicContact CD1-CD 4.06Å; Y233-Y267 HydrophobicContact CE1-CD2 4.37Å; Y233-Y267 HydrophobicContact CE1-CG 4.35Å; Y233-Y267 AromaticContact CE2-CD2 3.87Å; Y233-Y267 HydrophobicContact CE2-CD2 3.87Å; Y233-Y267 HydrophobicContact CE2-CE2 4.22Å; Y233-Y267 AromaticContact CZ-CD2 3.67Å; Y233-L269 HydrophobicContact CE1-CD1 4.46Å; Y233-L269 HydrophobicContact CE1-CD2 4.25Å
234	I	83.7	Confident	81	Confident	144 Å²	144	59.2 Å²	59.2	74%	0.738	33%	0.325	S	S	*	.	H	α-helix	trans	-94.1	-41.8	177.1	-56.2	172.8	0	0	0	109.4	R231 I232	R231-I234 PolarHBondContact O-N 3.1Å; I232-I234 VanDerWaalsContact C-N 3.28Å; I232-I234 PolarHBondContact O-N 3.44Å
235	K	82	Confident	81.5	Confident	108 Å²	108	59.8 Å²	59.8	47%	0.47	32%	0.318	S	S	.	.	H	α-helix	trans	-65.7	-39.5	173.8	-108.1	-76.1	-167.2	170.8	0	111.8	R231 P237 D282	R231-K235 PolarHBondContact O-N 3.12Å; K235-P237 WeakPolarHBondContact O-CD 3.45Å; K235-D282 IonicContact NZ-OD1 2.69Å; K235-D282 PolarHBondContact NZ-OD1 3.2Å
236	H	84	Confident	82.1	Confident	24 Å²	24	64.4 Å²	64.4	11%	0.111	35%	0.35	C	S	.	.			trans	-121.4	78.5	-177.4	-58.1	-59.5	0	0	0	111.6	I232 H238 L239 L277 Y283	I232-H236 WeakPolarHBondContact O-CB 3.5Å; I232-H236 PolarHBondContact O-N 2.79Å; H236-H238 PolarHBondContact O-N 3.38Å; H236-L239 HydrophobicContact CB-CB 3.79Å; H236-L239 HydrophobicContact CB-CD2 4.28Å; H236-L239 WeakPolarHBondContact O-CB 3.44Å; H236-L239 PolarHBondContact O-N 3.14Å; H236-L277 HydrophobicContact CB-CD1 4.31Å; H236-L277 WeakPolarHBondContact ND1-CD2 3.43Å; H236-Y283 AromaticContact CE1-CE2 3.81Å; H236-Y283 AromaticContact NE2-CE2 3.25Å; H236-Y283 WeakPolarHBondContact NE2-CE2 3.41Å; H236-Y283 AromaticContact NE2-CZ 3.47Å; H236-Y283 PolarHBondContact NE2-OH 3.46Å
237	P	81.1	Confident	83.1	Confident	46 Å²	46	67.3 Å²	67.3	30%	0.299	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-26.8	177.6	24.4	-32.1	0	0	0	113.2	I195 K235 L239	I195-P237 HydrophobicContact CD1-CB 3.63Å; I195-P237 HydrophobicContact CG1-CB 4.1Å; K235-P237 WeakPolarHBondContact O-CD 3.45Å; P237-L239 VanDerWaalsContact C-N 3.32Å
238	H	79.6	Confident	84.1	Confident	118 Å²	118	63.9 Å²	63.9	55%	0.546	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-7.8	178.3	-56.4	-87.6	0	0	0	114.1	W202 H236 F240	W202-H238 PolarHBondContact NE1-O 3.13Å; H236-H238 PolarHBondContact O-N 3.38Å; H238-F240 PolarHBondContact O-N 3.32Å
239	L	85.5	Confident	85.1	Confident	14 Å²	14	62.1 Å²	62.1	7%	0.073	30%	0.301	C	S	.	.	S	Bend	trans	-72.1	122.8	-179.1	178	60.3	0	0	0	110.3	I232 H236 P237 K241 L269 D273 I274 L277	I232-L239 HydrophobicContact CD1-CD2 3.66Å; I232-L239 HydrophobicContact CG1-CD2 3.79Å; H236-L239 HydrophobicContact CB-CB 3.79Å; H236-L239 HydrophobicContact CB-CD2 4.28Å; H236-L239 WeakPolarHBondContact O-CB 3.44Å; H236-L239 PolarHBondContact O-N 3.14Å; P237-L239 VanDerWaalsContact C-N 3.32Å; L239-K241 PolarHBondContact O-N 3.25Å; L239-L269 HydrophobicContact CD1-CD2 4.47Å; L239-L269 HydrophobicContact CD2-CD2 3.78Å; L239-L269 HydrophobicContact CG-CD2 3.87Å; L239-D273 HydrophobicContact CD1-CB 3.71Å; L239-I274 HydrophobicContact CD1-CD1 4.23Å; L239-I274 HydrophobicContact CD2-CD1 3.91Å; L239-L277 HydrophobicContact CD1-CD1 3.86Å; L239-L277 HydrophobicContact CD2-CD1 3.77Å; L239-L277 HydrophobicContact CG-CD1 4.29Å
240	F	86.2	Confident	85.9	Confident	1 Å²	1	57.3 Å²	57.3	0%	0.004	29%	0.287	C	S	.	.			trans	-59	131.6	173.8	174.8	-97.7	0	0	0	110.5	W202 H238 L269 I270 M307 Y310 M311	W202-F240 HydrophobicContact CD2-CB 4.47Å; W202-F240 HydrophobicContact CD2-CD2 4.27Å; W202-F240 AromaticContact CE3-CD2 3.81Å; W202-F240 HydrophobicContact CE3-CD2 3.81Å; W202-F240 HydrophobicContact CH2-CD2 4.03Å; W202-F240 HydrophobicContact CZ2-CB 4.18Å; W202-F240 HydrophobicContact CZ2-CD2 4.46Å; W202-F240 AromaticContact CZ3-CD2 3.68Å; W202-F240 HydrophobicContact CZ3-CD2 3.68Å; W202-F240 HydrophobicContact CZ3-CE2 4.32Å; H238-F240 PolarHBondContact O-N 3.32Å; F240-L269 VanDerWaalsContact O-CD2 3.26Å; F240-L269 WeakPolarHBondContact O-CD2 3.29Å; F240-I270 HydrophobicContact CD1-CD1 3.95Å; F240-I270 HydrophobicContact CD1-CG1 4.17Å; F240-M307 HydrophobicContact CE1-CE 3.8Å; F240-M307 HydrophobicContact CZ-CE 4.33Å; F240-Y310 HydrophobicContact CE2-CD1 4.01Å; F240-Y310 HydrophobicContact CE2-CE1 4.22Å; F240-Y310 HydrophobicContact CZ-CD1 4.08Å; F240-Y310 HydrophobicContact CZ-CE1 4.46Å; F240-M311 HydrophobicContact CD1-CE 3.63Å; F240-M311 HydrophobicContact CD2-CE 3.67Å; F240-M311 HydrophobicContact CD2-CG 4.03Å; F240-M311 HydrophobicContact CE1-CE 3.65Å; F240-M311 HydrophobicContact CE2-CE 3.7Å; F240-M311 HydrophobicContact CE2-CG 3.39Å; F240-M311 HydrophobicContact CE2-SD 4.41Å; F240-M311 HydrophobicContact CG-CE 3.64Å; F240-M311 HydrophobicContact CZ-CE 3.68Å; F240-M311 HydrophobicContact CZ-CG 3.75Å
241	K	89	Confident	86.5	Confident	74 Å²	74	58.5 Å²	58.5	32%	0.322	29%	0.287	S	S	.	.			trans	-138.6	125	178.2	68	-161.8	176.7	-160.5	0	109.7	Y233 L239 Y267 L269	Y233-K241 HydrophobicContact CD1-CD 4.06Å; L239-K241 PolarHBondContact O-N 3.25Å; K241-Y267 HydrophobicContact CB-CD1 4.05Å; K241-Y267 HydrophobicContact CD-CD1 4.48Å; K241-Y267 HydrophobicContact CD-CE1 4.39Å; K241-Y267 HydrophobicContact CG-CD1 4.12Å; K241-Y267 HydrophobicContact CG-CE1 4.28Å; K241-L269 HydrophobicContact CB-CD2 4.03Å
242	Y	90.4	Very high	86.8	Confident	13 Å²	13	52.5 Å²	52.5	5%	0.051	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.2	173.2	177.3	-109.1	0	0	0	109.9	A244 D248 Y267 L268 M307 Y310	Y242-A244 PolarHBondContact O-N 3.38Å; Y242-D248 WeakPolarHBondContact CE1-OD2 3.3Å; Y242-D248 PolarHBondContact OH-OD2 3.33Å; Y242-Y267 CarbonylContact O-C 3.55Å; Y242-Y267 WeakPolarHBondContact O-CA 3.45Å; Y242-L268 HydrophobicContact CD1-CB 4.41Å; Y242-L268 HydrophobicContact CD1-CD1 4.12Å; Y242-L268 HydrophobicContact CD1-CG 4.42Å; Y242-L268 PolarHBondContact N-O 3.39Å; Y242-L268 PolarHBondContact O-N 3.34Å; Y242-M307 HydrophobicContact CD1-CE 4.28Å; Y242-M307 HydrophobicContact CD1-CG 3.6Å; Y242-M307 HydrophobicContact CD1-SD 3.72Å; Y242-M307 HydrophobicContact CD2-CB 4.49Å; Y242-M307 HydrophobicContact CD2-CG 3.71Å; Y242-M307 HydrophobicContact CE1-CG 3.67Å; Y242-M307 HydrophobicContact CE1-SD 4.15Å; Y242-M307 HydrophobicContact CE2-CG 3.8Å; Y242-M307 HydrophobicContact CG-CE 4.03Å; Y242-M307 HydrophobicContact CG-CG 3.6Å; Y242-M307 HydrophobicContact CG-SD 3.99Å; Y242-Y310 AromaticContact CD2-CD1 3.62Å; Y242-Y310 HydrophobicContact CD2-CD1 3.62Å; Y242-Y310 HydrophobicContact CD2-CE1 4.1Å; Y242-Y310 AromaticContact CD2-CG 3.87Å; Y242-Y310 HydrophobicContact CD2-CG 3.87Å; Y242-Y310 HydrophobicContact CE2-CD1 4.29Å; Y242-Y310 HydrophobicContact CE2-CG 4.07Å
243	A	90	Very high	86.8	Confident	41 Å²	41	53.4 Å²	53.4	34%	0.339	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	109.8	175	0	0	0	0	0	109.4	D245 Y267	A243-D245 PolarHBondContact O-N 3.47Å; A243-Y267 HydrophobicContact CB-CD1 4.17Å; A243-Y267 HydrophobicContact CB-CE1 3.88Å
244	A	89.3	Confident	86.8	Confident	5 Å²	5	56.1 Å²	56.1	4%	0.041	29%	0.286	C	S	.	.			trans	-62.7	129.4	179.4	0	0	0	0	0	110.7	Y242 D248 K249 L252 A266	Y242-A244 PolarHBondContact O-N 3.38Å; A244-D248 HydrophobicContact CB-CB 3.79Å; A244-K249 HydrophobicContact CB-CG 4.26Å; A244-K249 WeakPolarHBondContact O-CE 3.4Å; A244-L252 HydrophobicContact CB-CD1 4.07Å; A244-A266 HydrophobicContact CB-CB 4.11Å; A244-A266 WeakPolarHBondContact CB-O 3.43Å; A244-A266 PolarHBondContact N-O 2.97Å
