A0A077Z4B5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4B5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 269 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.3	Very low	41.4	Very low	243 Å²	243	143.5 Å²	143.5	100%	1.197	82%	0.817	S	S	*	*				0	106.4	0	-63.5	161.5	171.5	0	0	106
2	N	43.5	Very low	41.7	Very low	161 Å²	161	140.3 Å²	140.3	86%	0.861	82%	0.821	S	S	*	*			cis	-139.3	142.5	7.9	-85.8	-20.3	0	0	0	108.5
3	C	30.7	Very low	41.5	Very low	120 Å²	120	139.9 Å²	139.9	81%	0.811	82%	0.821	S	S	*	*			trans	-124.3	150.8	164.1	-65.3	0	0	0	0	107.9
4	R	36.1	Very low	41.6	Very low	207 Å²	207	138 Å²	138	78%	0.781	81%	0.811	S	S	*	*			trans	125.8	148.4	130.9	-64.7	-175.6	179.4	-169.7	-3.6	117.3
5	H	44.9	Very low	41.7	Very low	160 Å²	160	140.6 Å²	140.6	74%	0.741	81%	0.812	S	S	*	*			trans	77.5	137.4	156	-48.7	111.2	0	0	0	115.5
6	G	42.4	Very low	41.8	Very low	66 Å²	66	137.5 Å²	137.5	68%	0.68	81%	0.808	S	S	*	*			cis	174.7	-169.1	5.8	0	0	0	0	0	104.5
7	D	42.9	Very low	41.8	Very low	126 Å²	126	133.3 Å²	133.3	67%	0.674	80%	0.801	S	S	*	*			cis	-174	148.4	-19.3	-120	-20.7	0	0	0	104.7
8	H	46.5	Very low	42	Very low	148 Å²	148	135.5 Å²	135.5	69%	0.685	81%	0.808	S	S	*	*			trans	74.8	140.4	145.7	-64.2	-53.5	0	0	0	126.2
9	N	45.6	Very low	42	Very low	163 Å²	163	133.4 Å²	133.4	87%	0.872	81%	0.807	S	S	*	*			trans	92.1	136.5	148.8	-58.9	-27	0	0	0	118.5
10	G	41.1	Very low	42.2	Very low	78 Å²	78	134.4 Å²	134.4	80%	0.804	81%	0.813	S	S	*	*			cis	-171.8	171.8	12.1	0	0	0	0	0	112.4
11	A	41	Very low	42.2	Very low	106 Å²	106	132.6 Å²	132.6	88%	0.876	81%	0.806	S	S	*	*			trans	-83.5	162	-169.1	0	0	0	0	0	115.6
12	A	44.7	Very low	42.2	Very low	105 Å²	105	128.1 Å²	128.1	87%	0.868	79%	0.787	S	S	*	*				176.5	135.1	129.4	0	0	0	0	0	112.7
13	V	38.6	Very low	42.2	Very low	136 Å²	136	125.1 Å²	125.1	82%	0.824	78%	0.779	S	S	*	*			trans	-112.9	134.7	170	165.3	0	0	0	0	106.9
14	V	43.4	Very low	42.8	Very low	113 Å²	113	128.8 Å²	128.8	69%	0.685	78%	0.784	S	S	*	*			trans	-177.3	144.8	132	-121.1	0	0	0	0	116
15	H	42.9	Very low	43.1	Very low	177 Å²	177	128.7 Å²	128.7	82%	0.819	79%	0.789	S	S	*	*			trans	69.9	153	148.1	-63.9	-50.3	0	0	0	120.5
16	A	42.7	Very low	42.8	Very low	91 Å²	91	126.8 Å²	126.8	75%	0.752	79%	0.789	S	S	*	*			cis	177.1	157.7	-19.8	0	0	0	0	0	106.7
17	G	42.4	Very low	43	Very low	66 Å²	66	128.8 Å²	128.8	68%	0.68	79%	0.793	S	S	*	*			trans	94.8	136.8	171.1	0	0	0	0	0	114.1
18	D	46.2	Very low	43.1	Very low	173 Å²	173	131.7 Å²	131.7	93%	0.925	80%	0.802	S	S	*	*			cis	-154.8	158	22.3	-75.8	-47	0	0	0	111.5
19	A	41.8	Very low	43.3	Very low	96 Å²	96	130.9 Å²	130.9	79%	0.793	81%	0.807	S	S	*	*			trans	-89.7	143.3	179.7	0	0	0	0	0	112.7
20	V	45.9	Very low	43.5	Very low	152 Å²	152	130.5 Å²	130.5	92%	0.921	81%	0.805	S	S	*	*			trans	-142.9	124.5	151.6	177.5	0	0	0	0	109.2
21	S	41.4	Very low	43.6	Very low	97 Å²	97	129.9 Å²	129.9	68%	0.678	79%	0.788	S	S	*	*			trans	-94.7	140.5	174.8	52.5	0	0	0	0	111.6
22	D	41.2	Very low	44.3	Very low	149 Å²	149	130.3 Å²	130.3	80%	0.797	78%	0.782	S	S	*	*			trans	-167.5	111.7	140.3	-105.2	-23.6	0	0	0	108.5
23	S	43.9	Very low	44.7	Very low	98 Å²	98	134.7 Å²	134.7	69%	0.685	78%	0.782	S	S	*	*				64.4	89.5	81.2	-55.7	0	0	0	0	113.2
24	Q	42.9	Very low	45.1	Very low	198 Å²	198	132.7 Å²	132.7	93%	0.925	77%	0.773	S	S	*	*			trans	-166.5	125.8	131.9	-107.4	168.6	-1.6	0	0	111.8
25	K	43.7	Very low	45.6	Very low	204 Å²	204	133 Å²	133	89%	0.887	77%	0.769	S	S	*	*			trans	-106.2	112.6	-178.8	-166.3	-178.3	-166.3	-179.5	0	105.5
26	T	38.9	Very low	46	Very low	121 Å²	121	125.9 Å²	125.9	74%	0.742	74%	0.741	S	S	*	*			trans	-119.7	98.4	167.9	47.5	0	0	0	0	108.7	E28	T26-E28 PolarHBondContact O-N 3.27Å
27	S	45.2	Very low	46.5	Very low	108 Å²	108	127 Å²	127	76%	0.755	74%	0.741	S	S	*	*			trans	-69.8	100.6	154.9	50.1	0	0	0	0	107.2	V29	S27-V29 PolarHBondContact O-N 3.29Å
28	E	44.8	Very low	47	Very low	187 Å²	187	131 Å²	131	87%	0.874	74%	0.735	S	S	*	*			trans	-78.3	110.5	171.9	-98.6	-179.6	155.1	0	0	109.9	T26	T26-E28 PolarHBondContact O-N 3.27Å
29	V	51.7	Low	47.1	Very low	130 Å²	130	128.2 Å²	128.2	79%	0.788	72%	0.716	S	S	*	*			trans	-60.6	127.6	169	-167.9	0	0	0	0	107.7	S27 C31	S27-V29 PolarHBondContact O-N 3.29Å; V29-C31 PolarHBondContact O-N 2.88Å
30	N	49.2	Very low	47.6	Very low	156 Å²	156	128.6 Å²	128.6	83%	0.834	71%	0.709	S	S	*	*			trans	-59.6	95.8	179.2	-155	0.7	0	0	0	109.5	P32	N30-P32 WeakPolarHBondContact O-CD 3.42Å
31	C	43	Very low	47.9	Very low	64 Å²	64	124.2 Å²	124.2	43%	0.432	69%	0.689	S	S	.	*			trans	-87.5	115.6	176.6	-176.6	0	0	0	0	109	V29 F33 C34	V29-C31 PolarHBondContact O-N 2.88Å; C31-F33 PolarHBondContact O-N 3.36Å; C31-C34 HydrophobicContact CB-CB 4.36Å; C31-C34 PolarHBondContact O-N 2.94Å; C31-C34 PolarHBondContact SG-SG 3.48Å
32	P	56.3	Low	48.3	Very low	116 Å²	116	127.9 Å²	127.9	75%	0.753	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-2.4	-178.6	-17.6	30.7	0	0	0	114.5	N30	N30-P32 WeakPolarHBondContact O-CD 3.42Å
33	F	52.5	Low	48.7	Very low	197 Å²	197	126 Å²	126	86%	0.864	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	1.1	-175	-111.5	-94.5	0	0	0	114.5	C31	C31-F33 PolarHBondContact O-N 3.36Å
34	C	47.7	Very low	48.9	Very low	94 Å²	94	125.7 Å²	125.7	64%	0.635	69%	0.685	S	S	*	*			trans	-102.4	11.5	-175.5	-59.5	0	0	0	0	114.5	C31 A36	C31-C34 HydrophobicContact CB-CB 4.36Å; C31-C34 PolarHBondContact O-N 2.94Å; C31-C34 PolarHBondContact SG-SG 3.48Å; C34-A36 VanDerWaalsContact C-N 3.35Å; C34-A36 PolarHBondContact O-N 2.88Å
35	I	53.1	Low	49	Very low	120 Å²	120	123 Å²	123	62%	0.615	68%	0.676	S	S	*	*			trans	-69.1	99.2	172.3	-54.4	177.7	0	0	0	107.3
36	A	52.3	Low	48.9	Very low	26 Å²	26	118.3 Å²	118.3	22%	0.215	67%	0.668	C	S	.	*			trans	-62.1	132.4	178.6	0	0	0	0	0	108.8	C34 W38 Q39	C34-A36 VanDerWaalsContact C-N 3.35Å; C34-A36 PolarHBondContact O-N 2.88Å; A36-W38 VanDerWaalsContact CB-CD1 3.44Å; A36-W38 HydrophobicContact CB-CD2 4.37Å; A36-W38 HydrophobicContact CB-CG 4.18Å; A36-W38 HydrophobicContact CB-CZ2 4.49Å; A36-W38 PolarHBondContact O-N 2.86Å; A36-Q39 PolarHBondContact O-N 3.43Å
37	P	53.4	Low	49.3	Very low	116 Å²	116	118.7 Å²	118.7	75%	0.753	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-13.8	-176.3	-25.9	33	0	0	0	114.9
38	W	52.4	Low	49.1	Very low	150 Å²	150	120.5 Å²	120.5	57%	0.568	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-26.4	176.2	59.5	-96	0	0	0	113.3	A36 T40 A41 Y42	A36-W38 VanDerWaalsContact CB-CD1 3.44Å; A36-W38 HydrophobicContact CB-CD2 4.37Å; A36-W38 HydrophobicContact CB-CG 4.18Å; A36-W38 HydrophobicContact CB-CZ2 4.49Å; A36-W38 PolarHBondContact O-N 2.86Å; W38-T40 PolarHBondContact O-N 2.94Å; W38-A41 PolarHBondContact O-N 3.11Å; W38-A41 VanDerWaalsContact O-N 3.11Å; W38-Y42 HydrophobicContact CB-CE2 4.49Å; W38-Y42 AromaticContact CE3-CD2 3.79Å; W38-Y42 HydrophobicContact CE3-CD2 3.79Å; W38-Y42 AromaticContact CE3-CE2 3.61Å; W38-Y42 HydrophobicContact CE3-CE2 3.61Å; W38-Y42 HydrophobicContact CZ3-CD2 4.38Å; W38-Y42 HydrophobicContact CZ3-CE2 4.26Å; W38-Y42 WeakPolarHBondContact O-CD2 3.1Å; W38-Y42 PolarHBondContact O-N 3.38Å
39	Q	48.4	Very low	49.6	Very low	113 Å²	113	114 Å²	114	53%	0.528	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.3	-28.9	-177.8	-75.4	-179.3	-35.7	0	0	113	A36	A36-Q39 PolarHBondContact O-N 3.43Å
40	T	51.7	Low	50.1	Low	104 Å²	104	112.9 Å²	112.9	64%	0.638	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-11.9	170.8	19.9	0	0	0	0	113.6	W38	W38-T40 PolarHBondContact O-N 2.94Å
41	A	52	Low	51.6	Low	60 Å²	60	108.9 Å²	108.9	50%	0.496	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.9	-20.2	171.8	0	0	0	0	0	113.1	W38 S43 S44	W38-A41 PolarHBondContact O-N 3.11Å; W38-A41 VanDerWaalsContact O-N 3.11Å; A41-S43 VanDerWaalsContact C-N 3.27Å; A41-S43 PolarHBondContact O-N 3.3Å; A41-S44 PolarHBondContact O-N 3.49Å
42	Y	50.8	Low	53.9	Low	175 Å²	175	107.3 Å²	107.3	69%	0.686	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-4.2	176	-80.1	-74.9	0	0	0	114.7	W38 S44	W38-Y42 HydrophobicContact CB-CE2 4.49Å; W38-Y42 AromaticContact CE3-CD2 3.79Å; W38-Y42 HydrophobicContact CE3-CD2 3.79Å; W38-Y42 AromaticContact CE3-CE2 3.61Å; W38-Y42 HydrophobicContact CE3-CE2 3.61Å; W38-Y42 HydrophobicContact CZ3-CD2 4.38Å; W38-Y42 HydrophobicContact CZ3-CE2 4.26Å; W38-Y42 WeakPolarHBondContact O-CD2 3.1Å; W38-Y42 PolarHBondContact O-N 3.38Å; Y42-S44 VanDerWaalsContact C-N 3.34Å
43	S	49	Very low	55.6	Low	109 Å²	109	106 Å²	106	76%	0.762	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-2.3	171	-171.6	0	0	0	0	113.4	A41 L45	A41-S43 VanDerWaalsContact C-N 3.27Å; A41-S43 PolarHBondContact O-N 3.3Å; S43-L45 PolarHBondContact O-N 3.38Å
44	S	48.7	Very low	57.6	Low	91 Å²	91	100 Å²	100	64%	0.636	57%	0.568	S	S	*	*	S	Bend	trans	-96.3	95.2	178.2	-72.2	0	0	0	0	110	A41 Y42	A41-S44 PolarHBondContact O-N 3.49Å; Y42-S44 VanDerWaalsContact C-N 3.34Å
45	L	43.8	Very low	59.9	Low	141 Å²	141	104 Å²	104	74%	0.738	57%	0.569	S	S	*	*			trans	59.5	73.2	167.3	-74.9	128.1	0	0	0	115.3	S43 I47	S43-L45 PolarHBondContact O-N 3.38Å; L45-I47 HydrophobicContact CB-CG1 4.11Å; L45-I47 HydrophobicContact CD2-CD1 4.06Å; L45-I47 HydrophobicContact CD2-CG1 3.54Å; L45-I47 HydrophobicContact CG-CG1 4.47Å; L45-I47 PolarHBondContact O-N 2.85Å
46	C	41	Very low	62	Low	106 Å²	106	101.7 Å²	101.7	72%	0.716	55%	0.553	S	S	*	*			trans	-62.1	86.7	134.1	-69.1	0	0	0	0	106.6	M48	C46-M48 PolarHBondContact O-N 2.76Å
47	I	48.8	Very low	64.1	Low	129 Å²	129	100.5 Å²	100.5	66%	0.662	54%	0.543	S	S	*	.			trans	-63.2	88.7	155.8	-57.4	176.3	0	0	0	103.5	L45 S49	L45-I47 HydrophobicContact CB-CG1 4.11Å; L45-I47 HydrophobicContact CD2-CD1 4.06Å; L45-I47 HydrophobicContact CD2-CG1 3.54Å; L45-I47 HydrophobicContact CG-CG1 4.47Å; L45-I47 PolarHBondContact O-N 2.85Å; I47-S49 PolarHBondContact O-N 2.9Å
48	M	40.7	Very low	66.1	Low	147 Å²	147	99.2 Å²	99.2	72%	0.724	52%	0.524	S	S	*	.			trans	-59.8	86.3	159.8	-74.1	-72.8	-60.4	0	0	104.4	C46 T50	C46-M48 PolarHBondContact O-N 2.76Å; M48-T50 HydrophobicContact CB-CG2 4.22Å; M48-T50 PolarHBondContact O-N 2.77Å
49	S	54.2	Low	68.2	Low	50 Å²	50	97 Å²	97	35%	0.35	52%	0.523	S	S	.	.			trans	-65.6	88.8	164.5	-176.1	0	0	0	0	105	I47 S51 S223	I47-S49 PolarHBondContact O-N 2.9Å; S49-S51 PolarHBondContact O-N 2.74Å; S49-S223 VanDerWaalsContact CB-O 3.24Å; S49-S223 WeakPolarHBondContact CB-O 3.34Å; S49-S223 PolarHBondContact OG-O 3.46Å
50	T	63.2	Low	70.4	Confident	107 Å²	107	94 Å²	94	66%	0.656	51%	0.512	S	S	*	.			trans	-72.5	93.1	175.7	54.1	0	0	0	0	105.6	M48 K52	M48-T50 HydrophobicContact CB-CG2 4.22Å; M48-T50 PolarHBondContact O-N 2.77Å; T50-K52 PolarHBondContact O-N 2.62Å
51	S	80.2	Confident	72.5	Confident	72 Å²	72	89 Å²	89	50%	0.503	48%	0.482	S	S	.	.			trans	-46.4	126	170	-173.9	0	0	0	0	108.7	S49 N53 R139	S49-S51 PolarHBondContact O-N 2.74Å; S51-N53 PolarHBondContact O-N 3.03Å; S51-R139 PolarHBondContact OG-NH2 3Å
52	K	92.2	Very high	74.6	Confident	31 Å²	31	92.4 Å²	92.4	14%	0.135	49%	0.488	C	S	.	.			trans	-64.6	108.8	-172.8	-68.2	172.5	-173.5	68.3	0	109.9	T50 W56 F135 R139 D225 F227 D228	T50-K52 PolarHBondContact O-N 2.62Å; K52-W56 HydrophobicContact CB-CB 4.3Å; K52-W56 HydrophobicContact CB-CD2 3.74Å; K52-W56 HydrophobicContact CB-CE3 3.68Å; K52-W56 HydrophobicContact CB-CG 4Å; K52-W56 HydrophobicContact CB-CZ3 4.39Å; K52-W56 HydrophobicContact CD-CD2 3.67Å; K52-W56 HydrophobicContact CD-CE3 3.62Å; K52-W56 HydrophobicContact CD-CH2 3.6Å; K52-W56 HydrophobicContact CD-CZ2 3.6Å; K52-W56 HydrophobicContact CD-CZ3 3.6Å; K52-W56 HydrophobicContact CG-CD2 3.71Å; K52-W56 HydrophobicContact CG-CE3 3.97Å; K52-W56 HydrophobicContact CG-CG 4.08Å; K52-W56 HydrophobicContact CG-CZ2 4.4Å; K52-W56 HydrophobicContact CG-CZ3 4.45Å; K52-F135 HydrophobicContact CB-CE2 4.16Å; K52-F135 VanDerWaalsContact O-CE2 3.23Å; K52-F135 WeakPolarHBondContact O-CE2 3.24Å; K52-F135 WeakPolarHBondContact O-CZ 3.47Å; K52-R139 PolarHBondContact O-NH1 3.13Å; K52-R139 PolarHBondContact O-NH2 2.78Å; K52-D225 WeakPolarHBondContact CD-OD1 3.25Å; K52-D225 PolarHBondContact N-OD2 2.98Å; K52-D225 VanDerWaalsContact NZ-CG 3.35Å; K52-D225 IonicContact NZ-OD1 3.7Å; K52-D225 PolarHBondContact NZ-OD1 2.92Å; K52-F227 HydrophobicContact CD-CD1 4.02Å; K52-D228 IonicContact NZ-OD1 2.6Å; K52-D228 PolarHBondContact NZ-OD1 2.9Å; K52-D228 IonicContact NZ-OD2 2.85Å; K52-D228 PolarHBondContact NZ-OD2 3.06Å
53	N	92.6	Very high	76.7	Confident	88 Å²	88	87.3 Å²	87.3	47%	0.471	47%	0.472	S	S	.	.			trans	-76.7	175.3	179.8	63.3	38.2	0	0	0	112.3	S51 R55 W56 L57 F135	S51-N53 PolarHBondContact O-N 3.03Å; N53-R55 PolarHBondContact O-N 2.87Å; N53-R55 WeakPolarHBondContact OD1-CA 3.46Å; N53-R55 WeakPolarHBondContact OD1-CB 3.23Å; N53-R55 PolarHBondContact OD1-N 2.94Å; N53-W56 WeakPolarHBondContact O-CB 3.06Å; N53-W56 PolarHBondContact O-N 3.18Å; N53-W56 VanDerWaalsContact O-N 3.09Å; N53-W56 PolarHBondContact OD1-N 3.18Å; N53-L57 PolarHBondContact O-N 3.4Å; N53-F135 WeakPolarHBondContact O-CZ 3.34Å
54	V	94.3	Very high	78.8	Confident	72 Å²	72	84.1 Å²	84.1	44%	0.436	45%	0.445	S	S	.	.	H	α-helix	trans	-61.3	-29.8	179.9	69.3	0	0	0	0	112.9	L57 Y58 F136	V54-L57 WeakPolarHBondContact O-CB 3.19Å; V54-L57 PolarHBondContact O-N 2.79Å; V54-Y58 HydrophobicContact CG2-CD2 3.88Å; V54-Y58 HydrophobicContact CG2-CE2 3.42Å; V54-Y58 VanDerWaalsContact CG2-CE2 3.42Å; V54-Y58 WeakPolarHBondContact O-CD2 3.46Å; V54-Y58 PolarHBondContact O-N 2.68Å; V54-F136 HydrophobicContact CG2-CE1 4.36Å; V54-F136 HydrophobicContact CG2-CZ 4.19Å
55	R	95.2	Very high	81.1	Confident	176 Å²	176	87.3 Å²	87.3	66%	0.664	45%	0.45	S	S	*	.	H	α-helix	trans	-67.1	-38.8	174.7	-179.3	179.1	-70.6	139.1	-1.5	111.3	N53 L57 N59	N53-R55 PolarHBondContact O-N 2.87Å; N53-R55 WeakPolarHBondContact OD1-CA 3.46Å; N53-R55 WeakPolarHBondContact OD1-CB 3.23Å; N53-R55 PolarHBondContact OD1-N 2.94Å; R55-L57 VanDerWaalsContact C-N 3.28Å; R55-L57 PolarHBondContact O-N 3.06Å; R55-N59 WeakPolarHBondContact O-CB 3.31Å; R55-N59 PolarHBondContact O-N 2.8Å; R55-N59 PolarHBondContact O-OD1 3.05Å
56	W	96.2	Very high	83.6	Confident	73 Å²	73	82.7 Å²	82.7	28%	0.277	43%	0.428	S	S	.	.	H	α-helix	trans	-58.3	-43	172.6	175.2	92.2	0	0	0	111.2	K52 N53 T60 F70 F135 F227	K52-W56 HydrophobicContact CB-CB 4.3Å; K52-W56 HydrophobicContact CB-CD2 3.74Å; K52-W56 HydrophobicContact CB-CE3 3.68Å; K52-W56 HydrophobicContact CB-CG 4Å; K52-W56 HydrophobicContact CB-CZ3 4.39Å; K52-W56 HydrophobicContact CD-CD2 3.67Å; K52-W56 HydrophobicContact CD-CE3 3.62Å; K52-W56 HydrophobicContact CD-CH2 3.6Å; K52-W56 HydrophobicContact CD-CZ2 3.6Å; K52-W56 HydrophobicContact CD-CZ3 3.6Å; K52-W56 HydrophobicContact CG-CD2 3.71Å; K52-W56 HydrophobicContact CG-CE3 3.97Å; K52-W56 HydrophobicContact CG-CG 4.08Å; K52-W56 HydrophobicContact CG-CZ2 4.4Å; K52-W56 HydrophobicContact CG-CZ3 4.45Å; N53-W56 WeakPolarHBondContact O-CB 3.06Å; N53-W56 PolarHBondContact O-N 3.18Å; N53-W56 VanDerWaalsContact O-N 3.09Å; N53-W56 PolarHBondContact OD1-N 3.18Å; W56-T60 HydrophobicContact CH2-CG2 4.11Å; W56-T60 HydrophobicContact CZ2-CG2 3.9Å; W56-T60 VanDerWaalsContact O-CB 3.25Å; W56-T60 WeakPolarHBondContact O-CB 3.25Å; W56-T60 PolarHBondContact O-N 3.29Å; W56-T60 PolarHBondContact O-OG1 3.38Å; W56-F70 AromaticContact CH2-CE2 3.79Å; W56-F70 HydrophobicContact CH2-CE2 3.79Å; W56-F70 HydrophobicContact CH2-CZ 4.04Å; W56-F70 HydrophobicContact CZ2-CE2 4.28Å; W56-F135 HydrophobicContact CE3-CE2 4.25Å; W56-F227 HydrophobicContact CH2-CD1 4.28Å; W56-F227 AromaticContact CH2-CE1 3.8Å; W56-F227 HydrophobicContact CH2-CE1 3.8Å; W56-F227 HydrophobicContact CZ3-CD1 4.01Å; W56-F227 AromaticContact CZ3-CE1 3.67Å; W56-F227 HydrophobicContact CZ3-CE1 3.67Å
57	L	96.8	Very high	86.2	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.005	39%	0.394	C	S	.	.	H	α-helix	trans	-59.2	-55.9	-179.7	172.6	67.7	0	0	0	111.1	N53 V54 R55 N59 T60 V61 V131 E132 F135 F136	N53-L57 PolarHBondContact O-N 3.4Å; V54-L57 WeakPolarHBondContact O-CB 3.19Å; V54-L57 PolarHBondContact O-N 2.79Å; R55-L57 VanDerWaalsContact C-N 3.28Å; R55-L57 PolarHBondContact O-N 3.06Å; L57-N59 VanDerWaalsContact C-N 3.33Å; L57-N59 PolarHBondContact O-N 3.26Å; L57-T60 PolarHBondContact O-N 3.34Å; L57-V61 HydrophobicContact CD1-CG2 4.46Å; L57-V61 PolarHBondContact O-N 3.43Å; L57-V131 HydrophobicContact CD1-CG1 3.91Å; L57-E132 HydrophobicContact CD2-CB 4.47Å; L57-E132 HydrophobicContact CD2-CG 4.12Å; L57-F135 HydrophobicContact CB-CD2 4.12Å; L57-F135 HydrophobicContact CB-CE1 4.43Å; L57-F135 HydrophobicContact CB-CE2 3.98Å; L57-F135 HydrophobicContact CB-CG 4.38Å; L57-F135 HydrophobicContact CB-CZ 4.16Å; L57-F135 HydrophobicContact CD1-CB 4.1Å; L57-F135 HydrophobicContact CD1-CD2 4.17Å; L57-F135 HydrophobicContact CD1-CG 4.14Å; L57-F135 HydrophobicContact CD2-CB 4.07Å; L57-F135 HydrophobicContact CD2-CD1 3.64Å; L57-F135 HydrophobicContact CD2-CD2 4.34Å; L57-F135 HydrophobicContact CD2-CE1 4.11Å; L57-F135 HydrophobicContact CD2-CG 3.77Å; L57-F135 HydrophobicContact CG-CD2 4.45Å; L57-F135 HydrophobicContact CG-CG 4.33Å; L57-F136 HydrophobicContact CD2-CE2 4.22Å; L57-F136 HydrophobicContact CD2-CZ 4.34Å
58	Y	95.6	Very high	88.5	Confident	88 Å²	88	71.7 Å²	71.7	35%	0.345	36%	0.364	S	S	.	.	H	α-helix	trans	-69.8	-29.5	-175.2	-65.9	-50.8	0	0	0	113.4	V54 E62 E132	V54-Y58 HydrophobicContact CG2-CD2 3.88Å; V54-Y58 HydrophobicContact CG2-CE2 3.42Å; V54-Y58 VanDerWaalsContact CG2-CE2 3.42Å; V54-Y58 WeakPolarHBondContact O-CD2 3.46Å; V54-Y58 PolarHBondContact O-N 2.68Å; Y58-E62 WeakPolarHBondContact O-CG 3.08Å; Y58-E132 HydrophobicContact CE1-CG 4.5Å
59	N	96.2	Very high	91.1	Very high	105 Å²	105	70.8 Å²	70.8	56%	0.561	36%	0.356	S	S	*	.	H	α-helix	trans	-74.9	-25.9	173.3	-67.7	3.9	0	0	0	112.9	R55 L57	R55-N59 WeakPolarHBondContact O-CB 3.31Å; R55-N59 PolarHBondContact O-N 2.8Å; R55-N59 PolarHBondContact O-OD1 3.05Å; L57-N59 VanDerWaalsContact C-N 3.33Å; L57-N59 PolarHBondContact O-N 3.26Å
60	T	95.9	Very high	93.2	Very high	48 Å²	48	69 Å²	69	29%	0.294	34%	0.341	S	S	.	.	H	α-helix	trans	-89.3	-32.1	-178.8	-55.2	0	0	0	0	111.6	W56 L57 F70	W56-T60 HydrophobicContact CH2-CG2 4.11Å; W56-T60 HydrophobicContact CZ2-CG2 3.9Å; W56-T60 VanDerWaalsContact O-CB 3.25Å; W56-T60 WeakPolarHBondContact O-CB 3.25Å; W56-T60 PolarHBondContact O-N 3.29Å; W56-T60 PolarHBondContact O-OG1 3.38Å; L57-T60 PolarHBondContact O-N 3.34Å; T60-F70 HydrophobicContact CG2-CD2 4.03Å; T60-F70 HydrophobicContact CG2-CE2 4.46Å
61	V	95.6	Very high	94.8	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.006	31%	0.31	C	S	.	.			trans	-126.5	63.2	-173.4	-167.9	0	0	0	0	109.4	L57 D63 A67 F70 Q128 V131	L57-V61 HydrophobicContact CD1-CG2 4.46Å; L57-V61 PolarHBondContact O-N 3.43Å; V61-D63 VanDerWaalsContact C-N 3.32Å; V61-A67 HydrophobicContact CG1-CB 3.46Å; V61-A67 VanDerWaalsContact CG1-CB 3.46Å; V61-F70 HydrophobicContact CG2-CG 4.46Å; V61-Q128 HydrophobicContact CG1-CB 4.34Å; V61-Q128 HydrophobicContact CG1-CG 4.13Å; V61-Q128 PolarHBondContact O-NE2 3.24Å; V61-Q128 VanDerWaalsContact O-NE2 3.12Å; V61-V131 HydrophobicContact CG1-CB 4.43Å; V61-V131 HydrophobicContact CG1-CG1 4.48Å; V61-V131 HydrophobicContact CG2-CG1 3.9Å
62	E	94.9	Very high	95.6	Very high	131 Å²	131	62.6 Å²	62.6	61%	0.612	29%	0.294	S	S	*	.	S	Bend	trans	-69.5	-32.4	-176.8	-67	-179.5	176.5	0	0	112.1	Y58 T66 Q128	Y58-E62 WeakPolarHBondContact O-CG 3.08Å; E62-T66 PolarHBondContact N-OG1 3.26Å; E62-Q128 PolarHBondContact O-NE2 3.05Å