245	D	89.8	Confident	86.8	Confident	50 Å²	50	53.8 Å²	53.8	27%	0.267	27%	0.272	S	S	.	.			trans	-81.2	-179.6	178.7	77.8	23	0	0	0	111.7	A243 Q247 D248 K249 K306	A243-D245 PolarHBondContact O-N 3.47Å; D245-Q247 VanDerWaalsContact C-N 3.3Å; D245-Q247 PolarHBondContact O-N 3.42Å; D245-Q247 WeakPolarHBondContact OD1-CA 3.36Å; D245-Q247 VanDerWaalsContact OD1-CB 3.31Å; D245-Q247 WeakPolarHBondContact OD1-CB 3.4Å; D245-Q247 PolarHBondContact OD1-N 3.32Å; D245-D248 PolarHBondContact N-OD2 3.22Å; D245-D248 PolarHBondContact O-N 2.98Å; D245-D248 VanDerWaalsContact OD1-CG 3.28Å; D245-D248 PolarHBondContact OD1-N 3.16Å; D245-K249 WeakPolarHBondContact O-CB 3.42Å; D245-K249 VanDerWaalsContact O-CG 3.25Å; D245-K249 WeakPolarHBondContact O-CG 3.35Å; D245-K249 PolarHBondContact O-N 3.38Å; D245-K306 VanDerWaalsContact CG-NZ 3.33Å; D245-K306 IonicContact OD1-NZ 2.8Å; D245-K306 PolarHBondContact OD1-NZ 3.22Å; D245-K306 IonicContact OD2-NZ 3.06Å; D245-K306 PolarHBondContact OD2-NZ 3.09Å
246	P	88	Confident	86.7	Confident	115 Å²	115	56.3 Å²	56.3	75%	0.747	29%	0.285	S	S	*	.	H	α-helix	trans	-60.8	-33.7	178.9	-25.2	36.2	0	0	0	114.6	H250	P246-H250 PolarHBondContact O-N 3.02Å
247	Q	89.4	Confident	86.4	Confident	112 Å²	112	57.9 Å²	57.9	52%	0.523	29%	0.293	S	S	.	.	H	α-helix	trans	-73.3	-42.5	178.6	-178.4	-174.8	-6.9	0	0	110.4	D245 K249 H250 W251 W302	D245-Q247 VanDerWaalsContact C-N 3.3Å; D245-Q247 PolarHBondContact O-N 3.42Å; D245-Q247 WeakPolarHBondContact OD1-CA 3.36Å; D245-Q247 VanDerWaalsContact OD1-CB 3.31Å; D245-Q247 WeakPolarHBondContact OD1-CB 3.4Å; D245-Q247 PolarHBondContact OD1-N 3.32Å; Q247-K249 VanDerWaalsContact C-N 3.34Å; Q247-K249 PolarHBondContact O-N 3.1Å; Q247-H250 WeakPolarHBondContact O-CB 3.25Å; Q247-H250 PolarHBondContact O-N 3.49Å; Q247-W251 PolarHBondContact O-N 3.23Å; Q247-W251 VanDerWaalsContact O-N 3.16Å; Q247-W302 HydrophobicContact CG-CH2 4.09Å; Q247-W302 HydrophobicContact CG-CZ3 4.11Å
248	D	89.8	Confident	86	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.2	-44.4	175	-56.1	-33.4	0	0	0	111	Y242 A244 D245 H250 W251 L252 W302 M303 K306	Y242-D248 WeakPolarHBondContact CE1-OD2 3.3Å; Y242-D248 PolarHBondContact OH-OD2 3.33Å; A244-D248 HydrophobicContact CB-CB 3.79Å; D245-D248 PolarHBondContact N-OD2 3.22Å; D245-D248 PolarHBondContact O-N 2.98Å; D245-D248 VanDerWaalsContact OD1-CG 3.28Å; D245-D248 PolarHBondContact OD1-N 3.16Å; D248-H250 PolarHBondContact O-N 3.07Å; D248-W251 PolarHBondContact O-N 3.42Å; D248-L252 VanDerWaalsContact O-CB 3.32Å; D248-L252 WeakPolarHBondContact O-CB 3.46Å; D248-L252 WeakPolarHBondContact O-CD1 3.45Å; D248-L252 WeakPolarHBondContact O-CG 3.13Å; D248-L252 PolarHBondContact O-N 3.35Å; D248-W302 WeakPolarHBondContact OD1-CZ3 3.46Å; D248-M303 HydrophobicContact CB-CE 3.86Å; D248-M303 HydrophobicContact CB-SD 4.13Å; D248-M303 WeakPolarHBondContact OD1-CE 3.19Å; D248-K306 VanDerWaalsContact OD1-CE 3.27Å; D248-K306 WeakPolarHBondContact OD1-CE 3.41Å; D248-K306 IonicContact OD1-NZ 2.83Å; D248-K306 PolarHBondContact OD1-NZ 3.21Å; D248-K306 IonicContact OD2-NZ 3.42Å
249	K	88.6	Confident	85.4	Confident	34 Å²	34	63.5 Å²	63.5	15%	0.148	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-30.2	177.2	-72.9	176.8	-158.6	-173.3	0	113	A244 D245 Q247 A253 K264	A244-K249 HydrophobicContact CB-CG 4.26Å; A244-K249 WeakPolarHBondContact O-CE 3.4Å; D245-K249 WeakPolarHBondContact O-CB 3.42Å; D245-K249 VanDerWaalsContact O-CG 3.25Å; D245-K249 WeakPolarHBondContact O-CG 3.35Å; D245-K249 PolarHBondContact O-N 3.38Å; Q247-K249 VanDerWaalsContact C-N 3.34Å; Q247-K249 PolarHBondContact O-N 3.1Å; K249-A253 WeakPolarHBondContact O-CB 3.41Å; K249-A253 PolarHBondContact O-N 3.39Å; K249-K264 PolarHBondContact NZ-O 3.23Å
250	H	87.1	Confident	84.3	Confident	114 Å²	114	66.1 Å²	66.1	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-67.2	-54.7	174.5	-171.9	48.1	0	0	0	110.1	P246 Q247 D248 L252 A253 E254	P246-H250 PolarHBondContact O-N 3.02Å; Q247-H250 WeakPolarHBondContact O-CB 3.25Å; Q247-H250 PolarHBondContact O-N 3.49Å; D248-H250 PolarHBondContact O-N 3.07Å; H250-L252 VanDerWaalsContact C-N 3.35Å; H250-L252 PolarHBondContact O-N 3.31Å; H250-A253 WeakPolarHBondContact O-CA 3.49Å; H250-A253 WeakPolarHBondContact O-CB 3.46Å; H250-A253 PolarHBondContact O-N 3.1Å; H250-E254 IonicContact NE2-OE1 3.06Å; H250-E254 PolarHBondContact O-N 3.41Å
251	W	89.3	Confident	82.9	Confident	41 Å²	41	70.3 Å²	70.3	16%	0.155	36%	0.355	C	S	.	.	H	α-helix	trans	-58.7	-42	177	-177.7	82.6	0	0	0	112.8	Q247 D248 A253 E254 Q255 F297 L299 P300 W302 M303	Q247-W251 PolarHBondContact O-N 3.23Å; Q247-W251 VanDerWaalsContact O-N 3.16Å; D248-W251 PolarHBondContact O-N 3.42Å; W251-A253 PolarHBondContact O-N 3.29Å; W251-E254 PolarHBondContact O-N 2.96Å; W251-Q255 HydrophobicContact CD2-CG 3.93Å; W251-Q255 HydrophobicContact CE3-CG 4.26Å; W251-Q255 HydrophobicContact CH2-CG 3.85Å; W251-Q255 HydrophobicContact CZ2-CG 3.48Å; W251-Q255 VanDerWaalsContact CZ2-CG 3.48Å; W251-Q255 HydrophobicContact CZ3-CG 4.23Å; W251-Q255 WeakPolarHBondContact O-CG 3.43Å; W251-Q255 PolarHBondContact O-N 3.43Å; W251-F297 HydrophobicContact CH2-CD2 4.15Å; W251-F297 HydrophobicContact CZ3-CD2 4.05Å; W251-F297 AromaticContact CZ3-CE2 3.99Å; W251-F297 HydrophobicContact CZ3-CE2 3.99Å; W251-L299 HydrophobicContact CE3-CD2 4.44Å; W251-L299 HydrophobicContact CH2-CD2 4.09Å; W251-L299 HydrophobicContact CZ3-CD2 3.6Å; W251-P300 HydrophobicContact CD2-CG 4.27Å; W251-P300 HydrophobicContact CZ2-CG 4.11Å; W251-W302 HydrophobicContact CB-CH2 4.22Å; W251-W302 HydrophobicContact CB-CZ2 4.16Å; W251-W302 HydrophobicContact CG-CZ2 4.07Å; W251-M303 HydrophobicContact CB-CE 4.34Å; W251-M303 HydrophobicContact CD2-CE 4.07Å; W251-M303 HydrophobicContact CE3-CE 3.62Å; W251-M303 HydrophobicContact CG-CE 4.39Å; W251-M303 HydrophobicContact CZ3-CE 4.33Å
252	L	88.1	Confident	81.1	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-63.2	-23.8	175.5	-71.9	168	0	0	0	113.7	A244 D248 H250 H257 M258 L268 F297	A244-L252 HydrophobicContact CB-CD1 4.07Å; D248-L252 VanDerWaalsContact O-CB 3.32Å; D248-L252 WeakPolarHBondContact O-CB 3.46Å; D248-L252 WeakPolarHBondContact O-CD1 3.45Å; D248-L252 WeakPolarHBondContact O-CG 3.13Å; D248-L252 PolarHBondContact O-N 3.35Å; H250-L252 VanDerWaalsContact C-N 3.35Å; H250-L252 PolarHBondContact O-N 3.31Å; L252-H257 HydrophobicContact CD2-CB 4.36Å; L252-H257 PolarHBondContact O-N 3.24Å; L252-H257 VanDerWaalsContact O-N 3.1Å; L252-M258 HydrophobicContact CB-CG 4.14Å; L252-M258 HydrophobicContact CB-SD 4.02Å; L252-M258 HydrophobicContact CD1-SD 4.2Å; L252-M258 PolarHBondContact O-N 2.92Å; L252-L268 HydrophobicContact CD1-CD2 4.1Å; L252-L268 HydrophobicContact CD2-CD2 4.24Å; L252-F297 HydrophobicContact CD2-CE2 3.46Å; L252-F297 VanDerWaalsContact CD2-CE2 3.46Å; L252-F297 HydrophobicContact CD2-CZ 3.49Å; L252-F297 VanDerWaalsContact CD2-CZ 3.49Å
253	A	85.6	Confident	79.7	Confident	19 Å²	19	73.1 Å²	73.1	16%	0.157	41%	0.408	C	S	.	.	H	α-helix	trans	-83.3	-39.3	173.9	0	0	0	0	0	111.7	K249 H250 W251 H256	K249-A253 WeakPolarHBondContact O-CB 3.41Å; K249-A253 PolarHBondContact O-N 3.39Å; H250-A253 WeakPolarHBondContact O-CA 3.49Å; H250-A253 WeakPolarHBondContact O-CB 3.46Å; H250-A253 PolarHBondContact O-N 3.1Å; W251-A253 PolarHBondContact O-N 3.29Å; A253-H256 WeakPolarHBondContact O-CA 3.47Å; A253-H256 PolarHBondContact O-N 3.19Å; A253-H256 PolarHBondContact O-ND1 3.39Å
254	E	86.4	Confident	78.7	Confident	106 Å²	106	77.6 Å²	77.6	50%	0.495	42%	0.42	S	S	.	.	H	α-helix	trans	-59.4	-46.7	173	-66.2	178.8	143.2	0	0	111.6	H250 W251 H256	H250-E254 IonicContact NE2-OE1 3.06Å; H250-E254 PolarHBondContact O-N 3.41Å; W251-E254 PolarHBondContact O-N 2.96Å; E254-H256 PolarHBondContact O-N 2.94Å