63	D	94.8	Very high	95.8	Very high	68 Å²	68	67.6 Å²	67.6	36%	0.364	32%	0.318	S	S	.	.	S	Bend	trans	-147.4	-177.6	-175.5	64.4	28.9	0	0	0	112.6	V61 E65 T66 A67	V61-D63 VanDerWaalsContact C-N 3.32Å; D63-E65 VanDerWaalsContact C-N 3.33Å; D63-E65 PolarHBondContact O-N 3.43Å; D63-E65 PolarHBondContact OD1-N 3.28Å; D63-T66 PolarHBondContact N-OG1 3.21Å; D63-T66 PolarHBondContact O-OG1 3.46Å; D63-T66 WeakPolarHBondContact OD1-CB 3.32Å; D63-T66 WeakPolarHBondContact OD1-CG2 3.42Å; D63-T66 PolarHBondContact OD1-N 2.99Å; D63-T66 PolarHBondContact OD1-OG1 2.89Å; D63-A67 WeakPolarHBondContact O-CB 3.3Å; D63-A67 PolarHBondContact O-N 3.26Å; D63-A67 VanDerWaalsContact O-N 3.08Å
64	E	95	Very high	96	Very high	42 Å²	42	66.6 Å²	66.6	20%	0.196	31%	0.31	C	S	.	.	H	α-helix	trans	-69.4	-29.1	-178.7	-174.3	70.7	175.1	0	0	112.6	V68 M97 K126 F127 Q128	E64-V68 WeakPolarHBondContact O-CG2 3.48Å; E64-V68 PolarHBondContact O-N 2.6Å; E64-V68 VanDerWaalsContact O-N 3.1Å; E64-M97 HydrophobicContact CG-CE 3.38Å; E64-K126 VanDerWaalsContact OE2-CB 3.26Å; E64-K126 WeakPolarHBondContact OE2-CB 3.27Å; E64-F127 WeakPolarHBondContact OE1-CD2 3.5Å; E64-F127 PolarHBondContact OE1-N 2.95Å; E64-F127 PolarHBondContact OE2-N 2.92Å; E64-Q128 PolarHBondContact OE2-N 3.4Å
65	E	95	Very high	96.1	Very high	157 Å²	157	64.4 Å²	64.4	73%	0.734	30%	0.301	S	S	*	.	H	α-helix	trans	-74.1	-47.4	-179.2	-178.2	170.7	177.9	0	0	111.2	D63 A67 V68 K69	D63-E65 VanDerWaalsContact C-N 3.33Å; D63-E65 PolarHBondContact O-N 3.43Å; D63-E65 PolarHBondContact OD1-N 3.28Å; E65-A67 VanDerWaalsContact C-N 3.29Å; E65-A67 PolarHBondContact O-N 2.96Å; E65-V68 PolarHBondContact O-N 2.71Å; E65-K69 PolarHBondContact O-N 3.3Å
66	T	96.3	Very high	96.2	Very high	44 Å²	44	56.1 Å²	56.1	27%	0.27	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-38.9	172.7	51.8	0	0	0	0	111.3	E62 D63 K69 F70	E62-T66 PolarHBondContact N-OG1 3.26Å; D63-T66 PolarHBondContact N-OG1 3.21Å; D63-T66 PolarHBondContact O-OG1 3.46Å; D63-T66 WeakPolarHBondContact OD1-CB 3.32Å; D63-T66 WeakPolarHBondContact OD1-CG2 3.42Å; D63-T66 PolarHBondContact OD1-N 2.99Å; D63-T66 PolarHBondContact OD1-OG1 2.89Å; T66-K69 PolarHBondContact O-N 3.42Å; T66-F70 VanDerWaalsContact O-CB 3.29Å; T66-F70 WeakPolarHBondContact O-CB 3.25Å; T66-F70 PolarHBondContact O-N 3.09Å
67	A	97.4	Very high	96.1	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-46.2	172.7	0	0	0	0	0	112.9	V61 D63 E65 F70 L71 F127 Q128	V61-A67 HydrophobicContact CG1-CB 3.46Å; V61-A67 VanDerWaalsContact CG1-CB 3.46Å; D63-A67 WeakPolarHBondContact O-CB 3.3Å; D63-A67 PolarHBondContact O-N 3.26Å; D63-A67 VanDerWaalsContact O-N 3.08Å; E65-A67 VanDerWaalsContact C-N 3.29Å; E65-A67 PolarHBondContact O-N 2.96Å; A67-F70 PolarHBondContact O-N 2.85Å; A67-L71 WeakPolarHBondContact O-CB 3.33Å; A67-L71 VanDerWaalsContact O-CG 3.28Å; A67-L71 WeakPolarHBondContact O-CG 3.45Å; A67-L71 PolarHBondContact O-N 3.13Å; A67-F127 HydrophobicContact CB-CB 3.94Å; A67-Q128 HydrophobicContact CB-CB 4.08Å
68	V	96.4	Very high	96	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.03	26%	0.26	C	S	.	.	H	α-helix	trans	-65.1	-42	177.7	168.4	0	0	0	0	111.2	E64 E65 L71 R72 L77 M97 I112 F127	E64-V68 WeakPolarHBondContact O-CG2 3.48Å; E64-V68 PolarHBondContact O-N 2.6Å; E64-V68 VanDerWaalsContact O-N 3.1Å; E65-V68 PolarHBondContact O-N 2.71Å; V68-L71 PolarHBondContact O-N 2.97Å; V68-R72 WeakPolarHBondContact O-CG 3.35Å; V68-R72 PolarHBondContact O-N 2.9Å; V68-L77 HydrophobicContact CG1-CD1 4.06Å; V68-M97 HydrophobicContact CG2-CE 3.6Å; V68-M97 HydrophobicContact CG2-SD 4.05Å; V68-I112 HydrophobicContact CG1-CD1 3.86Å; V68-I112 HydrophobicContact CG2-CD1 3.87Å; V68-F127 HydrophobicContact CG2-CB 4.11Å; V68-F127 HydrophobicContact CG2-CD2 3.41Å; V68-F127 VanDerWaalsContact CG2-CD2 3.41Å; V68-F127 HydrophobicContact CG2-CE2 3.99Å; V68-F127 HydrophobicContact CG2-CG 3.92Å
69	K	95.8	Very high	95.9	Very high	128 Å²	128	52.8 Å²	52.8	56%	0.557	27%	0.27	S	S	*	.	H	α-helix	trans	-60.8	-49.9	176.1	-175	-178.7	174.4	-172.5	0	111	E65 T66 L71 R72 E73	E65-K69 PolarHBondContact O-N 3.3Å; T66-K69 PolarHBondContact O-N 3.42Å; K69-L71 VanDerWaalsContact C-N 3.34Å; K69-L71 PolarHBondContact O-N 3.04Å; K69-R72 WeakPolarHBondContact O-CB 3.43Å; K69-R72 PolarHBondContact O-N 3.49Å; K69-R72 VanDerWaalsContact O-N 3.12Å; K69-E73 WeakPolarHBondContact CE-OE1 3.44Å; K69-E73 WeakPolarHBondContact O-CG 3.45Å; K69-E73 PolarHBondContact O-N 3.22Å
70	F	97.2	Very high	95.7	Very high	12 Å²	12	55.5 Å²	55.5	5%	0.053	28%	0.279	C	S	.	.	H	α-helix	trans	-55.1	-47.9	176.2	173.3	-98.8	0	0	0	111.9	W56 T60 V61 T66 A67 R72 E73 K74 V131 F227 L231	W56-F70 AromaticContact CH2-CE2 3.79Å; W56-F70 HydrophobicContact CH2-CE2 3.79Å; W56-F70 HydrophobicContact CH2-CZ 4.04Å; W56-F70 HydrophobicContact CZ2-CE2 4.28Å; T60-F70 HydrophobicContact CG2-CD2 4.03Å; T60-F70 HydrophobicContact CG2-CE2 4.46Å; V61-F70 HydrophobicContact CG2-CG 4.46Å; T66-F70 VanDerWaalsContact O-CB 3.29Å; T66-F70 WeakPolarHBondContact O-CB 3.25Å; T66-F70 PolarHBondContact O-N 3.09Å; A67-F70 PolarHBondContact O-N 2.85Å; F70-R72 VanDerWaalsContact C-N 3.31Å; F70-R72 PolarHBondContact O-N 2.75Å; F70-E73 PolarHBondContact O-N 2.71Å; F70-K74 HydrophobicContact CD1-CG 4.43Å; F70-K74 HydrophobicContact CD2-CG 4.43Å; F70-K74 HydrophobicContact CE1-CG 3.99Å; F70-K74 HydrophobicContact CE2-CD 4.4Å; F70-K74 HydrophobicContact CE2-CG 3.99Å; F70-K74 HydrophobicContact CZ-CD 4.27Å; F70-K74 HydrophobicContact CZ-CG 3.75Å; F70-K74 WeakPolarHBondContact O-CB 3.46Å; F70-K74 WeakPolarHBondContact O-CG 3.44Å; F70-K74 PolarHBondContact O-N 2.8Å; F70-V131 HydrophobicContact CD1-CG1 4.33Å; F70-V131 HydrophobicContact CD1-CG2 4.13Å; F70-V131 HydrophobicContact CE1-CG1 4.16Å; F70-V131 HydrophobicContact CE1-CG2 4.43Å; F70-F227 HydrophobicContact CE1-CE1 4.14Å; F70-F227 AromaticContact CE1-CZ 3.94Å; F70-F227 HydrophobicContact CE1-CZ 3.94Å; F70-F227 AromaticContact CZ-CE1 3.68Å; F70-F227 HydrophobicContact CZ-CE1 3.68Å; F70-F227 AromaticContact CZ-CZ 3.97Å; F70-F227 HydrophobicContact CZ-CZ 3.97Å; F70-L231 HydrophobicContact CE1-CD1 3.88Å; F70-L231 HydrophobicContact CZ-CD1 3.74Å
71	L	97.5	Very high	95.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.7	-30.4	179.5	-70.8	173.5	0	0	0	113.2	A67 V68 K69 G75 L76 L77 F118 F127 V131 M134	A67-L71 WeakPolarHBondContact O-CB 3.33Å; A67-L71 VanDerWaalsContact O-CG 3.28Å; A67-L71 WeakPolarHBondContact O-CG 3.45Å; A67-L71 PolarHBondContact O-N 3.13Å; V68-L71 PolarHBondContact O-N 2.97Å; K69-L71 VanDerWaalsContact C-N 3.34Å; K69-L71 PolarHBondContact O-N 3.04Å; L71-G75 PolarHBondContact O-N 2.7Å; L71-L76 HydrophobicContact CD2-CB 4.29Å; L71-L76 HydrophobicContact CD2-CD1 3.81Å; L71-L76 PolarHBondContact O-N 2.96Å; L71-L77 HydrophobicContact CB-CD1 3.66Å; L71-L77 HydrophobicContact CB-CG 3.84Å; L71-L77 HydrophobicContact CD1-CD1 4.22Å; L71-L77 PolarHBondContact O-N 2.72Å; L71-F118 HydrophobicContact CD1-CE1 4.45Å; L71-F118 HydrophobicContact CD1-CE2 4.05Å; L71-F118 HydrophobicContact CD1-CZ 3.87Å; L71-F118 HydrophobicContact CD2-CE2 4.15Å; L71-F118 HydrophobicContact CD2-CZ 3.75Å; L71-F118 HydrophobicContact CG-CZ 4.43Å; L71-F127 HydrophobicContact CD1-CB 3.97Å; L71-F127 HydrophobicContact CD1-CD1 3.36Å; L71-F127 HydrophobicContact CD1-CE1 4.12Å; L71-F127 HydrophobicContact CD1-CG 3.99Å; L71-V131 HydrophobicContact CD1-CG2 4.03Å; L71-V131 HydrophobicContact CD2-CG2 3.81Å; L71-V131 HydrophobicContact CG-CG2 3.87Å; L71-M134 HydrophobicContact CD2-CE 4.04Å
72	R	96	Very high	95.3	Very high	44 Å²	44	57.8 Å²	57.8	17%	0.166	29%	0.288	C	S	.	.	H	α-helix	trans	-70	-44.4	171.2	-77	-177.6	-179.6	128.3	12.5	112	V68 K69 F70 K74 G75 L77 H78 L92 G96	V68-R72 WeakPolarHBondContact O-CG 3.35Å; V68-R72 PolarHBondContact O-N 2.9Å; K69-R72 WeakPolarHBondContact O-CB 3.43Å; K69-R72 PolarHBondContact O-N 3.49Å; K69-R72 VanDerWaalsContact O-N 3.12Å; F70-R72 VanDerWaalsContact C-N 3.31Å; F70-R72 PolarHBondContact O-N 2.75Å; R72-K74 PolarHBondContact O-N 3.4Å; R72-G75 WeakPolarHBondContact O-CA 3.38Å; R72-G75 PolarHBondContact O-N 3Å; R72-L77 HydrophobicContact CG-CB 3.73Å; R72-L77 HydrophobicContact CG-CD1 4.38Å; R72-H78 PolarHBondContact NE-O 2.96Å; R72-L92 VanDerWaalsContact NH2-CD1 3.27Å; R72-L92 VanDerWaalsContact NH2-CD2 3.26Å; R72-G96 PolarHBondContact NH2-O 2.75Å
73	E	96.5	Very high	95.2	Very high	136 Å²	136	51.7 Å²	51.7	64%	0.636	26%	0.26	S	S	*	.	H	α-helix	trans	-60.9	-35.7	176.3	-72.4	173.1	178.9	0	0	111.6	K69 F70 G75	K69-E73 WeakPolarHBondContact CE-OE1 3.44Å; K69-E73 WeakPolarHBondContact O-CG 3.45Å; K69-E73 PolarHBondContact O-N 3.22Å; F70-E73 PolarHBondContact O-N 2.71Å; E73-G75 PolarHBondContact O-N 3.36Å
74	K	97.1	Very high	94.9	Very high	68 Å²	68	50.4 Å²	50.4	30%	0.296	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-1	171.9	-66.7	-64.7	-166.4	173.9	0	114.2	F70 R72 L76 D228 L231	F70-K74 HydrophobicContact CD1-CG 4.43Å; F70-K74 HydrophobicContact CD2-CG 4.43Å; F70-K74 HydrophobicContact CE1-CG 3.99Å; F70-K74 HydrophobicContact CE2-CD 4.4Å; F70-K74 HydrophobicContact CE2-CG 3.99Å; F70-K74 HydrophobicContact CZ-CD 4.27Å; F70-K74 HydrophobicContact CZ-CG 3.75Å; F70-K74 WeakPolarHBondContact O-CB 3.46Å; F70-K74 WeakPolarHBondContact O-CG 3.44Å; F70-K74 PolarHBondContact O-N 2.8Å; R72-K74 PolarHBondContact O-N 3.4Å; K74-L76 HydrophobicContact CB-CD1 4.31Å; K74-L76 HydrophobicContact CB-CG 4.27Å; K74-L76 PolarHBondContact O-N 3.11Å; K74-D228 IonicContact NZ-OD1 3.89Å; K74-D228 PolarHBondContact NZ-OD1 3.14Å; K74-D228 IonicContact NZ-OD2 2.71Å; K74-L231 HydrophobicContact CD-CD1 4.22Å; K74-L231 HydrophobicContact CG-CD1 4.14Å