255	Q	82.9	Confident	78.2	Confident	94 Å²	94	84.1 Å²	84.1	44%	0.439	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	8.7	175.1	-57.6	-51.5	-54.5	0	0	113.8	W251 H257	W251-Q255 HydrophobicContact CD2-CG 3.93Å; W251-Q255 HydrophobicContact CE3-CG 4.26Å; W251-Q255 HydrophobicContact CH2-CG 3.85Å; W251-Q255 HydrophobicContact CZ2-CG 3.48Å; W251-Q255 VanDerWaalsContact CZ2-CG 3.48Å; W251-Q255 HydrophobicContact CZ3-CG 4.23Å; W251-Q255 WeakPolarHBondContact O-CG 3.43Å; W251-Q255 PolarHBondContact O-N 3.43Å; Q255-H257 PolarHBondContact O-N 2.93Å; Q255-H257 PolarHBondContact O-ND1 3.47Å
256	H	79.9	Confident	78	Confident	161 Å²	161	82.1 Å²	82.1	75%	0.745	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	16.2	-179.5	-61.3	-35.5	0	0	0	115.9	A253 E254 M258	A253-H256 WeakPolarHBondContact O-CA 3.47Å; A253-H256 PolarHBondContact O-N 3.19Å; A253-H256 PolarHBondContact O-ND1 3.39Å; E254-H256 PolarHBondContact O-N 2.94Å; H256-M258 VanDerWaalsContact C-N 3.27Å; H256-M258 PolarHBondContact O-N 3.28Å
257	H	78.2	Confident	78.1	Confident	57 Å²	57	79.9 Å²	79.9	26%	0.264	42%	0.419	S	S	.	.	S	Bend	trans	-68.9	-29.6	171.8	-59.7	-35.9	0	0	0	111.3	L252 Q255 F297	L252-H257 HydrophobicContact CD2-CB 4.36Å; L252-H257 PolarHBondContact O-N 3.24Å; L252-H257 VanDerWaalsContact O-N 3.1Å; Q255-H257 PolarHBondContact O-N 2.93Å; Q255-H257 PolarHBondContact O-ND1 3.47Å; H257-F297 HydrophobicContact CB-CE1 4.3Å; H257-F297 AromaticContact CD2-CD1 3.69Å; H257-F297 AromaticContact CD2-CD2 3.55Å; H257-F297 AromaticContact CD2-CE1 3.91Å; H257-F297 AromaticContact CD2-CE2 3.75Å; H257-F297 AromaticContact CD2-CG 3.52Å; H257-F297 AromaticContact CD2-CZ 3.94Å; H257-F297 AromaticContact CE1-CD1 3.89Å; H257-F297 AromaticContact CE1-CG 3.78Å; H257-F297 AromaticContact CG-CD1 3.89Å; H257-F297 AromaticContact CG-CE1 3.97Å; H257-F297 AromaticContact ND1-CD1 4Å; H257-F297 VanDerWaalsContact NE2-CB 3.32Å; H257-F297 WeakPolarHBondContact NE2-CB 3.45Å; H257-F297 AromaticContact NE2-CD1 3.7Å; H257-F297 AromaticContact NE2-CD2 3.57Å; H257-F297 AromaticContact NE2-CG 3.24Å; H257-F297 WeakPolarHBondContact NE2-CG 3.26Å
258	M	73.5	Confident	78.1	Confident	31 Å²	31	74.6 Å²	74.6	15%	0.153	39%	0.394	C	S	.	.			trans	-112.7	129.4	171.3	-68.6	-173.9	58.7	0	0	111.9	L215 L252 H256 A266	L215-M258 HydrophobicContact CD2-CG 3.98Å; L252-M258 HydrophobicContact CB-CG 4.14Å; L252-M258 HydrophobicContact CB-SD 4.02Å; L252-M258 HydrophobicContact CD1-SD 4.2Å; L252-M258 PolarHBondContact O-N 2.92Å; H256-M258 VanDerWaalsContact C-N 3.27Å; H256-M258 PolarHBondContact O-N 3.28Å; M258-A266 HydrophobicContact CE-CB 4.22Å; M258-A266 HydrophobicContact SD-CB 3.89Å
259	R	66.8	Low	78.1	Confident	251 Å²	251	74.6 Å²	74.6	95%	0.947	39%	0.394	S	S	*	.	S	Bend	trans	-84.5	-9.1	176.5	-73.7	-174	175.1	-178.9	-3.4	114.9
260	A	61.8	Low	78.2	Confident	70 Å²	70	73 Å²	73	58%	0.579	39%	0.387	S	S	*	.			trans	-156.2	123	-178.3	0	0	0	0	0	111	G262	A260-G262 PolarHBondContact O-N 3.44Å
261	T	56.6	Low	78.3	Confident	89 Å²	89	68 Å²	68	55%	0.546	36%	0.364	S	S	.	.			trans	-79.6	10.9	-176.5	-35.9	0	0	0	0	113.3
262	G	51	Low	78.2	Confident	57 Å²	57	71.1 Å²	71.1	59%	0.588	38%	0.381	S	S	*	.	S	Bend	trans	-94.9	112	-167	0	0	0	0	0	116.1	A260 K264	A260-G262 PolarHBondContact O-N 3.44Å; G262-K264 PolarHBondContact O-N 2.86Å
263	G	61.2	Low	78.1	Confident	88 Å²	88	71.2 Å²	71.2	91%	0.907	38%	0.381	S	S	*	.	S	Bend	trans	68.3	-13.7	148.2	0	0	0	0	0	119.6
264	K	69.5	Low	78.2	Confident	135 Å²	135	70.3 Å²	70.3	59%	0.587	37%	0.374	S	S	*	.			trans	-93.3	149.5	179.5	-72.1	164.7	-174.9	150.6	0	111.4	K249 G262	K249-K264 PolarHBondContact NZ-O 3.23Å; G262-K264 PolarHBondContact O-N 2.86Å
265	M	78.3	Confident	78.1	Confident	142 Å²	142	70.9 Å²	70.9	70%	0.7	37%	0.371	S	S	*	.			trans	-72	128.8	168.9	-65.8	-54.2	-172.2	0	0	109.3	Y267	M265-Y267 HydrophobicContact CB-CE2 4.19Å
266	A	85.8	Confident	78.1	Confident	8 Å²	8	70.2 Å²	70.2	7%	0.066	37%	0.371	C	S	.	.			trans	-105.4	127.8	172	0	0	0	0	0	107	L215 A244 M258	L215-A266 HydrophobicContact CD1-CB 4Å; A244-A266 HydrophobicContact CB-CB 4.11Å; A244-A266 WeakPolarHBondContact CB-O 3.43Å; A244-A266 PolarHBondContact N-O 2.97Å; M258-A266 HydrophobicContact CE-CB 4.22Å; M258-A266 HydrophobicContact SD-CB 3.89Å
267	Y	89.8	Confident	78.3	Confident	69 Å²	69	63.9 Å²	63.9	27%	0.271	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.2	173.5	-70	-80.7	0	0	0	109.2	G216 Y233 K241 Y242 A243 M265	G216-Y267 PolarHBondContact N-O 3.34Å; Y233-Y267 HydrophobicContact CE1-CD2 4.37Å; Y233-Y267 HydrophobicContact CE1-CG 4.35Å; Y233-Y267 AromaticContact CE2-CD2 3.87Å; Y233-Y267 HydrophobicContact CE2-CD2 3.87Å; Y233-Y267 HydrophobicContact CE2-CE2 4.22Å; Y233-Y267 AromaticContact CZ-CD2 3.67Å; K241-Y267 HydrophobicContact CB-CD1 4.05Å; K241-Y267 HydrophobicContact CD-CD1 4.48Å; K241-Y267 HydrophobicContact CD-CE1 4.39Å; K241-Y267 HydrophobicContact CG-CD1 4.12Å; K241-Y267 HydrophobicContact CG-CE1 4.28Å; Y242-Y267 CarbonylContact O-C 3.55Å; Y242-Y267 WeakPolarHBondContact O-CA 3.45Å; A243-Y267 HydrophobicContact CB-CD1 4.17Å; A243-Y267 HydrophobicContact CB-CE1 3.88Å; M265-Y267 HydrophobicContact CB-CE2 4.19Å
268	L	90.3	Very high	78.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	139.8	167.8	-56.5	-177.7	0	0	0	108.9	L215 Y242 L252 F297 L299 M303 M307	L215-L268 HydrophobicContact CD1-CD2 4.13Å; Y242-L268 HydrophobicContact CD1-CB 4.41Å; Y242-L268 HydrophobicContact CD1-CD1 4.12Å; Y242-L268 HydrophobicContact CD1-CG 4.42Å; Y242-L268 PolarHBondContact N-O 3.39Å; Y242-L268 PolarHBondContact O-N 3.34Å; L252-L268 HydrophobicContact CD1-CD2 4.1Å; L252-L268 HydrophobicContact CD2-CD2 4.24Å; L268-F297 HydrophobicContact CD2-CZ 3.97Å; L268-L299 HydrophobicContact CD1-CD1 3.86Å; L268-L299 HydrophobicContact CD1-CD2 4.17Å; L268-M303 HydrophobicContact CD1-SD 3.91Å; L268-M307 HydrophobicContact CD1-SD 4.27Å
269	L	90.6	Very high	78.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.4	-179.2	-59.7	156.9	0	0	0	107.7	F213 V214 A219 I232 Y233 L239 F240 K241 I274	F213-L269 CarbonylContact C-O 3.5Å; F213-L269 WeakPolarHBondContact CA-O 3.49Å; V214-L269 HydrophobicContact CG2-CB 4.01Å; V214-L269 PolarHBondContact N-O 3.15Å; V214-L269 PolarHBondContact O-N 3.09Å; A219-L269 HydrophobicContact CB-CD1 3.52Å; I232-L269 HydrophobicContact CD1-CD1 4.23Å; Y233-L269 HydrophobicContact CE1-CD1 4.46Å; Y233-L269 HydrophobicContact CE1-CD2 4.25Å; L239-L269 HydrophobicContact CD1-CD2 4.47Å; L239-L269 HydrophobicContact CD2-CD2 3.78Å; L239-L269 HydrophobicContact CG-CD2 3.87Å; F240-L269 VanDerWaalsContact O-CD2 3.26Å; F240-L269 WeakPolarHBondContact O-CD2 3.29Å; K241-L269 HydrophobicContact CB-CD2 4.03Å; L269-I274 HydrophobicContact CB-CD1 4.19Å; L269-I274 HydrophobicContact CB-CG1 4.17Å; L269-I274 HydrophobicContact CD1-CD1 4.06Å
270	I	90.1	Very high	79.3	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	130.9	176.1	-61.1	166.7	0	0	0	108.2	L207 T211 F213 F240 E272 D273 I274 M311	L207-I270 HydrophobicContact CD2-CD1 3.86Å; L207-I270 HydrophobicContact CD2-CG1 4.24Å; T211-I270 HydrophobicContact CG2-CG2 4.19Å; F213-I270 HydrophobicContact CD1-CG1 4.27Å; F213-I270 HydrophobicContact CE1-CG1 3.89Å; F240-I270 HydrophobicContact CD1-CD1 3.95Å; F240-I270 HydrophobicContact CD1-CG1 4.17Å; I270-E272 VanDerWaalsContact C-N 3.34Å; I270-E272 HydrophobicContact CG2-CB 3.96Å; I270-E272 PolarHBondContact O-N 3.01Å; I270-D273 HydrophobicContact CB-CB 4.44Å; I270-D273 PolarHBondContact O-N 2.92Å; I270-I274 WeakPolarHBondContact O-CG1 3.44Å; I270-I274 PolarHBondContact O-N 2.81Å; I270-M311 HydrophobicContact CD1-CE 3.77Å