75	G	96.5	Very high	94.6	Very high	25 Å²	25	52.6 Å²	52.6	26%	0.258	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	6.4	-179.7	0	0	0	0	0	115.2	L71 R72 E73 L77 L235 P240	L71-G75 PolarHBondContact O-N 2.7Å; R72-G75 WeakPolarHBondContact O-CA 3.38Å; R72-G75 PolarHBondContact O-N 3Å; E73-G75 PolarHBondContact O-N 3.36Å; G75-L77 VanDerWaalsContact C-N 3.32Å; G75-L235 VanDerWaalsContact O-CD1 3.24Å; G75-L235 WeakPolarHBondContact O-CD1 3.32Å; G75-P240 WeakPolarHBondContact O-CD 3.42Å; G75-P240 VanDerWaalsContact O-CG 3.23Å; G75-P240 WeakPolarHBondContact O-CG 3.49Å
76	L	96.8	Very high	94.5	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.016	24%	0.244	C	C	.	.	S	Bend	trans	-81.3	-14.3	-177.9	-65	175.7	0	0	0	113.3	L71 K74 F118 L231 I234 L235	L71-L76 HydrophobicContact CD2-CB 4.29Å; L71-L76 HydrophobicContact CD2-CD1 3.81Å; L71-L76 PolarHBondContact O-N 2.96Å; K74-L76 HydrophobicContact CB-CD1 4.31Å; K74-L76 HydrophobicContact CB-CG 4.27Å; K74-L76 PolarHBondContact O-N 3.11Å; L76-F118 HydrophobicContact CB-CE2 3.97Å; L76-L231 HydrophobicContact CD1-CB 4.17Å; L76-L231 HydrophobicContact CD1-CD2 3.62Å; L76-L231 HydrophobicContact CD1-CG 4.36Å; L76-I234 HydrophobicContact CD2-CB 3.93Å; L76-I234 HydrophobicContact CD2-CG2 3.63Å; L76-L235 HydrophobicContact CD2-CB 3.83Å
77	L	95.7	Very high	94.3	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	25%	0.253	C	S	.	.	S	Bend	trans	-120.2	154.4	168.5	-67.5	177.3	0	0	0	109.5	V68 L71 R72 G75 S79 I112 T116 F118 F127	V68-L77 HydrophobicContact CG1-CD1 4.06Å; L71-L77 HydrophobicContact CB-CD1 3.66Å; L71-L77 HydrophobicContact CB-CG 3.84Å; L71-L77 HydrophobicContact CD1-CD1 4.22Å; L71-L77 PolarHBondContact O-N 2.72Å; R72-L77 HydrophobicContact CG-CB 3.73Å; R72-L77 HydrophobicContact CG-CD1 4.38Å; G75-L77 VanDerWaalsContact C-N 3.32Å; L77-S79 PolarHBondContact O-N 3.11Å; L77-I112 HydrophobicContact CD1-CD1 4.11Å; L77-T116 HydrophobicContact CD2-CG2 4.05Å; L77-F118 HydrophobicContact CD2-CD2 3.79Å; L77-F118 HydrophobicContact CD2-CE2 4.29Å; L77-F127 HydrophobicContact CD1-CD1 4.49Å; L77-F127 HydrophobicContact CD1-CE1 4.1Å; L77-F127 HydrophobicContact CD1-CZ 4.19Å; L77-F127 HydrophobicContact CD2-CE1 3.83Å; L77-F127 HydrophobicContact CD2-CZ 3.97Å; L77-F127 HydrophobicContact CG-CE1 4.46Å
78	H	94.6	Very high	94.1	Very high	10 Å²	10	52.3 Å²	52.3	5%	0.046	28%	0.276	C	S	.	.			trans	-59.6	129.4	171.2	-67.1	-72.6	0	0	0	110.8	R72 W99 P240 R241	R72-H78 PolarHBondContact NE-O 2.96Å; H78-W99 HydrophobicContact CB-CZ2 3.96Å; H78-W99 WeakPolarHBondContact O-CZ2 3.15Å; H78-P240 VanDerWaalsContact CE1-C 3.5Å; H78-P240 WeakPolarHBondContact CE1-CB 3.43Å; H78-R241 PolarHBondContact CE1-O 2.59Å; H78-R241 VanDerWaalsContact CE1-O 3.27Å; H78-R241 PolarHBondContact NE2-O 2.71Å
79	S	92.9	Very high	94	Very high	80 Å²	80	55.4 Å²	55.4	56%	0.559	30%	0.302	S	S	*	.	S	Bend	trans	-87	-29.3	164.8	-58.8	0	0	0	0	111.6	L77 W99	L77-S79 PolarHBondContact O-N 3.11Å; S79-W99 WeakPolarHBondContact O-CH2 3.34Å
80	E	91.8	Very high	93.9	Very high	162 Å²	162	49.8 Å²	49.8	76%	0.757	28%	0.278	S	S	*	.	S	Bend	trans	-139	153.7	175.4	-64.8	-178.8	-175.8	0	0	109.8
81	R	90.9	Very high	93.8	Very high	7 Å²	7	57.7 Å²	57.7	3%	0.026	31%	0.308	C	S	.	.			trans	-154.5	138.4	-177.2	-170	174.1	-167.9	141.9	16.1	113.1	M90 W99 S111 R114	R81-M90 HydrophobicContact CG-SD 4.28Å; R81-M90 PolarHBondContact O-N 3.21Å; R81-W99 HydrophobicContact CB-CD2 3.79Å; R81-W99 HydrophobicContact CB-CE3 3.99Å; R81-W99 HydrophobicContact CB-CG 4.26Å; R81-W99 HydrophobicContact CB-CH2 4.38Å; R81-W99 HydrophobicContact CB-CZ2 4.19Å; R81-W99 HydrophobicContact CB-CZ3 4.27Å; R81-S111 PolarHBondContact NH1-O 2.97Å; R81-R114 VanDerWaalsContact CZ-O 3.27Å; R81-R114 PolarHBondContact NH1-O 3.36Å; R81-R114 PolarHBondContact NH2-O 3.17Å
82	L	92.5	Very high	93.7	Very high	90 Å²	90	60.6 Å²	60.6	47%	0.471	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-90.5	146.8	166.3	-57	-176.1	0	0	0	111	P84 G87 A89	L82-P84 WeakPolarHBondContact O-CD 3.4Å; L82-G87 WeakPolarHBondContact CD2-O 3.16Å; L82-A89 HydrophobicContact CD2-CB 4.38Å
83	C	91.7	Very high	93.5	Very high	3 Å²	3	59.5 Å²	59.5	2%	0.02	33%	0.325	C	S	.	.			trans	-65.6	121.2	174.9	179.1	0	0	0	0	109	F85 C86 G87 E88 M90 C101	C83-F85 PolarHBondContact O-N 3.48Å; C83-C86 VanDerWaalsContact CB-SG 3.6Å; C83-C86 PolarHBondContact O-N 2.67Å; C83-G87 WeakPolarHBondContact O-CA 3.5Å; C83-G87 PolarHBondContact O-N 3.24Å; C83-E88 WeakPolarHBondContact CB-O 3.44Å; C83-E88 PolarHBondContact N-O 3.42Å; C83-M90 VanDerWaalsContact CA-SD 3.56Å; C83-M90 HydrophobicContact CB-CG 3.86Å; C83-M90 HydrophobicContact CB-SD 4.08Å; C83-C101 HydrophobicContact CB-CB 4.03Å
84	P	89	Confident	93	Very high	41 Å²	41	62.6 Å²	62.6	27%	0.266	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	2.9	-176.5	26.8	-32.9	0	0	0	113.7	L82 V110	L82-P84 WeakPolarHBondContact O-CD 3.4Å; P84-V110 HydrophobicContact CG-CG2 4.15Å
85	F	90	Very high	92.4	Very high	88 Å²	88	62.1 Å²	62.1	39%	0.386	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-26.2	-176.1	-58	-76.7	0	0	0	114.4	C83 R108	C83-F85 PolarHBondContact O-N 3.48Å; F85-R108 HydrophobicContact CD2-CB 4.29Å; F85-R108 HydrophobicContact CD2-CG 4.23Å; F85-R108 VanDerWaalsContact CE2-CD 3.41Å
86	C	92.9	Very high	92.1	Very high	45 Å²	45	61.8 Å²	61.8	30%	0.304	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131	-1	178.8	65.3	0	0	0	0	113.4	C83 E88 C101 C106	C83-C86 VanDerWaalsContact CB-SG 3.6Å; C83-C86 PolarHBondContact O-N 2.67Å; C86-E88 PolarHBondContact O-N 2.73Å; C86-E88 VanDerWaalsContact O-N 3.1Å; C86-C101 PolarHBondContact SG-SG 3.44Å; C86-C106 HydrophobicContact CB-CB 4.24Å
87	G	91.5	Very high	91.9	Very high	44 Å²	44	64.6 Å²	64.6	45%	0.454	36%	0.364	S	S	.	.			trans	76.4	-15	-179.7	0	0	0	0	0	115.2	L82 C83	L82-G87 WeakPolarHBondContact CD2-O 3.16Å; C83-G87 WeakPolarHBondContact O-CA 3.5Å; C83-G87 PolarHBondContact O-N 3.24Å
88	E	92.6	Very high	91.9	Very high	105 Å²	105	66.9 Å²	66.9	49%	0.491	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-65.4	145.5	-177.9	-68.8	-63.3	156.7	0	0	113.9	C83 C86 M90 N103	C83-E88 WeakPolarHBondContact CB-O 3.44Å; C83-E88 PolarHBondContact N-O 3.42Å; C86-E88 PolarHBondContact O-N 2.73Å; C86-E88 VanDerWaalsContact O-N 3.1Å; E88-M90 PolarHBondContact O-N 3.4Å; E88-N103 HydrophobicContact CB-CB 4.48Å; E88-N103 HydrophobicContact CG-CB 4.12Å
89	A	93.7	Very high	91.9	Very high	70 Å²	70	66.7 Å²	66.7	58%	0.579	38%	0.377	S	S	*	.	B	Isolated β-bridge	trans	-59.7	130.2	175.5	0	0	0	0	0	111.3	L82	L82-A89 HydrophobicContact CD2-CB 4.38Å
90	M	95	Very high	92	Very high	11 Å²	11	63.8 Å²	63.8	5%	0.054	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	153.2	177.2	-57.7	-175.3	85.5	0	0	110.5	R81 C83 E88 W99 C100 C101 R108 V110	R81-M90 HydrophobicContact CG-SD 4.28Å; R81-M90 PolarHBondContact O-N 3.21Å; C83-M90 VanDerWaalsContact CA-SD 3.56Å; C83-M90 HydrophobicContact CB-CG 3.86Å; C83-M90 HydrophobicContact CB-SD 4.08Å; E88-M90 PolarHBondContact O-N 3.4Å; M90-W99 HydrophobicContact CB-CB 4.08Å; M90-W99 HydrophobicContact CB-CE3 3.84Å; M90-W99 VanDerWaalsContact CE-C 3.43Å; M90-W99 HydrophobicContact CE-CB 3.71Å; M90-W99 WeakPolarHBondContact CE-O 3.1Å; M90-W99 HydrophobicContact SD-CB 3.75Å; M90-C100 WeakPolarHBondContact CA-O 3.41Å; M90-C100 WeakPolarHBondContact CB-O 3.5Å; M90-C101 HydrophobicContact CE-CB 4Å; M90-C101 VanDerWaalsContact CE-N 3.34Å; M90-C101 HydrophobicContact CG-CB 4.4Å; M90-R108 WeakPolarHBondContact CE-O 3.3Å; M90-V110 HydrophobicContact CE-CB 4.12Å; M90-V110 HydrophobicContact CE-CG2 3.97Å; M90-V110 HydrophobicContact SD-CG2 4.42Å
91	R	95.4	Very high	92.2	Very high	177 Å²	177	56.4 Å²	56.4	67%	0.668	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	151.7	168.9	-49.7	177.4	178.7	172.8	-1.3	110.2	G93 C100 F102	R91-G93 PolarHBondContact O-N 3.42Å; R91-C100 PolarHBondContact N-O 3.38Å; R91-C100 PolarHBondContact O-N 2.8Å; R91-F102 HydrophobicContact CB-CD2 4.21Å; R91-F102 HydrophobicContact CB-CE2 3.64Å; R91-F102 HydrophobicContact CB-CZ 4.43Å; R91-F102 HydrophobicContact CG-CD2 4.18Å; R91-F102 HydrophobicContact CG-CE2 4.07Å
92	L	94.7	Very high	92.3	Very high	61 Å²	61	62 Å²	62	32%	0.319	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	130.5	174	-69	167.2	0	0	0	109.9	R72 V98 W99 I112	R72-L92 VanDerWaalsContact NH2-CD1 3.27Å; R72-L92 VanDerWaalsContact NH2-CD2 3.26Å; L92-V98 WeakPolarHBondContact CA-O 3.37Å; L92-W99 HydrophobicContact CD1-CH2 4.29Å; L92-W99 HydrophobicContact CD2-CD2 3.74Å; L92-W99 HydrophobicContact CD2-CE3 3.95Å; L92-W99 HydrophobicContact CD2-CG 4.3Å; L92-W99 HydrophobicContact CD2-CH2 4.03Å; L92-W99 HydrophobicContact CD2-CZ2 3.83Å; L92-W99 HydrophobicContact CD2-CZ3 4.1Å; L92-W99 HydrophobicContact CG-CD2 4.38Å; L92-W99 HydrophobicContact CG-CE3 4.08Å; L92-W99 HydrophobicContact CG-CH2 3.88Å; L92-W99 HydrophobicContact CG-CZ2 4.19Å; L92-W99 HydrophobicContact CG-CZ3 3.84Å; L92-I112 HydrophobicContact CD2-CG2 3.73Å
93	G	91.6	Very high	92.4	Very high	21 Å²	21	59.8 Å²	59.8	22%	0.216	34%	0.336	C	S	.	.			trans	-74.3	178.4	171.8	0	0	0	0	0	112.1	R91 G95 G96 V98	R91-G93 PolarHBondContact O-N 3.42Å; G93-G95 PolarHBondContact O-N 3.41Å; G93-G96 PolarHBondContact O-N 2.74Å; G93-V98 PolarHBondContact N-O 2.83Å
94	H	85.3	Confident	92.5	Very high	202 Å²	202	64.3 Å²	64.3	94%	0.935	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	132.4	173.6	-174.5	-88.5	0	0	0	111.3	G96	H94-G96 VanDerWaalsContact C-N 3.33Å