271	E	88.5	Confident	79.5	Confident	9 Å²	9	56.8 Å²	56.8	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-62.3	-41.3	-176.9	-172.2	-172.8	-145.2	0	0	112.3	T212 V214 D273 I274 R275 S296	T212-E271 WeakPolarHBondContact CB-OE2 3.47Å; T212-E271 WeakPolarHBondContact O-CB 3.46Å; T212-E271 PolarHBondContact O-N 2.97Å; T212-E271 WeakPolarHBondContact OG1-CB 3.39Å; T212-E271 PolarHBondContact OG1-OE2 3.45Å; V214-E271 HydrophobicContact CG1-CB 4.15Å; V214-E271 HydrophobicContact CG1-CG 4.03Å; E271-D273 PolarHBondContact O-N 3.36Å; E271-I274 PolarHBondContact O-N 2.9Å; E271-R275 PolarHBondContact O-N 2.9Å; E271-R275 IonicContact OE1-CZ 3.45Å; E271-R275 IonicContact OE1-NH1 3.76Å; E271-R275 IonicContact OE1-NH2 2.81Å; E271-R275 PolarHBondContact OE1-NH2 2.89Å; E271-R275 IonicContact OE2-CZ 3.21Å; E271-R275 IonicContact OE2-NH1 2.74Å; E271-R275 PolarHBondContact OE2-NH1 3.22Å; E271-R275 IonicContact OE2-NH2 2.97Å; E271-R275 PolarHBondContact OE2-NH2 2.94Å; E271-S296 VanDerWaalsContact CD-OG 3.26Å; E271-S296 WeakPolarHBondContact OE1-CB 3.23Å; E271-S296 PolarHBondContact OE1-OG 3.41Å
272	E	87.2	Confident	80.1	Confident	106 Å²	106	56.9 Å²	56.9	50%	0.495	33%	0.327	S	S	.	.	H	α-helix	trans	-52.4	-49.9	175.1	-175.2	-179.2	-132.2	0	0	111.8	R206 I270 I274 R275 D276	R206-E272 IonicContact CZ-OE2 3.82Å; R206-E272 IonicContact NE-OE2 2.79Å; R206-E272 IonicContact NH2-OE2 3.94Å; R206-E272 PolarHBondContact NH2-OE2 2.86Å; I270-E272 VanDerWaalsContact C-N 3.34Å; I270-E272 HydrophobicContact CG2-CB 3.96Å; I270-E272 PolarHBondContact O-N 3.01Å; E272-I274 PolarHBondContact O-N 3.19Å; E272-R275 WeakPolarHBondContact O-CB 3.3Å; E272-R275 PolarHBondContact O-N 3Å; E272-R275 VanDerWaalsContact O-N 3.07Å; E272-D276 PolarHBondContact O-N 3.32Å
273	D	86.6	Confident	81	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.011	30%	0.301	C	S	.	.	H	α-helix	trans	-63.1	-29.9	178.4	-71.9	-24.9	0	0	0	113	K201 R206 L239 I270 E271 L277	K201-D273 IonicContact NZ-OD1 2.74Å; K201-D273 PolarHBondContact NZ-OD1 3.26Å; R206-D273 IonicContact CZ-OD1 3.94Å; R206-D273 IonicContact CZ-OD2 2.66Å; R206-D273 VanDerWaalsContact NH1-CG 3.25Å; R206-D273 IonicContact NH1-OD1 2.68Å; R206-D273 PolarHBondContact NH1-OD1 3.19Å; R206-D273 IonicContact NH1-OD2 2.65Å; R206-D273 PolarHBondContact NH1-OD2 3.3Å; R206-D273 IonicContact NH2-OD1 3.71Å; R206-D273 PolarHBondContact NH2-OD1 3.34Å; R206-D273 IonicContact NH2-OD2 2.75Å; L239-D273 HydrophobicContact CD1-CB 3.71Å; I270-D273 HydrophobicContact CB-CB 4.44Å; I270-D273 PolarHBondContact O-N 2.92Å; E271-D273 PolarHBondContact O-N 3.36Å; D273-L277 WeakPolarHBondContact O-CB 3.41Å; D273-L277 WeakPolarHBondContact O-CG 3.46Å; D273-L277 PolarHBondContact O-N 2.99Å
274	I	86.6	Confident	80.9	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-76.3	-33.2	175.7	-57.5	-55.5	0	0	0	111.6	V214 A219 L223 I232 L239 L269 I270 E271 E272 L277 A278 L294	V214-I274 HydrophobicContact CG2-CB 4.49Å; V214-I274 HydrophobicContact CG2-CG1 3.79Å; A219-I274 HydrophobicContact CB-CD1 4.1Å; A219-I274 HydrophobicContact CB-CG1 4.2Å; A219-I274 HydrophobicContact CB-CG2 4.28Å; L223-I274 HydrophobicContact CD1-CG2 4.34Å; L223-I274 HydrophobicContact CD2-CG2 4.37Å; L223-I274 HydrophobicContact CG-CG2 4.34Å; I232-I274 HydrophobicContact CD1-CD1 3.69Å; L239-I274 HydrophobicContact CD1-CD1 4.23Å; L239-I274 HydrophobicContact CD2-CD1 3.91Å; L269-I274 HydrophobicContact CB-CD1 4.19Å; L269-I274 HydrophobicContact CB-CG1 4.17Å; L269-I274 HydrophobicContact CD1-CD1 4.06Å; I270-I274 WeakPolarHBondContact O-CG1 3.44Å; I270-I274 PolarHBondContact O-N 2.81Å; E271-I274 PolarHBondContact O-N 2.9Å; E272-I274 PolarHBondContact O-N 3.19Å; I274-L277 HydrophobicContact CD1-CD1 4.29Å; I274-A278 WeakPolarHBondContact O-CB 3.41Å; I274-A278 PolarHBondContact O-N 3.4Å; I274-L294 HydrophobicContact CG2-CD1 4Å; I274-L294 HydrophobicContact CG2-CD2 3.88Å
275	R	84.5	Confident	80.3	Confident	118 Å²	118	56.5 Å²	56.5	45%	0.445	30%	0.299	S	S	.	.	H	α-helix	trans	-67.4	-45.5	171.4	-70.1	-170.6	179.2	106.2	2.4	111.3	E271 E272 L277 A278 A279	E271-R275 PolarHBondContact O-N 2.9Å; E271-R275 IonicContact OE1-CZ 3.45Å; E271-R275 IonicContact OE1-NH1 3.76Å; E271-R275 IonicContact OE1-NH2 2.81Å; E271-R275 PolarHBondContact OE1-NH2 2.89Å; E271-R275 IonicContact OE2-CZ 3.21Å; E271-R275 IonicContact OE2-NH1 2.74Å; E271-R275 PolarHBondContact OE2-NH1 3.22Å; E271-R275 IonicContact OE2-NH2 2.97Å; E271-R275 PolarHBondContact OE2-NH2 2.94Å; E272-R275 WeakPolarHBondContact O-CB 3.3Å; E272-R275 PolarHBondContact O-N 3Å; E272-R275 VanDerWaalsContact O-N 3.07Å; R275-L277 VanDerWaalsContact C-N 3.31Å; R275-L277 PolarHBondContact O-N 3.29Å; R275-A278 WeakPolarHBondContact O-CB 3.47Å; R275-A278 PolarHBondContact O-N 3.01Å; R275-A278 VanDerWaalsContact O-N 3.14Å; R275-A279 PolarHBondContact O-N 3.17Å
276	D	84.3	Confident	79.4	Confident	80 Å²	80	52.6 Å²	52.6	43%	0.428	29%	0.285	S	S	.	.	H	α-helix	trans	-56.5	-45.5	173.6	-76.9	1.7	0	0	0	111.5	K201 E272 A278 A279 S280	K201-D276 IonicContact NZ-OD2 3.26Å; K201-D276 PolarHBondContact NZ-OD2 3.35Å; E272-D276 PolarHBondContact O-N 3.32Å; D276-A278 VanDerWaalsContact C-N 3.35Å; D276-A278 PolarHBondContact O-N 3.41Å; D276-A279 PolarHBondContact O-N 2.93Å; D276-A279 VanDerWaalsContact O-N 3.16Å; D276-S280 PolarHBondContact O-N 3.45Å; D276-S280 VanDerWaalsContact O-N 3.14Å
277	L	84.1	Confident	78.1	Confident	28 Å²	28	60.6 Å²	60.6	15%	0.147	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-36.7	176.6	-78.1	174	0	0	0	112.6	H236 L239 D273 I274 R275 A279 S280 Y283	H236-L277 HydrophobicContact CB-CD1 4.31Å; H236-L277 WeakPolarHBondContact ND1-CD2 3.43Å; L239-L277 HydrophobicContact CD1-CD1 3.86Å; L239-L277 HydrophobicContact CD2-CD1 3.77Å; L239-L277 HydrophobicContact CG-CD1 4.29Å; D273-L277 WeakPolarHBondContact O-CB 3.41Å; D273-L277 WeakPolarHBondContact O-CG 3.46Å; D273-L277 PolarHBondContact O-N 2.99Å; I274-L277 HydrophobicContact CD1-CD1 4.29Å; R275-L277 VanDerWaalsContact C-N 3.31Å; R275-L277 PolarHBondContact O-N 3.29Å; L277-A279 VanDerWaalsContact C-N 3.26Å; L277-A279 PolarHBondContact O-N 3.39Å; L277-S280 PolarHBondContact O-N 3.45Å; L277-S280 PolarHBondContact O-OG 3.38Å; L277-S280 VanDerWaalsContact O-OG 3.1Å; L277-Y283 WeakPolarHBondContact O-CD2 3.42Å
278	A	82.7	Confident	76.8	Confident	9 Å²	9	62.3 Å²	62.3	7%	0.074	34%	0.34	C	S	.	.	H	α-helix	trans	-68.2	-26.8	173.7	0	0	0	0	0	113.1	L223 I274 R275 D276 L289 L291	L223-A278 HydrophobicContact CD2-CB 3.81Å; I274-A278 WeakPolarHBondContact O-CB 3.41Å; I274-A278 PolarHBondContact O-N 3.4Å; R275-A278 WeakPolarHBondContact O-CB 3.47Å; R275-A278 PolarHBondContact O-N 3.01Å; R275-A278 VanDerWaalsContact O-N 3.14Å; D276-A278 VanDerWaalsContact C-N 3.35Å; D276-A278 PolarHBondContact O-N 3.41Å; A278-L289 HydrophobicContact CB-CD2 4.02Å; A278-L291 HydrophobicContact CB-CD1 3.96Å; A278-L291 HydrophobicContact CB-CD2 3.99Å; A278-L291 HydrophobicContact CB-CG 4.26Å
279	A	78.3	Confident	75.9	Confident	67 Å²	67	64.6 Å²	64.6	55%	0.554	35%	0.351	S	S	*	.	H	α-helix	trans	-83.5	-13.7	177.7	0	0	0	0	0	113.8	R275 D276 L277	R275-A279 PolarHBondContact O-N 3.17Å; D276-A279 PolarHBondContact O-N 2.93Å; D276-A279 VanDerWaalsContact O-N 3.16Å; L277-A279 VanDerWaalsContact C-N 3.26Å; L277-A279 PolarHBondContact O-N 3.39Å