95	G	85.3	Confident	92.8	Very high	58 Å²	58	67.5 Å²	67.5	60%	0.598	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	-0.2	-176.3	0	0	0	0	0	115.5	G93 M97	G93-G95 PolarHBondContact O-N 3.41Å; G95-M97 WeakPolarHBondContact O-CG 3.18Å; G95-M97 PolarHBondContact O-N 2.9Å
96	G	90.8	Very high	93	Very high	18 Å²	18	64.4 Å²	64.4	19%	0.186	38%	0.378	C	S	.	.	S	Bend	trans	69.8	5.8	168.2	0	0	0	0	0	116.6	R72 G93 H94	R72-G96 PolarHBondContact NH2-O 2.75Å; G93-G96 PolarHBondContact O-N 2.74Å; H94-G96 VanDerWaalsContact C-N 3.33Å
97	M	92.4	Very high	93	Very high	61 Å²	61	71 Å²	71	30%	0.3	40%	0.396	S	S	.	.	S	Bend	trans	-96.8	-10.8	-174.8	-67.4	-61.8	166.4	0	0	114.8	E64 V68 G95 I112 F127	E64-M97 HydrophobicContact CG-CE 3.38Å; V68-M97 HydrophobicContact CG2-CE 3.6Å; V68-M97 HydrophobicContact CG2-SD 4.05Å; G95-M97 WeakPolarHBondContact O-CG 3.18Å; G95-M97 PolarHBondContact O-N 2.9Å; M97-I112 VanDerWaalsContact C-CG2 3.45Å; M97-I112 WeakPolarHBondContact O-CG1 3.34Å; M97-I112 WeakPolarHBondContact O-CG2 3.41Å; M97-I112 PolarHBondContact O-N 3.3Å; M97-I112 HydrophobicContact SD-CD1 3.76Å; M97-I112 HydrophobicContact SD-CG1 4.39Å; M97-F127 HydrophobicContact CE-CD2 4.45Å; M97-F127 HydrophobicContact SD-CD2 4.19Å; M97-F127 HydrophobicContact SD-CE2 4.06Å
98	V	94.2	Very high	93.1	Very high	50 Å²	50	74.4 Å²	74.4	30%	0.303	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	128.8	-173.4	-180	0	0	0	0	109.4	L92 G93 K109 V110	L92-V98 WeakPolarHBondContact CA-O 3.37Å; G93-V98 PolarHBondContact N-O 2.83Å; V98-K109 HydrophobicContact CG1-CB 3.66Å; V98-K109 HydrophobicContact CG1-CD 4.34Å; V98-K109 HydrophobicContact CG1-CG 4.1Å; V98-V110 CarbonylContact C-O 3.52Å; V98-V110 WeakPolarHBondContact CA-O 3.49Å
99	W	95	Very high	93.2	Very high	7 Å²	7	77 Å²	77	3%	0.027	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	128	164.4	-68.3	102	0	0	0	109.6	H78 S79 R81 M90 L92 K109 V110	H78-W99 HydrophobicContact CB-CZ2 3.96Å; H78-W99 WeakPolarHBondContact O-CZ2 3.15Å; S79-W99 WeakPolarHBondContact O-CH2 3.34Å; R81-W99 HydrophobicContact CB-CD2 3.79Å; R81-W99 HydrophobicContact CB-CE3 3.99Å; R81-W99 HydrophobicContact CB-CG 4.26Å; R81-W99 HydrophobicContact CB-CH2 4.38Å; R81-W99 HydrophobicContact CB-CZ2 4.19Å; R81-W99 HydrophobicContact CB-CZ3 4.27Å; M90-W99 HydrophobicContact CB-CB 4.08Å; M90-W99 HydrophobicContact CB-CE3 3.84Å; M90-W99 VanDerWaalsContact CE-C 3.43Å; M90-W99 HydrophobicContact CE-CB 3.71Å; M90-W99 WeakPolarHBondContact CE-O 3.1Å; M90-W99 HydrophobicContact SD-CB 3.75Å; L92-W99 HydrophobicContact CD1-CH2 4.29Å; L92-W99 HydrophobicContact CD2-CD2 3.74Å; L92-W99 HydrophobicContact CD2-CE3 3.95Å; L92-W99 HydrophobicContact CD2-CG 4.3Å; L92-W99 HydrophobicContact CD2-CH2 4.03Å; L92-W99 HydrophobicContact CD2-CZ2 3.83Å; L92-W99 HydrophobicContact CD2-CZ3 4.1Å; L92-W99 HydrophobicContact CG-CD2 4.38Å; L92-W99 HydrophobicContact CG-CE3 4.08Å; L92-W99 HydrophobicContact CG-CH2 3.88Å; L92-W99 HydrophobicContact CG-CZ2 4.19Å; L92-W99 HydrophobicContact CG-CZ3 3.84Å; W99-K109 CarbonylContact O-C 3.44Å; W99-K109 VanDerWaalsContact O-CA 3.29Å; W99-K109 WeakPolarHBondContact O-CA 3.17Å; W99-V110 HydrophobicContact CB-CB 4.28Å; W99-V110 WeakPolarHBondContact CB-O 3.45Å; W99-V110 PolarHBondContact N-O 3.17Å; W99-V110 PolarHBondContact O-N 3.3Å
100	C	96.1	Very high	93.1	Very high	19 Å²	19	73.8 Å²	73.8	13%	0.128	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.3	178.8	-66.2	0	0	0	0	109.8	M90 R91 F102	M90-C100 WeakPolarHBondContact CA-O 3.41Å; M90-C100 WeakPolarHBondContact CB-O 3.5Å; R91-C100 PolarHBondContact N-O 3.38Å; R91-C100 PolarHBondContact O-N 2.8Å; C100-F102 HydrophobicContact CB-CD2 4.38Å; C100-F102 HydrophobicContact CB-CE2 3.67Å; C100-F102 HydrophobicContact CB-CZ 4.15Å; C100-F102 VanDerWaalsContact O-CD2 3.25Å; C100-F102 WeakPolarHBondContact O-CD2 3.22Å; C100-F102 WeakPolarHBondContact O-CE2 3.39Å
101	C	95.5	Very high	93	Very high	7 Å²	7	75.9 Å²	75.9	5%	0.047	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	126.3	168.3	-179.4	0	0	0	0	108.9	C83 C86 M90 R107 R108	C83-C101 HydrophobicContact CB-CB 4.03Å; C86-C101 PolarHBondContact SG-SG 3.44Å; M90-C101 HydrophobicContact CE-CB 4Å; M90-C101 VanDerWaalsContact CE-N 3.34Å; M90-C101 HydrophobicContact CG-CB 4.4Å; C101-R107 WeakPolarHBondContact O-CA 3.13Å; C101-R108 WeakPolarHBondContact CB-O 3.44Å; C101-R108 PolarHBondContact N-O 3.14Å
102	F	93.6	Very high	92.9	Very high	123 Å²	123	67.5 Å²	67.5	54%	0.539	36%	0.362	S	S	.	.			trans	-95.4	-2.6	-178.6	-73.9	-97.9	0	0	0	113.3	R91 C100 P104	R91-F102 HydrophobicContact CB-CD2 4.21Å; R91-F102 HydrophobicContact CB-CE2 3.64Å; R91-F102 HydrophobicContact CB-CZ 4.43Å; R91-F102 HydrophobicContact CG-CD2 4.18Å; R91-F102 HydrophobicContact CG-CE2 4.07Å; C100-F102 HydrophobicContact CB-CD2 4.38Å; C100-F102 HydrophobicContact CB-CE2 3.67Å; C100-F102 HydrophobicContact CB-CZ 4.15Å; C100-F102 VanDerWaalsContact O-CD2 3.25Å; C100-F102 WeakPolarHBondContact O-CD2 3.22Å; C100-F102 WeakPolarHBondContact O-CE2 3.39Å; F102-P104 VanDerWaalsContact O-CD 3.28Å; F102-P104 WeakPolarHBondContact O-CD 3.47Å; F102-P104 VanDerWaalsContact O-N 3.15Å
103	N	93.9	Very high	92.9	Very high	44 Å²	44	65.7 Å²	65.7	24%	0.235	35%	0.351	C	S	.	.			trans	-58	119.6	170.9	-177.4	-16.9	0	0	0	109.1	E88 S105 C106 R107	E88-N103 HydrophobicContact CB-CB 4.48Å; E88-N103 HydrophobicContact CG-CB 4.12Å; N103-S105 PolarHBondContact O-N 3.22Å; N103-S105 VanDerWaalsContact O-N 3.13Å; N103-S105 PolarHBondContact OD1-N 3.42Å; N103-S105 VanDerWaalsContact OD1-N 3.15Å; N103-S105 PolarHBondContact OD1-OG 3.19Å; N103-C106 HydrophobicContact CB-CB 3.95Å; N103-C106 PolarHBondContact O-N 2.89Å; N103-R107 PolarHBondContact O-N 2.92Å
104	P	94.7	Very high	92.9	Very high	98 Å²	98	67 Å²	67	64%	0.636	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-30.2	-175.5	-28.3	36	0	0	0	114.4	F102 R107	F102-P104 VanDerWaalsContact O-CD 3.28Å; F102-P104 WeakPolarHBondContact O-CD 3.47Å; F102-P104 VanDerWaalsContact O-N 3.15Å; P104-R107 PolarHBondContact O-NE 3.3Å; P104-R107 VanDerWaalsContact O-NE 3.12Å
105	S	94.8	Very high	93.1	Very high	108 Å²	108	57.4 Å²	57.4	76%	0.755	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-17.2	178.1	66.3	0	0	0	0	113.6	N103	N103-S105 PolarHBondContact O-N 3.22Å; N103-S105 VanDerWaalsContact O-N 3.13Å; N103-S105 PolarHBondContact OD1-N 3.42Å; N103-S105 VanDerWaalsContact OD1-N 3.15Å; N103-S105 PolarHBondContact OD1-OG 3.19Å
106	C	94.2	Very high	93.5	Very high	23 Å²	23	54.8 Å²	54.8	16%	0.155	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-59.7	-177.1	-169.4	0	0	0	0	112.3	C86 N103 R108	C86-C106 HydrophobicContact CB-CB 4.24Å; N103-C106 HydrophobicContact CB-CB 3.95Å; N103-C106 PolarHBondContact O-N 2.89Å; C106-R108 WeakPolarHBondContact O-CG 3.33Å; C106-R108 PolarHBondContact O-N 3.19Å
107	R	93.4	Very high	93.6	Very high	183 Å²	183	54.6 Å²	54.6	69%	0.691	27%	0.271	S	S	*	.			trans	48.9	17.3	-178.4	-57.2	-172.2	-173.3	-152.9	-1.8	116.8	C101 N103 P104	C101-R107 WeakPolarHBondContact O-CA 3.13Å; N103-R107 PolarHBondContact O-N 2.92Å; P104-R107 PolarHBondContact O-NE 3.3Å; P104-R107 VanDerWaalsContact O-NE 3.12Å
108	R	93.5	Very high	93.7	Very high	116 Å²	116	51.7 Å²	51.7	44%	0.438	26%	0.257	S	S	.	.			trans	-71.2	148.7	-173.9	-67.8	-178.6	-169.1	-141.1	14.2	111.9	F85 M90 C101 C106	F85-R108 HydrophobicContact CD2-CB 4.29Å; F85-R108 HydrophobicContact CD2-CG 4.23Å; F85-R108 VanDerWaalsContact CE2-CD 3.41Å; M90-R108 WeakPolarHBondContact CE-O 3.3Å; C101-R108 WeakPolarHBondContact CB-O 3.44Å; C101-R108 PolarHBondContact N-O 3.14Å; C106-R108 WeakPolarHBondContact O-CG 3.33Å; C106-R108 PolarHBondContact O-N 3.19Å
109	K	94.2	Very high	93.5	Very high	160 Å²	160	51.5 Å²	51.5	70%	0.696	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	136	177.2	-69.2	-177.3	-177.1	179.3	0	109.8	V98 W99	V98-K109 HydrophobicContact CG1-CB 3.66Å; V98-K109 HydrophobicContact CG1-CD 4.34Å; V98-K109 HydrophobicContact CG1-CG 4.1Å; W99-K109 CarbonylContact O-C 3.44Å; W99-K109 VanDerWaalsContact O-CA 3.29Å; W99-K109 WeakPolarHBondContact O-CA 3.17Å
110	V	91.8	Very high	92.5	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.1	-177.9	174.2	0	0	0	0	109.2	P84 M90 V98 W99 R114	P84-V110 HydrophobicContact CG-CG2 4.15Å; M90-V110 HydrophobicContact CE-CB 4.12Å; M90-V110 HydrophobicContact CE-CG2 3.97Å; M90-V110 HydrophobicContact SD-CG2 4.42Å; V98-V110 CarbonylContact C-O 3.52Å; V98-V110 WeakPolarHBondContact CA-O 3.49Å; W99-V110 HydrophobicContact CB-CB 4.28Å; W99-V110 WeakPolarHBondContact CB-O 3.45Å; W99-V110 PolarHBondContact N-O 3.17Å; W99-V110 PolarHBondContact O-N 3.3Å; V110-R114 HydrophobicContact CG1-CB 3.72Å; V110-R114 HydrophobicContact CG1-CG 4.08Å
111	S	92.7	Very high	91.3	Very high	54 Å²	54	55.1 Å²	55.1	38%	0.378	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	143.6	175	176.5	0	0	0	0	111.1	R81 R113 R114	R81-S111 PolarHBondContact NH1-O 2.97Å; S111-R113 PolarHBondContact O-N 3.41Å; S111-R113 VanDerWaalsContact O-N 3.09Å; S111-R113 PolarHBondContact OG-N 3.17Å; S111-R114 WeakPolarHBondContact O-CB 3.27Å; S111-R114 PolarHBondContact O-N 3.46Å
112	I	93.9	Very high	90.3	Very high	2 Å²	2	56 Å²	56	1%	0.01	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.1	173.2	60.5	164.2	0	0	0	113.2	V68 L77 L92 M97 T116 F127	V68-I112 HydrophobicContact CG1-CD1 3.86Å; V68-I112 HydrophobicContact CG2-CD1 3.87Å; L77-I112 HydrophobicContact CD1-CD1 4.11Å; L92-I112 HydrophobicContact CD2-CG2 3.73Å; M97-I112 VanDerWaalsContact C-CG2 3.45Å; M97-I112 WeakPolarHBondContact O-CG1 3.34Å; M97-I112 WeakPolarHBondContact O-CG2 3.41Å; M97-I112 PolarHBondContact O-N 3.3Å; M97-I112 HydrophobicContact SD-CD1 3.76Å; M97-I112 HydrophobicContact SD-CG1 4.39Å; I112-T116 WeakPolarHBondContact O-CG2 3.31Å; I112-F127 HydrophobicContact CD1-CD2 4.21Å; I112-F127 HydrophobicContact CD1-CE2 3.34Å; I112-F127 HydrophobicContact CD1-CZ 3.71Å; I112-F127 HydrophobicContact CG1-CE2 3.81Å; I112-F127 HydrophobicContact CG1-CZ 3.91Å