280	S	78.4	Confident	75.2	Confident	39 Å²	39	69.3 Å²	69.3	27%	0.273	37%	0.372	S	S	.	.	S	Bend	trans	-75.6	154.7	179.8	83.4	0	0	0	0	112.7	D276 L277 D282 Y283 R284	D276-S280 PolarHBondContact O-N 3.45Å; D276-S280 VanDerWaalsContact O-N 3.14Å; L277-S280 PolarHBondContact O-N 3.45Å; L277-S280 PolarHBondContact O-OG 3.38Å; L277-S280 VanDerWaalsContact O-OG 3.1Å; S280-D282 PolarHBondContact O-N 2.87Å; S280-Y283 PolarHBondContact O-N 3.44Å; S280-R284 WeakPolarHBondContact O-CB 3.4Å; S280-R284 PolarHBondContact O-N 3.13Å
281	D	65.1	Low	74.5	Confident	144 Å²	144	72.4 Å²	72.4	77%	0.77	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-18.2	-176.2	-68	-31.9	0	0	0	114.4	Y283 R284	D281-Y283 PolarHBondContact O-N 3.47Å; D281-R284 WeakPolarHBondContact OD1-CD 3.38Å
282	D	68.5	Low	73.9	Confident	92 Å²	92	81.3 Å²	81.3	49%	0.492	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-24.4	171.7	-93.5	-59.2	0	0	0	113.6	K235 S280	K235-D282 IonicContact NZ-OD1 2.69Å; K235-D282 PolarHBondContact NZ-OD1 3.2Å; S280-D282 PolarHBondContact O-N 2.87Å
283	Y	71.3	Confident	73.3	Confident	12 Å²	12	78.5 Å²	78.5	5%	0.047	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-16.7	-175.7	-62.3	-85.6	0	0	0	113.2	L223 M225 H236 L277 S280 D281 G285 C286 L289	L223-Y283 HydrophobicContact CB-CD1 4.29Å; L223-Y283 HydrophobicContact CB-CE1 4.04Å; L223-Y283 HydrophobicContact CD2-CD1 4.49Å; M225-Y283 HydrophobicContact CE-CE1 3.86Å; M225-Y283 WeakPolarHBondContact CE-OH 3Å; M225-Y283 HydrophobicContact SD-CE1 4.3Å; M225-Y283 PolarHBondContact SD-OH 2.91Å; H236-Y283 AromaticContact CE1-CE2 3.81Å; H236-Y283 AromaticContact NE2-CE2 3.25Å; H236-Y283 WeakPolarHBondContact NE2-CE2 3.41Å; H236-Y283 AromaticContact NE2-CZ 3.47Å; H236-Y283 PolarHBondContact NE2-OH 3.46Å; L277-Y283 WeakPolarHBondContact O-CD2 3.42Å; S280-Y283 PolarHBondContact O-N 3.44Å; D281-Y283 PolarHBondContact O-N 3.47Å; Y283-G285 PolarHBondContact O-N 3.48Å; Y283-C286 PolarHBondContact O-N 2.94Å; Y283-L289 VanDerWaalsContact O-CD1 3.23Å; Y283-L289 WeakPolarHBondContact O-CD1 3.43Å
284	R	59.3	Low	72.8	Confident	187 Å²	187	79 Å²	79	71%	0.706	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	87	-178.1	-161.4	172.7	-167	-83.4	-2.4	111.9	S280 D281	S280-R284 WeakPolarHBondContact O-CB 3.4Å; S280-R284 PolarHBondContact O-N 3.13Å; D281-R284 WeakPolarHBondContact OD1-CD 3.38Å
285	G	55.5	Low	72.6	Confident	72 Å²	72	85.6 Å²	85.6	74%	0.742	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	131	-5.9	-176.3	0	0	0	0	0	114.9	Y283 L287	Y283-G285 PolarHBondContact O-N 3.48Å; G285-L287 PolarHBondContact O-N 3.49Å
286	C	59.2	Low	72.8	Confident	61 Å²	61	82.1 Å²	82.1	41%	0.412	44%	0.442	S	S	.	.			trans	-70.3	110.6	172.6	-79	0	0	0	0	111.4	Y283 D288 L289	Y283-C286 PolarHBondContact O-N 2.94Å; C286-D288 PolarHBondContact O-N 3.35Å; C286-D288 VanDerWaalsContact O-N 3.11Å; C286-L289 HydrophobicContact CB-CD1 4.29Å; C286-L289 HydrophobicContact CB-CG 4.03Å; C286-L289 WeakPolarHBondContact O-CB 3.25Å; C286-L289 WeakPolarHBondContact O-CG 3.17Å; C286-L289 PolarHBondContact O-N 2.94Å
287	L	58.9	Low	73	Confident	175 Å²	175	79.1 Å²	79.1	92%	0.916	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.6	173.8	-63.4	174.7	0	0	0	113.8	G285 L289	G285-L287 PolarHBondContact O-N 3.49Å; L287-L289 VanDerWaalsContact C-N 3.32Å
288	D	62.4	Low	73.2	Confident	106 Å²	106	81.2 Å²	81.2	57%	0.567	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	4.6	174.6	-73.5	-48.4	0	0	0	114.3	C286 K290	C286-D288 PolarHBondContact O-N 3.35Å; C286-D288 VanDerWaalsContact O-N 3.11Å; D288-K290 PolarHBondContact O-N 3.2Å; D288-K290 VanDerWaalsContact O-N 3.15Å
289	L	72.3	Confident	73.5	Confident	47 Å²	47	81.1 Å²	81.1	25%	0.246	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-67.8	108.5	173.8	-82.9	170	0	0	0	110.9	A222 L223 A278 Y283 C286 L287 L291	A222-L289 CarbonylContact O-C 3.58Å; A222-L289 WeakPolarHBondContact O-CA 3.38Å; L223-L289 HydrophobicContact CD2-CD2 3.91Å; A278-L289 HydrophobicContact CB-CD2 4.02Å; Y283-L289 VanDerWaalsContact O-CD1 3.23Å; Y283-L289 WeakPolarHBondContact O-CD1 3.43Å; C286-L289 HydrophobicContact CB-CD1 4.29Å; C286-L289 HydrophobicContact CB-CG 4.03Å; C286-L289 WeakPolarHBondContact O-CB 3.25Å; C286-L289 WeakPolarHBondContact O-CG 3.17Å; C286-L289 PolarHBondContact O-N 2.94Å; L287-L289 VanDerWaalsContact C-N 3.32Å; L289-L291 HydrophobicContact CB-CD1 3.98Å; L289-L291 HydrophobicContact CD2-CD1 3.93Å; L289-L291 HydrophobicContact CG-CD1 4.46Å
290	K	74.9	Confident	74	Confident	99 Å²	99	79.3 Å²	79.3	43%	0.43	42%	0.419	S	S	.	.			trans	-118	68.7	-179.9	-63.8	-174.1	-176.3	-173.4	0	110.4	A222 D288 E292 E293	A222-K290 VanDerWaalsContact CB-O 3.29Å; A222-K290 WeakPolarHBondContact CB-O 3.28Å; A222-K290 PolarHBondContact O-N 3.49Å; D288-K290 PolarHBondContact O-N 3.2Å; D288-K290 VanDerWaalsContact O-N 3.15Å; K290-E292 PolarHBondContact O-N 3.39Å; K290-E293 HydrophobicContact CB-CB 4.22Å; K290-E293 HydrophobicContact CB-CG 4.06Å; K290-E293 WeakPolarHBondContact O-CB 3.38Å; K290-E293 PolarHBondContact O-N 3.49Å
291	L	76	Confident	74.3	Confident	68 Å²	68	80.4 Å²	80.4	36%	0.356	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-62.2	-28.1	177.1	-76.4	73.3	0	0	0	111.6	A278 L289 E293 L294	A278-L291 HydrophobicContact CB-CD1 3.96Å; A278-L291 HydrophobicContact CB-CD2 3.99Å; A278-L291 HydrophobicContact CB-CG 4.26Å; L289-L291 HydrophobicContact CB-CD1 3.98Å; L289-L291 HydrophobicContact CD2-CD1 3.93Å; L289-L291 HydrophobicContact CG-CD1 4.46Å; L291-E293 PolarHBondContact O-N 3.19Å; L291-L294 HydrophobicContact CB-CD1 4.08Å; L291-L294 HydrophobicContact CG-CD1 4.03Å; L291-L294 WeakPolarHBondContact O-CB 3.46Å; L291-L294 WeakPolarHBondContact O-CG 3.2Å; L291-L294 PolarHBondContact O-N 3.32Å
292	E	75.1	Confident	75.5	Confident	195 Å²	195	77.4 Å²	77.4	91%	0.911	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-60.2	-23.9	171.4	-62.6	166.3	-167.7	0	0	113.4	K290 L294	K290-E292 PolarHBondContact O-N 3.39Å; E292-L294 VanDerWaalsContact C-N 3.32Å
293	E	76.3	Confident	76.4	Confident	47 Å²	47	73 Å²	73	22%	0.22	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-83.9	-5	173.5	-71.6	-157.1	-141.9	0	0	113.8	K221 K290 L291 K295	K221-E293 VanDerWaalsContact CD-OE2 3.29Å; K221-E293 WeakPolarHBondContact CD-OE2 3.37Å; K221-E293 WeakPolarHBondContact CE-OE2 3.38Å; K221-E293 IonicContact NZ-OE1 2.95Å; K221-E293 PolarHBondContact NZ-OE1 2.85Å; K221-E293 IonicContact NZ-OE2 3.56Å; K221-E293 PolarHBondContact NZ-OE2 3.09Å; K290-E293 HydrophobicContact CB-CB 4.22Å; K290-E293 HydrophobicContact CB-CG 4.06Å; K290-E293 WeakPolarHBondContact O-CB 3.38Å; K290-E293 PolarHBondContact O-N 3.49Å; L291-E293 PolarHBondContact O-N 3.19Å; E293-K295 PolarHBondContact O-N 3.11Å
294	L	76	Confident	77.2	Confident	14 Å²	14	72.7 Å²	72.7	7%	0.073	38%	0.381	C	S	.	.			trans	-70.1	79.4	165.6	-61.1	167.6	0	0	0	108.2	V214 A219 A222 I274 L291 E292 S296	V214-L294 HydrophobicContact CB-CD2 4.42Å; V214-L294 HydrophobicContact CG1-CB 4.16Å; V214-L294 HydrophobicContact CG1-CD2 4.18Å; V214-L294 HydrophobicContact CG2-CD2 4.4Å; A219-L294 HydrophobicContact CB-CD2 4.47Å; A222-L294 HydrophobicContact CB-CD1 4.37Å; A222-L294 HydrophobicContact CB-CD2 3.45Å; A222-L294 VanDerWaalsContact CB-CD2 3.45Å; A222-L294 HydrophobicContact CB-CG 3.62Å; I274-L294 HydrophobicContact CG2-CD1 4Å; I274-L294 HydrophobicContact CG2-CD2 3.88Å; L291-L294 HydrophobicContact CB-CD1 4.08Å; L291-L294 HydrophobicContact CG-CD1 4.03Å; L291-L294 WeakPolarHBondContact O-CB 3.46Å; L291-L294 WeakPolarHBondContact O-CG 3.2Å; L291-L294 PolarHBondContact O-N 3.32Å; E292-L294 VanDerWaalsContact C-N 3.32Å; L294-S296 PolarHBondContact O-N 2.81Å