113	R	93.7	Very high	89.2	Confident	23 Å²	23	54 Å²	54	9%	0.087	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-29.4	176	-64.5	178.3	-175.1	-95.9	-8.7	113.5	S111 G115 T116 F118 E119 R122 L125 F127	S111-R113 PolarHBondContact O-N 3.41Å; S111-R113 VanDerWaalsContact O-N 3.09Å; S111-R113 PolarHBondContact OG-N 3.17Å; R113-G115 PolarHBondContact O-N 3.11Å; R113-T116 WeakPolarHBondContact O-CB 3.26Å; R113-T116 PolarHBondContact O-N 3.39Å; R113-T116 PolarHBondContact O-OG1 2.99Å; R113-F118 HydrophobicContact CB-CB 4.46Å; R113-F118 HydrophobicContact CG-CB 4.18Å; R113-E119 WeakPolarHBondContact O-CB 3.46Å; R113-E119 PolarHBondContact O-N 3.07Å; R113-R122 PolarHBondContact NH1-O 2.87Å; R113-R122 VanDerWaalsContact NH1-O 3.15Å; R113-L125 VanDerWaalsContact CZ-O 3.24Å; R113-L125 PolarHBondContact NH1-O 2.85Å; R113-L125 VanDerWaalsContact NH1-O 3.15Å; R113-L125 PolarHBondContact NH2-O 3.04Å; R113-F127 HydrophobicContact CG-CE1 4.19Å; R113-F127 HydrophobicContact CG-CE2 4.19Å; R113-F127 HydrophobicContact CG-CZ 3.45Å; R113-F127 VanDerWaalsContact CG-CZ 3.45Å
114	R	91.1	Very high	88.5	Confident	48 Å²	48	61.2 Å²	61.2	18%	0.181	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	130.9	-172.6	179.3	170.9	-177.7	167.9	-4.2	110.4	R81 V110 S111 T116 E119 A244	R81-R114 VanDerWaalsContact CZ-O 3.27Å; R81-R114 PolarHBondContact NH1-O 3.36Å; R81-R114 PolarHBondContact NH2-O 3.17Å; V110-R114 HydrophobicContact CG1-CB 3.72Å; V110-R114 HydrophobicContact CG1-CG 4.08Å; S111-R114 WeakPolarHBondContact O-CB 3.27Å; S111-R114 PolarHBondContact O-N 3.46Å; R114-T116 VanDerWaalsContact C-N 3.27Å; R114-E119 WeakPolarHBondContact CG-OE1 3.32Å; R114-A244 HydrophobicContact CG-CB 4.09Å; R114-A244 VanDerWaalsContact CZ-O 3.32Å; R114-A244 PolarHBondContact NE-O 3.35Å; R114-A244 PolarHBondContact NH2-O 2.9Å
115	G	89.9	Confident	88.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-2.7	-176.8	0	0	0	0	0	114.3	R113 E119 P240 R241	R113-G115 PolarHBondContact O-N 3.11Å; G115-E119 PolarHBondContact N-OE2 3.47Å; G115-P240 CarbonylContact O-C 3.57Å; G115-P240 WeakPolarHBondContact O-CA 3.47Å; G115-R241 PolarHBondContact O-N 3.35Å
116	T	94	Very high	88.3	Confident	4 Å²	4	58.6 Å²	58.6	3%	0.025	27%	0.274	C	S	.	.	S	Bend	trans	-106.3	171.4	-179.2	76	0	0	0	0	111.3	L77 I112 R113 R114 F118 E119 P240	L77-T116 HydrophobicContact CD2-CG2 4.05Å; I112-T116 WeakPolarHBondContact O-CG2 3.31Å; R113-T116 WeakPolarHBondContact O-CB 3.26Å; R113-T116 PolarHBondContact O-N 3.39Å; R113-T116 PolarHBondContact O-OG1 2.99Å; R114-T116 VanDerWaalsContact C-N 3.27Å; T116-F118 PolarHBondContact O-N 3.36Å; T116-F118 VanDerWaalsContact O-N 3.14Å; T116-F118 PolarHBondContact OG1-N 2.65Å; T116-E119 WeakPolarHBondContact O-CB 3.39Å; T116-E119 PolarHBondContact O-N 3.38Å; T116-P240 HydrophobicContact CG2-CB 4.18Å; T116-P240 HydrophobicContact CG2-CG 4.39Å
117	W	93.2	Very high	88.4	Confident	13 Å²	13	57.6 Å²	57.6	5%	0.049	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.8	169.6	-170.8	81.7	0	0	0	112.8	E119 R122 M134 W161 H164 L165 V168 I234 H238	W117-E119 VanDerWaalsContact C-N 3.33Å; W117-E119 PolarHBondContact O-N 3.37Å; W117-R122 PolarHBondContact O-NE 3.4Å; W117-R122 PolarHBondContact O-NH2 3.48Å; W117-M134 HydrophobicContact CZ3-SD 4.12Å; W117-W161 HydrophobicContact CH2-CE3 4.26Å; W117-W161 AromaticContact CH2-CZ3 3.88Å; W117-W161 HydrophobicContact CH2-CZ3 3.88Å; W117-W161 HydrophobicContact CZ3-CE3 4.4Å; W117-W161 HydrophobicContact CZ3-CH2 4.06Å; W117-W161 AromaticContact CZ3-CZ3 3.58Å; W117-W161 HydrophobicContact CZ3-CZ3 3.58Å; W117-H164 HydrophobicContact CH2-CB 4.39Å; W117-H164 HydrophobicContact CZ2-CB 3.9Å; W117-L165 HydrophobicContact CH2-CD2 3.78Å; W117-L165 HydrophobicContact CH2-CG 4.34Å; W117-L165 HydrophobicContact CZ2-CD2 4.25Å; W117-V168 HydrophobicContact CZ2-CG2 3.97Å; W117-I234 HydrophobicContact CB-CG2 3.71Å; W117-I234 HydrophobicContact CD2-CD1 4.49Å; W117-I234 HydrophobicContact CD2-CG2 3.78Å; W117-I234 HydrophobicContact CE3-CD1 4.27Å; W117-I234 HydrophobicContact CE3-CG2 4.17Å; W117-I234 HydrophobicContact CG-CG2 3.58Å; W117-I234 HydrophobicContact CH2-CD1 4.2Å; W117-I234 HydrophobicContact CZ2-CD1 4.41Å; W117-I234 HydrophobicContact CZ3-CD1 4.12Å; W117-H238 HydrophobicContact CB-CB 4.19Å; W117-H238 AromaticContact CD1-CD2 3.26Å; W117-H238 AromaticContact CD1-CG 3.66Å; W117-H238 HydrophobicContact CG-CB 4.35Å; W117-H238 AromaticContact NE1-CD2 3.54Å
118	F	93.9	Very high	88.5	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	3.9	178.2	-57.1	-80	0	0	0	114.7	L71 L76 L77 R113 T116 F127 A130 M134 W161	L71-F118 HydrophobicContact CD1-CE1 4.45Å; L71-F118 HydrophobicContact CD1-CE2 4.05Å; L71-F118 HydrophobicContact CD1-CZ 3.87Å; L71-F118 HydrophobicContact CD2-CE2 4.15Å; L71-F118 HydrophobicContact CD2-CZ 3.75Å; L71-F118 HydrophobicContact CG-CZ 4.43Å; L76-F118 HydrophobicContact CB-CE2 3.97Å; L77-F118 HydrophobicContact CD2-CD2 3.79Å; L77-F118 HydrophobicContact CD2-CE2 4.29Å; R113-F118 HydrophobicContact CB-CB 4.46Å; R113-F118 HydrophobicContact CG-CB 4.18Å; T116-F118 PolarHBondContact O-N 3.36Å; T116-F118 VanDerWaalsContact O-N 3.14Å; T116-F118 PolarHBondContact OG1-N 2.65Å; F118-F127 HydrophobicContact CB-CE1 3.89Å; F118-F127 HydrophobicContact CD1-CD1 4.41Å; F118-F127 HydrophobicContact CD1-CE1 4.21Å; F118-F127 AromaticContact CD2-CE1 3.96Å; F118-F127 HydrophobicContact CD2-CE1 3.96Å; F118-F127 HydrophobicContact CG-CD1 4.37Å; F118-F127 AromaticContact CG-CE1 3.76Å; F118-F127 HydrophobicContact CG-CE1 3.76Å; F118-A130 HydrophobicContact CD1-CB 4.44Å; F118-A130 HydrophobicContact CE1-CB 4.08Å; F118-M134 HydrophobicContact CE1-CE 4.09Å; F118-M134 HydrophobicContact CZ-CE 3.98Å; F118-W161 HydrophobicContact CD1-CH2 4.04Å; F118-W161 HydrophobicContact CE1-CH2 4.08Å
119	E	90.2	Very high	88.7	Confident	46 Å²	46	46.2 Å²	46.2	22%	0.215	23%	0.227	C	C	.	.			trans	-61.2	165.7	173.1	-168.5	156.4	-152.3	0	0	111.8	R113 R114 G115 T116 W117 R122 R241	R113-E119 WeakPolarHBondContact O-CB 3.46Å; R113-E119 PolarHBondContact O-N 3.07Å; R114-E119 WeakPolarHBondContact CG-OE1 3.32Å; G115-E119 PolarHBondContact N-OE2 3.47Å; T116-E119 WeakPolarHBondContact O-CB 3.39Å; T116-E119 PolarHBondContact O-N 3.38Å; W117-E119 VanDerWaalsContact C-N 3.33Å; W117-E119 PolarHBondContact O-N 3.37Å; E119-R122 PolarHBondContact O-N 2.91Å; E119-R122 VanDerWaalsContact O-N 3.07Å; E119-R241 IonicContact OE2-NH2 3.92Å
120	A	75	Confident	88.8	Confident	44 Å²	44	38.6 Å²	38.6	36%	0.364	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.2	133.4	179.2	0	0	0	0	0	111.4
121	P	70.6	Confident	89.1	Confident	58 Å²	58	38.4 Å²	38.4	38%	0.377	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	cis	-92.6	1.9	20.8	37.4	-27	0	0	0	113.9	N123 L251	P121-N123 PolarHBondContact O-N 2.96Å; P121-L251 HydrophobicContact CB-CD1 3.77Å; P121-L251 HydrophobicContact CG-CD1 3.49Å; P121-L251 VanDerWaalsContact CG-CD1 3.49Å; P121-L251 HydrophobicContact CG-CD2 3.93Å; P121-L251 HydrophobicContact CG-CG 4.28Å
122	R	73.9	Confident	89.3	Confident	25 Å²	25	36.8 Å²	36.8	9%	0.094	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-83.3	10	-172.7	-69.5	174.5	-68.9	-80.7	2	113.8	R113 W117 E119 K124 W161 H164	R113-R122 PolarHBondContact NH1-O 2.87Å; R113-R122 VanDerWaalsContact NH1-O 3.15Å; W117-R122 PolarHBondContact O-NE 3.4Å; W117-R122 PolarHBondContact O-NH2 3.48Å; E119-R122 PolarHBondContact O-N 2.91Å; E119-R122 VanDerWaalsContact O-N 3.07Å; R122-K124 VanDerWaalsContact C-N 3.34Å; R122-K124 PolarHBondContact O-N 3.34Å; R122-W161 HydrophobicContact CB-CZ2 4.13Å; R122-W161 HydrophobicContact CG-CZ2 4.29Å; R122-H164 PolarHBondContact NH1-CD2 2.98Å; R122-H164 PolarHBondContact NH1-CE1 3.48Å; R122-H164 VanDerWaalsContact NH1-CG 3.31Å; R122-H164 PolarHBondContact NH1-ND1 3.06Å; R122-H164 PolarHBondContact NH1-NE2 3.24Å; R122-H164 VanDerWaalsContact NH1-NE2 3.15Å
123	N	71.2	Confident	89.4	Confident	81 Å²	81	36.7 Å²	36.7	43%	0.433	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-81.4	-3	-168.9	68.3	-32.4	0	0	0	115.9	P121	P121-N123 PolarHBondContact O-N 2.96Å
124	K	79.6	Confident	89.6	Confident	196 Å²	196	35.6 Å²	35.6	85%	0.852	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-93	-16.7	-177.1	-62.4	-173.7	-179.4	-176.8	0	114.5	R122	R122-K124 VanDerWaalsContact C-N 3.34Å; R122-K124 PolarHBondContact O-N 3.34Å
125	L	90.9	Very high	89.9	Confident	24 Å²	24	33.4 Å²	33.4	13%	0.126	17%	0.167	C	C	.	.	S	Bend	trans	-94.4	136.4	-175.4	-167	74.7	0	0	0	110.5	R113 T129 A130 I133 L153 T157 W161	R113-L125 VanDerWaalsContact CZ-O 3.24Å; R113-L125 PolarHBondContact NH1-O 2.85Å; R113-L125 VanDerWaalsContact NH1-O 3.15Å; R113-L125 PolarHBondContact NH2-O 3.04Å; L125-T129 HydrophobicContact CD1-CG2 3.89Å; L125-T129 HydrophobicContact CD2-CG2 3.99Å; L125-T129 HydrophobicContact CG-CG2 4.16Å; L125-A130 HydrophobicContact CD2-CB 4.29Å; L125-I133 HydrophobicContact CD2-CD1 3.36Å; L125-L153 HydrophobicContact CD1-CD2 3.9Å; L125-T157 HydrophobicContact CD1-CG2 4.24Å; L125-W161 HydrophobicContact CB-CZ2 4.25Å; L125-W161 HydrophobicContact CD2-CD2 4.42Å; L125-W161 HydrophobicContact CD2-CZ2 3.71Å
126	K	94.2	Very high	90.2	Very high	128 Å²	128	34 Å²	34	56%	0.557	17%	0.169	S	C	*	.			trans	-48.5	143.3	168	-77.5	-172.6	-178	-176.7	0	111.5	E64 Q128 T129 A130	E64-K126 VanDerWaalsContact OE2-CB 3.26Å; E64-K126 WeakPolarHBondContact OE2-CB 3.27Å; K126-Q128 VanDerWaalsContact C-N 3.27Å; K126-Q128 PolarHBondContact O-N 2.88Å; K126-T129 PolarHBondContact O-N 2.9Å; K126-A130 PolarHBondContact O-N 3.26Å