295	K	82.1	Confident	78.5	Confident	138 Å²	138	69.8 Å²	69.8	60%	0.6	38%	0.375	S	S	*	.			trans	-66.9	79.6	164.3	-65.9	-160.5	172.8	-148.5	0	108.5	E293	E293-K295 PolarHBondContact O-N 3.11Å
296	S	87.4	Confident	80.1	Confident	45 Å²	45	68.9 Å²	68.9	32%	0.315	35%	0.351	S	S	.	.			trans	-76.3	156.3	173.6	51.6	0	0	0	0	111.1	F213 E271 L294	F213-S296 VanDerWaalsContact O-CA 3.24Å; F213-S296 WeakPolarHBondContact O-CA 3.16Å; E271-S296 VanDerWaalsContact CD-OG 3.26Å; E271-S296 WeakPolarHBondContact OE1-CB 3.23Å; E271-S296 PolarHBondContact OE1-OG 3.41Å; L294-S296 PolarHBondContact O-N 2.81Å
297	F	89.3	Confident	81.4	Confident	16 Å²	16	66 Å²	66	7%	0.07	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	153	-177.9	52.2	-84	0	0	0	109.6	F213 W251 L252 H257 L268 L299	F213-F297 PolarHBondContact N-O 3.25Å; F213-F297 WeakPolarHBondContact O-CD1 3.4Å; F213-F297 PolarHBondContact O-N 2.78Å; W251-F297 HydrophobicContact CH2-CD2 4.15Å; W251-F297 HydrophobicContact CZ3-CD2 4.05Å; W251-F297 AromaticContact CZ3-CE2 3.99Å; W251-F297 HydrophobicContact CZ3-CE2 3.99Å; L252-F297 HydrophobicContact CD2-CE2 3.46Å; L252-F297 VanDerWaalsContact CD2-CE2 3.46Å; L252-F297 HydrophobicContact CD2-CZ 3.49Å; L252-F297 VanDerWaalsContact CD2-CZ 3.49Å; H257-F297 HydrophobicContact CB-CE1 4.3Å; H257-F297 AromaticContact CD2-CD1 3.69Å; H257-F297 AromaticContact CD2-CD2 3.55Å; H257-F297 AromaticContact CD2-CE1 3.91Å; H257-F297 AromaticContact CD2-CE2 3.75Å; H257-F297 AromaticContact CD2-CG 3.52Å; H257-F297 AromaticContact CD2-CZ 3.94Å; H257-F297 AromaticContact CE1-CD1 3.89Å; H257-F297 AromaticContact CE1-CG 3.78Å; H257-F297 AromaticContact CG-CD1 3.89Å; H257-F297 AromaticContact CG-CE1 3.97Å; H257-F297 AromaticContact ND1-CD1 4Å; H257-F297 VanDerWaalsContact NE2-CB 3.32Å; H257-F297 WeakPolarHBondContact NE2-CB 3.45Å; H257-F297 AromaticContact NE2-CD1 3.7Å; H257-F297 AromaticContact NE2-CD2 3.57Å; H257-F297 AromaticContact NE2-CG 3.24Å; H257-F297 WeakPolarHBondContact NE2-CG 3.26Å; L268-F297 HydrophobicContact CD2-CZ 3.97Å; F297-L299 HydrophobicContact CD2-CD2 3.88Å; F297-L299 HydrophobicContact CE2-CD2 3.51Å; F297-L299 HydrophobicContact CE2-CG 4.5Å
298	V	89	Confident	82.7	Confident	73 Å²	73	61.5 Å²	61.5	44%	0.442	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	140.3	172.6	177	0	0	0	0	108.4	E209 T212	E209-V298 WeakPolarHBondContact O-CG1 3.42Å; T212-V298 HydrophobicContact CG2-CG2 4.08Å
299	L	88.4	Confident	83.8	Confident	6 Å²	6	63.7 Å²	63.7	3%	0.031	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-91	149.2	175.6	-70.7	-178	0	0	0	111.1	F213 W251 L268 F297 M303 V304 M307	F213-L299 HydrophobicContact CB-CD1 4.19Å; F213-L299 HydrophobicContact CB-CG 4.23Å; F213-L299 HydrophobicContact CD1-CD1 4.07Å; F213-L299 HydrophobicContact CD2-CB 4.05Å; F213-L299 HydrophobicContact CD2-CD1 3.42Å; F213-L299 VanDerWaalsContact CD2-CD1 3.42Å; F213-L299 HydrophobicContact CD2-CG 3.43Å; F213-L299 VanDerWaalsContact CD2-CG 3.43Å; F213-L299 HydrophobicContact CE1-CD1 4.29Å; F213-L299 HydrophobicContact CE2-CB 4.13Å; F213-L299 HydrophobicContact CE2-CD1 3.65Å; F213-L299 HydrophobicContact CE2-CG 3.91Å; F213-L299 HydrophobicContact CG-CD1 3.61Å; F213-L299 HydrophobicContact CG-CG 3.93Å; F213-L299 HydrophobicContact CZ-CD1 4.06Å; W251-L299 HydrophobicContact CE3-CD2 4.44Å; W251-L299 HydrophobicContact CH2-CD2 4.09Å; W251-L299 HydrophobicContact CZ3-CD2 3.6Å; L268-L299 HydrophobicContact CD1-CD1 3.86Å; L268-L299 HydrophobicContact CD1-CD2 4.17Å; F297-L299 HydrophobicContact CD2-CD2 3.88Å; F297-L299 HydrophobicContact CE2-CD2 3.51Å; F297-L299 HydrophobicContact CE2-CG 4.5Å; L299-M303 HydrophobicContact CB-CB 4.47Å; L299-M303 HydrophobicContact CD1-CG 4.24Å; L299-M303 HydrophobicContact CD1-SD 3.93Å; L299-M303 HydrophobicContact CD2-CE 4.44Å; L299-M303 HydrophobicContact CD2-SD 3.52Å; L299-M303 VanDerWaalsContact CD2-SD 3.52Å; L299-M303 HydrophobicContact CG-SD 4.23Å; L299-V304 HydrophobicContact CB-CG2 3.73Å; L299-M307 HydrophobicContact CD1-CE 4.43Å; L299-M307 HydrophobicContact CD1-SD 3.31Å; L299-M307 WeakPolarHBondContact CD1-SD 3.44Å
300	P	88.8	Confident	84.4	Confident	29 Å²	29	65.2 Å²	65.2	19%	0.188	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-69	150.2	174.9	31.9	-35	0	0	0	109.8	W251 W302 M303 V304	W251-P300 HydrophobicContact CD2-CG 4.27Å; W251-P300 HydrophobicContact CZ2-CG 4.11Å; P300-W302 VanDerWaalsContact C-N 3.29Å; P300-W302 HydrophobicContact CB-CG 4.5Å; P300-W302 HydrophobicContact CG-CD2 4.15Å; P300-W302 VanDerWaalsContact CG-CE2 3.46Å; P300-W302 HydrophobicContact CG-CG 4.46Å; P300-W302 HydrophobicContact CG-CZ2 3.7Å; P300-W302 PolarHBondContact O-N 2.74Å; P300-W302 VanDerWaalsContact O-N 3.17Å; P300-M303 HydrophobicContact CG-CB 3.94Å; P300-M303 HydrophobicContact CG-CE 4.37Å; P300-M303 WeakPolarHBondContact O-CA 3.36Å; P300-M303 PolarHBondContact O-N 3.08Å; P300-V304 PolarHBondContact O-N 3.41Å; P300-V304 VanDerWaalsContact O-N 3.09Å
301	S	85.8	Confident	84.8	Confident	62 Å²	62	60.6 Å²	60.6	43%	0.434	29%	0.29	S	S	.	.	H	α-helix	trans	-48.7	-46.5	-175.3	50.6	0	0	0	0	113.3	M303 V304 E305	S301-M303 VanDerWaalsContact C-N 3.25Å; S301-M303 PolarHBondContact O-N 3.2Å; S301-V304 CarbonylContact O-C 3.59Å; S301-V304 WeakPolarHBondContact O-CB 3.47Å; S301-V304 PolarHBondContact O-N 3.28Å; S301-V304 VanDerWaalsContact O-N 3.08Å; S301-E305 WeakPolarHBondContact O-CG 3.22Å; S301-E305 PolarHBondContact O-N 2.84Å
302	W	89	Confident	85	Confident	81 Å²	81	61.6 Å²	61.6	31%	0.307	29%	0.293	S	S	.	.	H	α-helix	trans	-58.7	-31.4	177.5	64.2	-99.7	0	0	0	114	Q247 D248 W251 P300 K306	Q247-W302 HydrophobicContact CG-CH2 4.09Å; Q247-W302 HydrophobicContact CG-CZ3 4.11Å; D248-W302 WeakPolarHBondContact OD1-CZ3 3.46Å; W251-W302 HydrophobicContact CB-CH2 4.22Å; W251-W302 HydrophobicContact CB-CZ2 4.16Å; W251-W302 HydrophobicContact CG-CZ2 4.07Å; P300-W302 VanDerWaalsContact C-N 3.29Å; P300-W302 HydrophobicContact CB-CG 4.5Å; P300-W302 HydrophobicContact CG-CD2 4.15Å; P300-W302 VanDerWaalsContact CG-CE2 3.46Å; P300-W302 HydrophobicContact CG-CG 4.46Å; P300-W302 HydrophobicContact CG-CZ2 3.7Å; P300-W302 PolarHBondContact O-N 2.74Å; P300-W302 VanDerWaalsContact O-N 3.17Å; W302-K306 WeakPolarHBondContact O-CG 3.42Å; W302-K306 PolarHBondContact O-N 2.69Å
303	M	88.4	Confident	85.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-80.4	-38.3	175.9	-165.9	-179.9	-54.7	0	0	110.8	D248 W251 L268 L299 P300 S301 E305 K306 M307	D248-M303 HydrophobicContact CB-CE 3.86Å; D248-M303 HydrophobicContact CB-SD 4.13Å; D248-M303 WeakPolarHBondContact OD1-CE 3.19Å; W251-M303 HydrophobicContact CB-CE 4.34Å; W251-M303 HydrophobicContact CD2-CE 4.07Å; W251-M303 HydrophobicContact CE3-CE 3.62Å; W251-M303 HydrophobicContact CG-CE 4.39Å; W251-M303 HydrophobicContact CZ3-CE 4.33Å; L268-M303 HydrophobicContact CD1-SD 3.91Å; L299-M303 HydrophobicContact CB-CB 4.47Å; L299-M303 HydrophobicContact CD1-CG 4.24Å; L299-M303 HydrophobicContact CD1-SD 3.93Å; L299-M303 HydrophobicContact CD2-CE 4.44Å; L299-M303 HydrophobicContact CD2-SD 3.52Å; L299-M303 VanDerWaalsContact CD2-SD 3.52Å; L299-M303 HydrophobicContact CG-SD 4.23Å; P300-M303 HydrophobicContact CG-CB 3.94Å; P300-M303 HydrophobicContact CG-CE 4.37Å; P300-M303 WeakPolarHBondContact O-CA 3.36Å; P300-M303 PolarHBondContact O-N 3.08Å; S301-M303 VanDerWaalsContact C-N 3.25Å; S301-M303 PolarHBondContact O-N 3.2Å; M303-E305 VanDerWaalsContact C-N 3.31Å; M303-E305 PolarHBondContact O-N 3.23Å; M303-K306 PolarHBondContact O-N 3.25Å; M303-M307 WeakPolarHBondContact O-CG 3.5Å; M303-M307 PolarHBondContact O-N 3.43Å