127	F	95.8	Very high	90.4	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-63.3	-35.7	175.8	-75.6	-68.8	0	0	0	112	E64 A67 V68 L71 L77 M97 I112 R113 F118 T129 A130 V131	E64-F127 WeakPolarHBondContact OE1-CD2 3.5Å; E64-F127 PolarHBondContact OE1-N 2.95Å; E64-F127 PolarHBondContact OE2-N 2.92Å; A67-F127 HydrophobicContact CB-CB 3.94Å; V68-F127 HydrophobicContact CG2-CB 4.11Å; V68-F127 HydrophobicContact CG2-CD2 3.41Å; V68-F127 VanDerWaalsContact CG2-CD2 3.41Å; V68-F127 HydrophobicContact CG2-CE2 3.99Å; V68-F127 HydrophobicContact CG2-CG 3.92Å; L71-F127 HydrophobicContact CD1-CB 3.97Å; L71-F127 HydrophobicContact CD1-CD1 3.36Å; L71-F127 HydrophobicContact CD1-CE1 4.12Å; L71-F127 HydrophobicContact CD1-CG 3.99Å; L77-F127 HydrophobicContact CD1-CD1 4.49Å; L77-F127 HydrophobicContact CD1-CE1 4.1Å; L77-F127 HydrophobicContact CD1-CZ 4.19Å; L77-F127 HydrophobicContact CD2-CE1 3.83Å; L77-F127 HydrophobicContact CD2-CZ 3.97Å; L77-F127 HydrophobicContact CG-CE1 4.46Å; M97-F127 HydrophobicContact CE-CD2 4.45Å; M97-F127 HydrophobicContact SD-CD2 4.19Å; M97-F127 HydrophobicContact SD-CE2 4.06Å; I112-F127 HydrophobicContact CD1-CD2 4.21Å; I112-F127 HydrophobicContact CD1-CE2 3.34Å; I112-F127 HydrophobicContact CD1-CZ 3.71Å; I112-F127 HydrophobicContact CG1-CE2 3.81Å; I112-F127 HydrophobicContact CG1-CZ 3.91Å; R113-F127 HydrophobicContact CG-CE1 4.19Å; R113-F127 HydrophobicContact CG-CE2 4.19Å; R113-F127 HydrophobicContact CG-CZ 3.45Å; R113-F127 VanDerWaalsContact CG-CZ 3.45Å; F118-F127 HydrophobicContact CB-CE1 3.89Å; F118-F127 HydrophobicContact CD1-CD1 4.41Å; F118-F127 HydrophobicContact CD1-CE1 4.21Å; F118-F127 AromaticContact CD2-CE1 3.96Å; F118-F127 HydrophobicContact CD2-CE1 3.96Å; F118-F127 HydrophobicContact CG-CD1 4.37Å; F118-F127 AromaticContact CG-CE1 3.76Å; F118-F127 HydrophobicContact CG-CE1 3.76Å; F127-T129 PolarHBondContact O-N 3.25Å; F127-A130 WeakPolarHBondContact O-CB 3.46Å; F127-A130 PolarHBondContact O-N 3.43Å; F127-V131 WeakPolarHBondContact O-CG2 3.41Å; F127-V131 PolarHBondContact O-N 3.35Å
128	Q	96.2	Very high	90.5	Very high	39 Å²	39	33.3 Å²	33.3	18%	0.182	17%	0.167	C	C	.	.	H	α-helix	trans	-53.8	-55.7	172.6	176	172.6	36.1	0	0	110.8	V61 E62 E64 A67 K126 A130 V131 E132	V61-Q128 HydrophobicContact CG1-CB 4.34Å; V61-Q128 HydrophobicContact CG1-CG 4.13Å; V61-Q128 PolarHBondContact O-NE2 3.24Å; V61-Q128 VanDerWaalsContact O-NE2 3.12Å; E62-Q128 PolarHBondContact O-NE2 3.05Å; E64-Q128 PolarHBondContact OE2-N 3.4Å; A67-Q128 HydrophobicContact CB-CB 4.08Å; K126-Q128 VanDerWaalsContact C-N 3.27Å; K126-Q128 PolarHBondContact O-N 2.88Å; Q128-A130 VanDerWaalsContact C-N 3.29Å; Q128-A130 PolarHBondContact O-N 3.47Å; Q128-V131 WeakPolarHBondContact O-CB 3.22Å; Q128-V131 PolarHBondContact O-N 2.99Å; Q128-E132 WeakPolarHBondContact O-CG 3.37Å; Q128-E132 PolarHBondContact O-N 2.89Å
129	T	96	Very high	90.4	Very high	21 Å²	21	36.8 Å²	36.8	13%	0.129	18%	0.18	C	C	.	.	H	α-helix	trans	-65.7	-31.7	-179.9	-42.8	0	0	0	0	112.8	L125 K126 F127 V131 E132 I133 L151 L153	L125-T129 HydrophobicContact CD1-CG2 3.89Å; L125-T129 HydrophobicContact CD2-CG2 3.99Å; L125-T129 HydrophobicContact CG-CG2 4.16Å; K126-T129 PolarHBondContact O-N 2.9Å; F127-T129 PolarHBondContact O-N 3.25Å; T129-V131 VanDerWaalsContact C-N 3.32Å; T129-V131 PolarHBondContact O-N 2.96Å; T129-E132 WeakPolarHBondContact CA-OE2 3.39Å; T129-E132 PolarHBondContact O-N 3.42Å; T129-I133 HydrophobicContact CG2-CD1 4.44Å; T129-I133 VanDerWaalsContact O-CG1 3.22Å; T129-I133 WeakPolarHBondContact O-CG1 3.31Å; T129-I133 PolarHBondContact O-N 3.43Å; T129-L151 HydrophobicContact CG2-CD1 4.21Å; T129-L153 HydrophobicContact CG2-CD1 4.4Å; T129-L153 HydrophobicContact CG2-CD2 3.95Å
130	A	96.5	Very high	90.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.2	-42.5	172.4	0	0	0	0	0	111.9	F118 L125 K126 F127 Q128 I133 M134 W161	F118-A130 HydrophobicContact CD1-CB 4.44Å; F118-A130 HydrophobicContact CE1-CB 4.08Å; L125-A130 HydrophobicContact CD2-CB 4.29Å; K126-A130 PolarHBondContact O-N 3.26Å; F127-A130 WeakPolarHBondContact O-CB 3.46Å; F127-A130 PolarHBondContact O-N 3.43Å; Q128-A130 VanDerWaalsContact C-N 3.29Å; Q128-A130 PolarHBondContact O-N 3.47Å; A130-I133 PolarHBondContact O-N 3.22Å; A130-M134 WeakPolarHBondContact O-CE 3.47Å; A130-M134 WeakPolarHBondContact O-CG 3.47Å; A130-M134 PolarHBondContact O-N 3.48Å; A130-M134 VanDerWaalsContact O-N 3.08Å; A130-W161 HydrophobicContact CB-CH2 3.32Å; A130-W161 HydrophobicContact CB-CZ2 3.85Å; A130-W161 HydrophobicContact CB-CZ3 3.99Å
131	V	97.7	Very high	91.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.6	-44.8	177.2	173.4	0	0	0	0	111.1	L57 V61 F70 L71 F127 Q128 T129 I133 M134 F135 F227	L57-V131 HydrophobicContact CD1-CG1 3.91Å; V61-V131 HydrophobicContact CG1-CB 4.43Å; V61-V131 HydrophobicContact CG1-CG1 4.48Å; V61-V131 HydrophobicContact CG2-CG1 3.9Å; F70-V131 HydrophobicContact CD1-CG1 4.33Å; F70-V131 HydrophobicContact CD1-CG2 4.13Å; F70-V131 HydrophobicContact CE1-CG1 4.16Å; F70-V131 HydrophobicContact CE1-CG2 4.43Å; L71-V131 HydrophobicContact CD1-CG2 4.03Å; L71-V131 HydrophobicContact CD2-CG2 3.81Å; L71-V131 HydrophobicContact CG-CG2 3.87Å; F127-V131 WeakPolarHBondContact O-CG2 3.41Å; F127-V131 PolarHBondContact O-N 3.35Å; Q128-V131 WeakPolarHBondContact O-CB 3.22Å; Q128-V131 PolarHBondContact O-N 2.99Å; T129-V131 VanDerWaalsContact C-N 3.32Å; T129-V131 PolarHBondContact O-N 2.96Å; V131-I133 VanDerWaalsContact C-N 3.34Å; V131-I133 PolarHBondContact O-N 3.43Å; V131-M134 HydrophobicContact CG2-CE 4.13Å; V131-M134 PolarHBondContact O-N 3.13Å; V131-F135 WeakPolarHBondContact O-CB 3.47Å; V131-F135 PolarHBondContact O-N 3.24Å; V131-F227 HydrophobicContact CG1-CE2 4.45Å; V131-F227 HydrophobicContact CG1-CZ 3.81Å
132	E	97.3	Very high	92.6	Very high	19 Å²	19	38.7 Å²	38.7	9%	0.089	18%	0.184	C	C	.	.	H	α-helix	trans	-57.3	-46	175	-66.7	166.2	168.8	0	0	111.7	L57 Y58 Q128 T129 M134 F135 F136 L151	L57-E132 HydrophobicContact CD2-CB 4.47Å; L57-E132 HydrophobicContact CD2-CG 4.12Å; Y58-E132 HydrophobicContact CE1-CG 4.5Å; Q128-E132 WeakPolarHBondContact O-CG 3.37Å; Q128-E132 PolarHBondContact O-N 2.89Å; T129-E132 WeakPolarHBondContact CA-OE2 3.39Å; T129-E132 PolarHBondContact O-N 3.42Å; E132-M134 PolarHBondContact O-N 3.45Å; E132-F135 WeakPolarHBondContact O-CB 3.43Å; E132-F135 PolarHBondContact O-N 3.18Å; E132-F136 HydrophobicContact CB-CD2 4.34Å; E132-F136 HydrophobicContact CB-CE2 4.3Å; E132-F136 WeakPolarHBondContact O-CD2 3.42Å; E132-F136 PolarHBondContact O-N 3.38Å; E132-L151 HydrophobicContact CB-CD1 3.84Å; E132-L151 HydrophobicContact CB-CD2 4.15Å; E132-L151 WeakPolarHBondContact OE2-CD2 3.35Å
133	I	96.9	Very high	93.5	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-46.9	176.2	-68.1	168.2	0	0	0	111.4	L125 T129 A130 V131 F135 F136 W137 Y147 L151 L153 W161 L165	L125-I133 HydrophobicContact CD2-CD1 3.36Å; T129-I133 HydrophobicContact CG2-CD1 4.44Å; T129-I133 VanDerWaalsContact O-CG1 3.22Å; T129-I133 WeakPolarHBondContact O-CG1 3.31Å; T129-I133 PolarHBondContact O-N 3.43Å; A130-I133 PolarHBondContact O-N 3.22Å; V131-I133 VanDerWaalsContact C-N 3.34Å; V131-I133 PolarHBondContact O-N 3.43Å; I133-F135 VanDerWaalsContact C-N 3.27Å; I133-F135 PolarHBondContact O-N 3.22Å; I133-F136 PolarHBondContact O-N 2.86Å; I133-W137 WeakPolarHBondContact O-CB 3.4Å; I133-W137 PolarHBondContact O-N 2.94Å; I133-Y147 HydrophobicContact CB-CE1 4.09Å; I133-Y147 HydrophobicContact CG1-CD1 4.17Å; I133-Y147 HydrophobicContact CG1-CE1 3.68Å; I133-Y147 HydrophobicContact CG2-CE1 4.1Å; I133-Y147 PolarHBondContact O-OH 2.9Å; I133-L151 HydrophobicContact CG1-CD1 3.95Å; I133-L153 HydrophobicContact CD1-CD1 3.55Å; I133-L153 HydrophobicContact CG1-CD1 3.83Å; I133-W161 HydrophobicContact CB-CE3 4.36Å; I133-W161 HydrophobicContact CD1-CB 4.23Å; I133-W161 HydrophobicContact CD1-CD2 3.84Å; I133-W161 HydrophobicContact CD1-CE3 4.31Å; I133-W161 HydrophobicContact CD1-CG 3.76Å; I133-W161 HydrophobicContact CG2-CB 3.9Å; I133-W161 HydrophobicContact CG2-CD2 4.23Å; I133-W161 HydrophobicContact CG2-CE3 3.9Å; I133-W161 HydrophobicContact CG2-CG 4.26Å; I133-L165 HydrophobicContact CG2-CD1 4.08Å
134	M	97.4	Very high	94.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62	-38.1	178.9	-70.5	-175.7	-65.8	0	0	111.8	L71 W117 F118 A130 V131 E132 S138 W161 L165 F227 L231 I234	L71-M134 HydrophobicContact CD2-CE 4.04Å; W117-M134 HydrophobicContact CZ3-SD 4.12Å; F118-M134 HydrophobicContact CE1-CE 4.09Å; F118-M134 HydrophobicContact CZ-CE 3.98Å; A130-M134 WeakPolarHBondContact O-CE 3.47Å; A130-M134 WeakPolarHBondContact O-CG 3.47Å; A130-M134 PolarHBondContact O-N 3.48Å; A130-M134 VanDerWaalsContact O-N 3.08Å; V131-M134 HydrophobicContact CG2-CE 4.13Å; V131-M134 PolarHBondContact O-N 3.13Å; E132-M134 PolarHBondContact O-N 3.45Å; M134-S138 WeakPolarHBondContact O-CB 3.08Å; M134-S138 PolarHBondContact O-N 2.87Å; M134-S138 VanDerWaalsContact O-N 3.07Å; M134-S138 PolarHBondContact O-OG 3Å; M134-W161 HydrophobicContact CG-CZ3 4.43Å; M134-L165 HydrophobicContact CG-CD1 4.47Å; M134-L165 HydrophobicContact CG-CD2 4.01Å; M134-F227 HydrophobicContact CB-CD2 4.41Å; M134-F227 HydrophobicContact CB-CE2 3.86Å; M134-L231 HydrophobicContact CE-CD2 3.86Å; M134-L231 HydrophobicContact SD-CD2 3.79Å; M134-I234 HydrophobicContact SD-CD1 3.61Å