304	V	86.8	Confident	84.7	Confident	6 Å²	6	54.5 Å²	54.5	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-40.1	173.4	-179.7	0	0	0	0	111	L207 L299 P300 S301 M307 R308	L207-V304 HydrophobicContact CB-CG1 4.12Å; L299-V304 HydrophobicContact CB-CG2 3.73Å; P300-V304 PolarHBondContact O-N 3.41Å; P300-V304 VanDerWaalsContact O-N 3.09Å; S301-V304 CarbonylContact O-C 3.59Å; S301-V304 WeakPolarHBondContact O-CB 3.47Å; S301-V304 PolarHBondContact O-N 3.28Å; S301-V304 VanDerWaalsContact O-N 3.08Å; V304-M307 PolarHBondContact O-N 2.87Å; V304-R308 WeakPolarHBondContact O-CB 3.42Å; V304-R308 PolarHBondContact O-N 3.35Å
305	E	87	Confident	84.1	Confident	125 Å²	125	58.3 Å²	58.3	58%	0.584	28%	0.278	S	S	*	.	H	α-helix	trans	-61.8	-46.7	173.7	-74.7	170.2	-162.1	0	0	112.6	S301 M303 M307 R308 K309	S301-E305 WeakPolarHBondContact O-CG 3.22Å; S301-E305 PolarHBondContact O-N 2.84Å; M303-E305 VanDerWaalsContact C-N 3.31Å; M303-E305 PolarHBondContact O-N 3.23Å; E305-M307 VanDerWaalsContact C-N 3.29Å; E305-M307 PolarHBondContact O-N 3.14Å; E305-R308 PolarHBondContact O-N 3.38Å; E305-K309 PolarHBondContact O-N 3.2Å
306	K	89.3	Confident	82.7	Confident	53 Å²	53	54.2 Å²	54.2	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-59.1	-41.1	173.6	-72.4	-167	-52	177.7	0	111.7	D245 D248 W302 M303 Y310	D245-K306 VanDerWaalsContact CG-NZ 3.33Å; D245-K306 IonicContact OD1-NZ 2.8Å; D245-K306 PolarHBondContact OD1-NZ 3.22Å; D245-K306 IonicContact OD2-NZ 3.06Å; D245-K306 PolarHBondContact OD2-NZ 3.09Å; D248-K306 VanDerWaalsContact OD1-CE 3.27Å; D248-K306 WeakPolarHBondContact OD1-CE 3.41Å; D248-K306 IonicContact OD1-NZ 2.83Å; D248-K306 PolarHBondContact OD1-NZ 3.21Å; D248-K306 IonicContact OD2-NZ 3.42Å; W302-K306 WeakPolarHBondContact O-CG 3.42Å; W302-K306 PolarHBondContact O-N 2.69Å; M303-K306 PolarHBondContact O-N 3.25Å; K306-Y310 WeakPolarHBondContact O-CB 3.47Å; K306-Y310 PolarHBondContact O-N 3.4Å
307	M	87.2	Confident	80.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-68.1	-38.9	177.3	-71.9	-174.2	58.6	0	0	112.8	L207 F213 F240 Y242 L268 L299 M303 V304 E305 Y310 M311	L207-M307 HydrophobicContact CD1-CB 3.91Å; F213-M307 HydrophobicContact CD1-CE 3.75Å; F213-M307 HydrophobicContact CD1-SD 4.46Å; F213-M307 HydrophobicContact CE1-CE 3.26Å; F213-M307 HydrophobicContact CE1-SD 4.1Å; F213-M307 HydrophobicContact CZ-CE 3.97Å; F213-M307 HydrophobicContact CZ-SD 4.36Å; F240-M307 HydrophobicContact CE1-CE 3.8Å; F240-M307 HydrophobicContact CZ-CE 4.33Å; Y242-M307 HydrophobicContact CD1-CE 4.28Å; Y242-M307 HydrophobicContact CD1-CG 3.6Å; Y242-M307 HydrophobicContact CD1-SD 3.72Å; Y242-M307 HydrophobicContact CD2-CB 4.49Å; Y242-M307 HydrophobicContact CD2-CG 3.71Å; Y242-M307 HydrophobicContact CE1-CG 3.67Å; Y242-M307 HydrophobicContact CE1-SD 4.15Å; Y242-M307 HydrophobicContact CE2-CG 3.8Å; Y242-M307 HydrophobicContact CG-CE 4.03Å; Y242-M307 HydrophobicContact CG-CG 3.6Å; Y242-M307 HydrophobicContact CG-SD 3.99Å; L268-M307 HydrophobicContact CD1-SD 4.27Å; L299-M307 HydrophobicContact CD1-CE 4.43Å; L299-M307 HydrophobicContact CD1-SD 3.31Å; L299-M307 WeakPolarHBondContact CD1-SD 3.44Å; M303-M307 WeakPolarHBondContact O-CG 3.5Å; M303-M307 PolarHBondContact O-N 3.43Å; V304-M307 PolarHBondContact O-N 2.87Å; E305-M307 VanDerWaalsContact C-N 3.29Å; E305-M307 PolarHBondContact O-N 3.14Å; M307-Y310 WeakPolarHBondContact O-CB 3.38Å; M307-Y310 PolarHBondContact O-N 3.43Å; M307-M311 PolarHBondContact O-N 3.2Å
308	R	85.4	Confident	78.8	Confident	82 Å²	82	57.5 Å²	57.5	31%	0.309	28%	0.277	S	S	.	.	H	α-helix	trans	-61.1	-49.7	174.3	-164.9	-168.8	-53.4	-78.4	2	110.6	P204 L207 V304 E305 Y310 M311 E312	P204-R308 HydrophobicContact CB-CG 3.52Å; P204-R308 PolarHBondContact O-NH1 2.91Å; L207-R308 PolarHBondContact O-NH1 3.48Å; L207-R308 PolarHBondContact O-NH2 3.42Å; V304-R308 WeakPolarHBondContact O-CB 3.42Å; V304-R308 PolarHBondContact O-N 3.35Å; E305-R308 PolarHBondContact O-N 3.38Å; R308-Y310 VanDerWaalsContact C-N 3.29Å; R308-Y310 PolarHBondContact O-N 2.89Å; R308-M311 WeakPolarHBondContact O-CB 3.48Å; R308-M311 PolarHBondContact O-N 3.11Å; R308-E312 PolarHBondContact O-N 3.46Å
309	K	85.6	Confident	76.5	Confident	152 Å²	152	59 Å²	59	66%	0.661	28%	0.279	S	S	*	.	H	α-helix	trans	-60.9	-37.3	175.7	-172	173.4	-178.3	176.2	0	112.2	E305 E312 T313	E305-K309 PolarHBondContact O-N 3.2Å; K309-E312 WeakPolarHBondContact O-CB 3.36Å; K309-E312 PolarHBondContact O-N 3.34Å; K309-T313 WeakPolarHBondContact O-CG2 3.37Å; K309-T313 PolarHBondContact O-N 3.37Å; K309-T313 PolarHBondContact O-OG1 3.09Å
310	Y	85	Confident	74.2	Confident	79 Å²	79	65.3 Å²	65.3	31%	0.31	31%	0.308	S	S	.	.	H	α-helix	trans	-64.3	-44.6	175.2	-178.5	-105.8	0	0	0	112.4	F240 Y242 K306 M307 R308 E312 T313 L314	F240-Y310 HydrophobicContact CE2-CD1 4.01Å; F240-Y310 HydrophobicContact CE2-CE1 4.22Å; F240-Y310 HydrophobicContact CZ-CD1 4.08Å; F240-Y310 HydrophobicContact CZ-CE1 4.46Å; Y242-Y310 AromaticContact CD2-CD1 3.62Å; Y242-Y310 HydrophobicContact CD2-CD1 3.62Å; Y242-Y310 HydrophobicContact CD2-CE1 4.1Å; Y242-Y310 AromaticContact CD2-CG 3.87Å; Y242-Y310 HydrophobicContact CD2-CG 3.87Å; Y242-Y310 HydrophobicContact CE2-CD1 4.29Å; Y242-Y310 HydrophobicContact CE2-CG 4.07Å; K306-Y310 WeakPolarHBondContact O-CB 3.47Å; K306-Y310 PolarHBondContact O-N 3.4Å; M307-Y310 WeakPolarHBondContact O-CB 3.38Å; M307-Y310 PolarHBondContact O-N 3.43Å; R308-Y310 VanDerWaalsContact C-N 3.29Å; R308-Y310 PolarHBondContact O-N 2.89Å; Y310-E312 VanDerWaalsContact C-N 3.34Å; Y310-E312 PolarHBondContact O-N 3.31Å; Y310-T313 WeakPolarHBondContact CA-OG1 3.43Å; Y310-T313 PolarHBondContact O-N 3.15Å; Y310-T313 PolarHBondContact O-OG1 2.78Å; Y310-L314 HydrophobicContact CD1-CD1 4.01Å; Y310-L314 HydrophobicContact CE1-CD1 3.46Å; Y310-L314 VanDerWaalsContact CE1-CD1 3.46Å; Y310-L314 HydrophobicContact CE1-CG 4.38Å; Y310-L314 HydrophobicContact CE2-CD1 4.22Å; Y310-L314 HydrophobicContact CE2-CG 4.42Å; Y310-L314 WeakPolarHBondContact O-CG 3.49Å; Y310-L314 PolarHBondContact O-N 3.17Å; Y310-L314 VanDerWaalsContact O-N 3.15Å
311	M	83.1	Confident	71.9	Confident	2 Å²	2	71 Å²	71	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-57	-47.3	171.9	-76.6	-177.4	163.8	0	0	111.7	L207 F240 I270 M307 R308 T313 L314 R315	L207-M311 HydrophobicContact CD1-CE 3.97Å; L207-M311 HydrophobicContact CD1-SD 3.61Å; L207-M311 HydrophobicContact CD2-CE 3.92Å; L207-M311 HydrophobicContact CD2-SD 4.35Å; L207-M311 HydrophobicContact CG-CE 4.03Å; L207-M311 HydrophobicContact CG-SD 3.79Å; F240-M311 HydrophobicContact CD1-CE 3.63Å; F240-M311 HydrophobicContact CD2-CE 3.67Å; F240-M311 HydrophobicContact CD2-CG 4.03Å; F240-M311 HydrophobicContact CE1-CE 3.65Å; F240-M311 HydrophobicContact CE2-CE 3.7Å; F240-M311 HydrophobicContact CE2-CG 3.39Å; F240-M311 HydrophobicContact CE2-SD 4.41Å; F240-M311 HydrophobicContact CG-CE 3.64Å; F240-M311 HydrophobicContact CZ-CE 3.68Å; F240-M311 HydrophobicContact CZ-CG 3.75Å; I270-M311 HydrophobicContact CD1-CE 3.77Å; M307-M311 PolarHBondContact O-N 3.2Å; R308-M311 WeakPolarHBondContact O-CB 3.48Å; R308-M311 PolarHBondContact O-N 3.11Å; M311-T313 PolarHBondContact O-N 2.98Å; M311-L314 PolarHBondContact O-N 2.78Å; M311-R315 PolarHBondContact O-N 2.99Å
312	E	79.5	Confident	69.8	Low	88 Å²	88	71.1 Å²	71.1	41%	0.411	33%	0.331	S	S	.	.	H	α-helix	trans	-53.7	-50.9	176.8	-150.3	82.4	-122.9	0	0	111.3	R308 K309 Y310 L314 R315 T316	R308-E312 PolarHBondContact O-N 3.46Å; K309-E312 WeakPolarHBondContact O-CB 3.36Å; K309-E312 PolarHBondContact O-N 3.34Å; Y310-E312 VanDerWaalsContact C-N 3.34Å; Y310-E312 PolarHBondContact O-N 3.31Å; E312-L314 VanDerWaalsContact C-N 3.34Å; E312-L314 PolarHBondContact O-N 3.36Å; E312-R315 WeakPolarHBondContact O-CB 3.1Å; E312-R315 PolarHBondContact O-N 3.04Å; E312-R315 VanDerWaalsContact O-N 3.13Å; E312-T316 PolarHBondContact O-N 3.19Å; E312-T316 PolarHBondContact O-OG1 2.88Å
313	T	77	Confident	67.8	Low	68 Å²	68	73.3 Å²	73.3	42%	0.417	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-35.2	-178.3	52	0	0	0	0	113.6	K309 Y310 M311 R315 T316 E317	K309-T313 WeakPolarHBondContact O-CG2 3.37Å; K309-T313 PolarHBondContact O-N 3.37Å; K309-T313 PolarHBondContact O-OG1 3.09Å; Y310-T313 WeakPolarHBondContact CA-OG1 3.43Å; Y310-T313 PolarHBondContact O-N 3.15Å; Y310-T313 PolarHBondContact O-OG1 2.78Å; M311-T313 PolarHBondContact O-N 2.98Å; T313-R315 VanDerWaalsContact C-N 3.26Å; T313-R315 PolarHBondContact O-N 2.84Å; T313-T316 PolarHBondContact O-OG1 3.41Å; T313-E317 WeakPolarHBondContact O-CB 3.45Å; T313-E317 PolarHBondContact O-N 3.14Å; T313-E317 VanDerWaalsContact O-N 3.09Å
314	L	67.9	Low	65.5	Low	25 Å²	25	81.3 Å²	81.3	13%	0.131	39%	0.39	C	S	.	.	H	α-helix	trans	-75.9	-15.4	178.4	-67.6	-177.7	0	0	0	113.4	R197 W202 Y310 M311 E312	R197-L314 PolarHBondContact NH1-O 3.04Å; W202-L314 HydrophobicContact CZ3-CB 4.43Å; W202-L314 HydrophobicContact CZ3-CD1 3.82Å; Y310-L314 HydrophobicContact CD1-CD1 4.01Å; Y310-L314 HydrophobicContact CE1-CD1 3.46Å; Y310-L314 VanDerWaalsContact CE1-CD1 3.46Å; Y310-L314 HydrophobicContact CE1-CG 4.38Å; Y310-L314 HydrophobicContact CE2-CD1 4.22Å; Y310-L314 HydrophobicContact CE2-CG 4.42Å; Y310-L314 WeakPolarHBondContact O-CG 3.49Å; Y310-L314 PolarHBondContact O-N 3.17Å; Y310-L314 VanDerWaalsContact O-N 3.15Å; M311-L314 PolarHBondContact O-N 2.78Å; E312-L314 VanDerWaalsContact C-N 3.34Å; E312-L314 PolarHBondContact O-N 3.36Å
315	R	64	Low	63.3	Low	94 Å²	94	84.4 Å²	84.4	36%	0.355	42%	0.416	S	S	.	.	H	α-helix	trans	-85.8	-48.3	171.9	-171.6	-173.7	-169.3	132.5	0.1	111	D203 M311 E312 T313 E317 N318 E319	D203-R315 IonicContact OD1-CZ 3.77Å; D203-R315 IonicContact OD1-NH1 2.69Å; D203-R315 PolarHBondContact OD1-NH1 2.73Å; D203-R315 IonicContact OD1-NH2 3.61Å; M311-R315 PolarHBondContact O-N 2.99Å; E312-R315 WeakPolarHBondContact O-CB 3.1Å; E312-R315 PolarHBondContact O-N 3.04Å; E312-R315 VanDerWaalsContact O-N 3.13Å; T313-R315 VanDerWaalsContact C-N 3.26Å; T313-R315 PolarHBondContact O-N 2.84Å; R315-E317 VanDerWaalsContact C-N 3.34Å; R315-E317 PolarHBondContact O-N 2.98Å; R315-N318 WeakPolarHBondContact O-CA 3.46Å; R315-N318 VanDerWaalsContact O-CB 3.29Å; R315-N318 WeakPolarHBondContact O-CB 3.26Å; R315-N318 PolarHBondContact O-N 2.79Å; R315-E319 PolarHBondContact O-N 3.39Å
316	T	52.7	Low	61	Low	53 Å²	53	83.4 Å²	83.4	33%	0.325	42%	0.421	S	S	.	.	H	α-helix	trans	-66.9	-32.3	180	54.6	0	0	0	0	112.9	E312 T313 N318 E319 H320	E312-T316 PolarHBondContact O-N 3.19Å; E312-T316 PolarHBondContact O-OG1 2.88Å; T313-T316 PolarHBondContact O-OG1 3.41Å; T316-N318 PolarHBondContact O-N 2.89Å; T316-E319 PolarHBondContact O-N 3.23Å; T316-H320 PolarHBondContact O-N 2.83Å; T316-H320 VanDerWaalsContact O-N 3.15Å; T316-H320 PolarHBondContact O-ND1 2.99Å
317	E	50.4	Low	58.7	Low	87 Å²	87	86.4 Å²	86.4	41%	0.407	45%	0.446	S	S	.	.	H	α-helix	trans	-57.3	-32.6	168.3	-172.8	-167.4	-162	0	0	112	R197 T313 R315	R197-E317 IonicContact CZ-OE2 3.74Å; R197-E317 IonicContact NH1-OE2 2.69Å; R197-E317 PolarHBondContact NH1-OE2 3.08Å; R197-E317 IonicContact NH2-OE2 2.75Å; T313-E317 WeakPolarHBondContact O-CB 3.45Å; T313-E317 PolarHBondContact O-N 3.14Å; T313-E317 VanDerWaalsContact O-N 3.09Å; R315-E317 VanDerWaalsContact C-N 3.34Å; R315-E317 PolarHBondContact O-N 2.98Å
318	N	44.5	Very low	56.6	Low	42 Å²	42	95.9 Å²	95.9	23%	0.225	49%	0.49	C	S	.	.	H	α-helix	trans	-81.9	-38.7	-179.6	-153.1	69.9	0	0	0	112.2	E198 R315 T316 R321 A322	E198-N318 PolarHBondContact OE1-ND2 2.93Å; R315-N318 WeakPolarHBondContact O-CA 3.46Å; R315-N318 VanDerWaalsContact O-CB 3.29Å; R315-N318 WeakPolarHBondContact O-CB 3.26Å; R315-N318 PolarHBondContact O-N 2.79Å; T316-N318 PolarHBondContact O-N 2.89Å; N318-R321 PolarHBondContact O-N 2.89Å; N318-A322 PolarHBondContact O-N 3.24Å; N318-A322 VanDerWaalsContact O-N 3.12Å
319	E	40.2	Very low	54.8	Low	105 Å²	105	101.8 Å²	101.8	49%	0.491	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-43.3	176	-80.7	-179.9	132.6	0	0	112.6	R315 T316 R321 A322 V323	R315-E319 PolarHBondContact O-N 3.39Å; T316-E319 PolarHBondContact O-N 3.23Å; E319-R321 VanDerWaalsContact C-N 3.26Å; E319-R321 PolarHBondContact O-N 2.95Å; E319-A322 WeakPolarHBondContact O-CB 3.49Å; E319-A322 PolarHBondContact O-N 3.43Å; E319-V323 PolarHBondContact O-N 2.91Å
320	H	40.7	Very low	53.3	Low	139 Å²	139	99.3 Å²	99.3	64%	0.644	53%	0.529	S	S	*	.	H	α-helix	trans	-61.2	-36.2	177.9	-72.7	83.4	0	0	0	111.9	T316 A322 V323	T316-H320 PolarHBondContact O-N 2.83Å; T316-H320 VanDerWaalsContact O-N 3.15Å; T316-H320 PolarHBondContact O-ND1 2.99Å; H320-A322 VanDerWaalsContact C-N 3.34Å; H320-V323 PolarHBondContact O-N 3.45Å
321	R	41.3	Very low	51.6	Low	147 Å²	147	100.3 Å²	100.3	56%	0.555	54%	0.54	S	S	*	.	H	α-helix	trans	-74	-19.2	173.8	-75.6	-175.3	169.2	172.5	1.7	114.5	E133 N318 E319	E133-R321 IonicContact OE1-CZ 3.73Å; E133-R321 IonicContact OE1-NE 3.66Å; E133-R321 IonicContact OE1-NH2 2.69Å; E133-R321 PolarHBondContact OE1-NH2 2.78Å; N318-R321 PolarHBondContact O-N 2.89Å; E319-R321 VanDerWaalsContact C-N 3.26Å; E319-R321 PolarHBondContact O-N 2.95Å
322	A	41.1	Very low	49.8	Very low	65 Å²	65	105.8 Å²	105.8	54%	0.537	57%	0.57	S	S	.	*	H	α-helix	trans	-79.6	-27.4	175.4	0	0	0	0	0	112.5	N318 E319 H320	N318-A322 PolarHBondContact O-N 3.24Å; N318-A322 VanDerWaalsContact O-N 3.12Å; E319-A322 WeakPolarHBondContact O-CB 3.49Å; E319-A322 PolarHBondContact O-N 3.43Å; H320-A322 VanDerWaalsContact C-N 3.34Å
323	V	46.7	Very low	48.1	Very low	127 Å²	127	106.8 Å²	106.8	77%	0.77	58%	0.579	S	S	*	*	H	α-helix	trans	-82.4	-25.5	-178.9	179.1	0	0	0	0	112.8	E319 H320 A325	E319-V323 PolarHBondContact O-N 2.91Å; H320-V323 PolarHBondContact O-N 3.45Å; V323-A325 VanDerWaalsContact C-N 3.3Å; V323-A325 PolarHBondContact O-N 3.31Å
324	E	41	Very low	46.3	Very low	168 Å²	168	109.3 Å²	109.3	79%	0.785	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	6.8	178.8	-71.4	-166.6	139.4	0	0	115.2	P326	E324-P326 VanDerWaalsContact O-CD 3.23Å; E324-P326 WeakPolarHBondContact O-CD 3.48Å
325	A	39.1	Very low	44.9	Very low	71 Å²	71	114.9 Å²	114.9	59%	0.587	62%	0.62	S	S	*	*			trans	-78.1	112.1	174	0	0	0	0	0	110.7	V323	V323-A325 VanDerWaalsContact C-N 3.3Å; V323-A325 PolarHBondContact O-N 3.31Å
326	P	39.6	Very low	43.5	Very low	104 Å²	104	116.4 Å²	116.4	68%	0.675	64%	0.639	S	S	*	*			trans	-68.2	144	177.3	29.2	-34.6	0	0	0	110.5	E324 Q328	E324-P326 VanDerWaalsContact O-CD 3.23Å; E324-P326 WeakPolarHBondContact O-CD 3.48Å; P326-Q328 PolarHBondContact O-N 2.99Å
327	P	41.9	Very low	42.8	Very low	116 Å²	116	121.2 Å²	121.2	75%	0.753	66%	0.663	S	S	*	*			trans	-64	124	176.7	26.8	-33.5	0	0	0	109.9	T329	P327-T329 PolarHBondContact O-N 3.01Å
328	Q	42.9	Very low	42.1	Very low	200 Å²	200	124.1 Å²	124.1	94%	0.935	68%	0.684	S	S	*	*			trans	-74.7	113.4	172.5	-63.2	179.2	20.8	0	0	108.6	P326	P326-Q328 PolarHBondContact O-N 2.99Å
329	T	46.8	Very low	41.9	Very low	205 Å²	205	131.5 Å²	131.5	100%	1.258	73%	0.726	S	S	*	*			trans	-98.7	0	169.1	54.3	0	0	0	0	110.6	P327	P327-T329 PolarHBondContact O-N 3.01Å

Retrieved 329 of 329 residues in 876.6 ms (Link to these results)

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