135	F	97.7	Very high	95.2	Very high	1 Å²	1	35.4 Å²	35.4	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-67	-46.5	177	179.3	-83.5	0	0	0	112.9	K52 N53 W56 L57 V131 E132 I133 S138 R139 F227	K52-F135 HydrophobicContact CB-CE2 4.16Å; K52-F135 VanDerWaalsContact O-CE2 3.23Å; K52-F135 WeakPolarHBondContact O-CE2 3.24Å; K52-F135 WeakPolarHBondContact O-CZ 3.47Å; N53-F135 WeakPolarHBondContact O-CZ 3.34Å; W56-F135 HydrophobicContact CE3-CE2 4.25Å; L57-F135 HydrophobicContact CB-CD2 4.12Å; L57-F135 HydrophobicContact CB-CE1 4.43Å; L57-F135 HydrophobicContact CB-CE2 3.98Å; L57-F135 HydrophobicContact CB-CG 4.38Å; L57-F135 HydrophobicContact CB-CZ 4.16Å; L57-F135 HydrophobicContact CD1-CB 4.1Å; L57-F135 HydrophobicContact CD1-CD2 4.17Å; L57-F135 HydrophobicContact CD1-CG 4.14Å; L57-F135 HydrophobicContact CD2-CB 4.07Å; L57-F135 HydrophobicContact CD2-CD1 3.64Å; L57-F135 HydrophobicContact CD2-CD2 4.34Å; L57-F135 HydrophobicContact CD2-CE1 4.11Å; L57-F135 HydrophobicContact CD2-CG 3.77Å; L57-F135 HydrophobicContact CG-CD2 4.45Å; L57-F135 HydrophobicContact CG-CG 4.33Å; V131-F135 WeakPolarHBondContact O-CB 3.47Å; V131-F135 PolarHBondContact O-N 3.24Å; E132-F135 WeakPolarHBondContact O-CB 3.43Å; E132-F135 PolarHBondContact O-N 3.18Å; I133-F135 VanDerWaalsContact C-N 3.27Å; I133-F135 PolarHBondContact O-N 3.22Å; F135-S138 PolarHBondContact O-OG 3.11Å; F135-R139 PolarHBondContact O-N 2.86Å; F135-F227 VanDerWaalsContact CA-CD2 3.41Å; F135-F227 HydrophobicContact CB-CD2 3.85Å; F135-F227 HydrophobicContact CB-CE2 3.87Å; F135-F227 HydrophobicContact CB-CG 4.39Å; F135-F227 HydrophobicContact CB-CZ 4.44Å; F135-F227 HydrophobicContact CD2-CB 4.28Å; F135-F227 HydrophobicContact CD2-CD1 4.07Å; F135-F227 HydrophobicContact CD2-CD2 4.27Å; F135-F227 HydrophobicContact CD2-CE1 4.45Å; F135-F227 AromaticContact CD2-CG 3.94Å; F135-F227 HydrophobicContact CD2-CG 3.94Å
136	F	96.9	Very high	95.4	Very high	12 Å²	12	36 Å²	36	5%	0.053	18%	0.18	C	C	.	.	H	α-helix	trans	-72.2	-39.5	-179.4	-74.8	-58.1	0	0	0	111.4	V54 L57 E132 I133 S138 R139 G140 Y141 F146 Y147 L151	V54-F136 HydrophobicContact CG2-CE1 4.36Å; V54-F136 HydrophobicContact CG2-CZ 4.19Å; L57-F136 HydrophobicContact CD2-CE2 4.22Å; L57-F136 HydrophobicContact CD2-CZ 4.34Å; E132-F136 HydrophobicContact CB-CD2 4.34Å; E132-F136 HydrophobicContact CB-CE2 4.3Å; E132-F136 WeakPolarHBondContact O-CD2 3.42Å; E132-F136 PolarHBondContact O-N 3.38Å; I133-F136 PolarHBondContact O-N 2.86Å; F136-S138 PolarHBondContact O-N 2.95Å; F136-R139 CarbonylContact O-C 3.56Å; F136-R139 PolarHBondContact O-N 3.2Å; F136-G140 PolarHBondContact O-N 2.75Å; F136-Y141 HydrophobicContact CB-CD2 4.44Å; F136-Y141 HydrophobicContact CD1-CD2 4.01Å; F136-Y141 WeakPolarHBondContact O-CB 3.43Å; F136-Y141 WeakPolarHBondContact O-CD2 3.29Å; F136-Y141 PolarHBondContact O-N 3.08Å; F136-F146 HydrophobicContact CB-CE1 3.92Å; F136-F146 AromaticContact CD1-CE1 3.82Å; F136-F146 HydrophobicContact CD1-CE1 3.82Å; F136-F146 AromaticContact CD1-CZ 3.59Å; F136-F146 HydrophobicContact CD1-CZ 3.59Å; F136-F146 HydrophobicContact CD2-CE1 4.14Å; F136-F146 HydrophobicContact CE1-CE1 4.37Å; F136-F146 AromaticContact CE1-CZ 3.84Å; F136-F146 HydrophobicContact CE1-CZ 3.84Å; F136-F146 AromaticContact CG-CE1 3.7Å; F136-F146 HydrophobicContact CG-CE1 3.7Å; F136-F146 AromaticContact CG-CZ 3.98Å; F136-F146 HydrophobicContact CG-CZ 3.98Å; F136-F146 HydrophobicContact CZ-CZ 4.42Å; F136-Y147 HydrophobicContact CB-CE1 4.4Å; F136-L151 HydrophobicContact CD2-CD1 4.3Å; F136-L151 HydrophobicContact CE2-CD2 4.1Å
137	W	96.8	Very high	95.5	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-42.9	174.7	-174.1	93.6	0	0	0	112.4	I133 R139 G140 T142 Y147 L165 R166 A169 E213 W216 R217 I230	I133-W137 WeakPolarHBondContact O-CB 3.4Å; I133-W137 PolarHBondContact O-N 2.94Å; W137-R139 PolarHBondContact O-N 3.28Å; W137-G140 PolarHBondContact O-N 3.47Å; W137-T142 HydrophobicContact CG-CG2 4.35Å; W137-Y147 PolarHBondContact N-OH 2.97Å; W137-L165 HydrophobicContact CB-CD1 3.5Å; W137-L165 VanDerWaalsContact CB-CD1 3.5Å; W137-L165 HydrophobicContact CD2-CB 3.65Å; W137-L165 HydrophobicContact CD2-CD1 3.8Å; W137-L165 HydrophobicContact CD2-CG 4.29Å; W137-L165 HydrophobicContact CE3-CB 4.12Å; W137-L165 HydrophobicContact CE3-CD1 4.37Å; W137-L165 HydrophobicContact CG-CB 4.01Å; W137-L165 HydrophobicContact CG-CD1 3.36Å; W137-L165 HydrophobicContact CG-CG 4.29Å; W137-L165 HydrophobicContact CH2-CB 4.45Å; W137-L165 HydrophobicContact CZ2-CB 3.98Å; W137-L165 HydrophobicContact CZ3-CB 4.49Å; W137-R166 HydrophobicContact CZ2-CG 4.24Å; W137-A169 HydrophobicContact CH2-CB 3.92Å; W137-E213 HydrophobicContact CH2-CG 4.14Å; W137-E213 HydrophobicContact CZ2-CB 4.08Å; W137-E213 HydrophobicContact CZ2-CG 3.64Å; W137-W216 HydrophobicContact CH2-CE3 4.1Å; W137-W216 HydrophobicContact CH2-CZ3 4.44Å; W137-W216 HydrophobicContact CZ3-CD2 4.49Å; W137-W216 AromaticContact CZ3-CE3 3.91Å; W137-W216 HydrophobicContact CZ3-CE3 3.91Å; W137-W216 HydrophobicContact CZ3-CH2 4.27Å; W137-W216 AromaticContact CZ3-CZ3 3.79Å; W137-W216 HydrophobicContact CZ3-CZ3 3.79Å; W137-R217 PolarHBondContact O-NH2 3.34Å; W137-I230 HydrophobicContact CE3-CG1 4.3Å; W137-I230 HydrophobicContact CZ3-CD1 3.92Å; W137-I230 HydrophobicContact CZ3-CG1 4.14Å
138	S	95.6	Very high	95.5	Very high	4 Å²	4	35.8 Å²	35.8	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-29.9	178.9	72.4	0	0	0	0	112.1	M134 F135 F136 G140 A226 F227	M134-S138 WeakPolarHBondContact O-CB 3.08Å; M134-S138 PolarHBondContact O-N 2.87Å; M134-S138 VanDerWaalsContact O-N 3.07Å; M134-S138 PolarHBondContact O-OG 3Å; F135-S138 PolarHBondContact O-OG 3.11Å; F136-S138 PolarHBondContact O-N 2.95Å; S138-G140 VanDerWaalsContact C-N 3.33Å; S138-A226 WeakPolarHBondContact CB-O 3.45Å; S138-F227 WeakPolarHBondContact OG-CA 3.48Å; S138-F227 PolarHBondContact OG-N 2.82Å
139	R	92.1	Very high	95.5	Very high	72 Å²	72	38.8 Å²	38.8	27%	0.272	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	3.5	175.1	-69.4	-176	156.2	62.4	22.8	115.2	S51 K52 F135 F136 W137 Y141 D225	S51-R139 PolarHBondContact OG-NH2 3Å; K52-R139 PolarHBondContact O-NH1 3.13Å; K52-R139 PolarHBondContact O-NH2 2.78Å; F135-R139 PolarHBondContact O-N 2.86Å; F136-R139 CarbonylContact O-C 3.56Å; F136-R139 PolarHBondContact O-N 3.2Å; W137-R139 PolarHBondContact O-N 3.28Å; R139-Y141 HydrophobicContact CB-CD2 3.75Å; R139-Y141 HydrophobicContact CB-CE2 3.81Å; R139-D225 IonicContact NH2-OD2 3.73Å
140	G	93.5	Very high	95.4	Very high	35 Å²	35	43 Å²	43	36%	0.361	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	0.3	177.2	0	0	0	0	0	115.1	F136 W137 S138 T142	F136-G140 PolarHBondContact O-N 2.75Å; W137-G140 PolarHBondContact O-N 3.47Å; S138-G140 VanDerWaalsContact C-N 3.33Å; G140-T142 PolarHBondContact O-N 3.12Å; G140-T142 VanDerWaalsContact O-N 3.11Å
141	Y	94.9	Very high	95.3	Very high	116 Å²	116	44.3 Å²	44.3	46%	0.455	22%	0.222	S	C	.	.			trans	-78.4	100	174.6	-58.3	-81.6	0	0	0	110	F136 R139 F146 Y147	F136-Y141 HydrophobicContact CB-CD2 4.44Å; F136-Y141 HydrophobicContact CD1-CD2 4.01Å; F136-Y141 WeakPolarHBondContact O-CB 3.43Å; F136-Y141 WeakPolarHBondContact O-CD2 3.29Å; F136-Y141 PolarHBondContact O-N 3.08Å; R139-Y141 HydrophobicContact CB-CD2 3.75Å; R139-Y141 HydrophobicContact CB-CE2 3.81Å; Y141-F146 AromaticContact CD1-CD2 3.79Å; Y141-F146 HydrophobicContact CD1-CD2 3.79Å; Y141-F146 HydrophobicContact CD1-CE1 4.33Å; Y141-F146 AromaticContact CD1-CE2 3.53Å; Y141-F146 HydrophobicContact CD1-CE2 3.53Å; Y141-F146 HydrophobicContact CD1-CG 4.28Å; Y141-F146 AromaticContact CD1-CZ 3.83Å; Y141-F146 HydrophobicContact CD1-CZ 3.83Å; Y141-F146 HydrophobicContact CD2-CZ 4.36Å; Y141-F146 HydrophobicContact CE1-CD2 4.42Å; Y141-F146 AromaticContact CE1-CE2 3.94Å; Y141-F146 HydrophobicContact CE1-CE2 3.94Å; Y141-F146 HydrophobicContact CE1-CZ 4.41Å; Y141-F146 HydrophobicContact CG-CD1 4.44Å; Y141-F146 HydrophobicContact CG-CD2 4.44Å; Y141-F146 HydrophobicContact CG-CE1 4.04Å; Y141-F146 HydrophobicContact CG-CE2 4.01Å; Y141-F146 AromaticContact CG-CZ 3.8Å; Y141-F146 HydrophobicContact CG-CZ 3.8Å; Y141-Y147 VanDerWaalsContact O-CE2 3.22Å; Y141-Y147 WeakPolarHBondContact O-CE2 3.28Å; Y141-Y147 PolarHBondContact O-OH 3.47Å
142	T	93.4	Very high	95.2	Very high	37 Å²	37	47.5 Å²	47.5	23%	0.227	25%	0.254	C	S	.	.			trans	-123.2	-2.8	-177	62.4	0	0	0	0	114	W137 G140 N162 E213	W137-T142 HydrophobicContact CG-CG2 4.35Å; G140-T142 PolarHBondContact O-N 3.12Å; G140-T142 VanDerWaalsContact O-N 3.11Å; T142-N162 WeakPolarHBondContact CA-OD1 3.39Å; T142-N162 VanDerWaalsContact CB-OD1 3.3Å; T142-N162 WeakPolarHBondContact CB-OD1 3.46Å; T142-N162 WeakPolarHBondContact CG2-OD1 3.41Å; T142-N162 PolarHBondContact O-ND2 3.16Å; T142-N162 VanDerWaalsContact O-ND2 3.07Å; T142-E213 WeakPolarHBondContact CG2-OE1 3.22Å
143	S	92.9	Very high	95	Very high	64 Å²	64	47.4 Å²	47.4	45%	0.448	25%	0.254	S	S	.	.			trans	-74.9	142.9	-172.7	86	0	0	0	0	112.4	Q145 F146 Y147	S143-Q145 PolarHBondContact O-N 3.15Å; S143-F146 PolarHBondContact O-N 3.13Å; S143-F146 WeakPolarHBondContact OG-CB 3.32Å; S143-F146 PolarHBondContact OG-N 3.04Å; S143-F146 VanDerWaalsContact OG-N 3.14Å; S143-Y147 VanDerWaalsContact O-CD2 3.29Å; S143-Y147 WeakPolarHBondContact O-CD2 3.29Å; S143-Y147 PolarHBondContact O-N 3.32Å
144	M	92.5	Very high	94.7	Very high	65 Å²	65	51.6 Å²	51.6	32%	0.32	28%	0.277	S	S	.	.	H	α-helix	trans	-61.4	-35.3	178.7	-60.1	-64.2	148.1	0	0	112.3	K148 T158 F159	M144-K148 WeakPolarHBondContact O-CB 3.46Å; M144-K148 PolarHBondContact O-N 3.44Å; M144-K148 VanDerWaalsContact O-N 3.13Å; M144-T158 HydrophobicContact CE-CG2 3.96Å; M144-T158 VanDerWaalsContact SD-CB 3.5Å; M144-T158 HydrophobicContact SD-CG2 3.42Å; M144-T158 WeakPolarHBondContact SD-CG2 3.24Å; M144-F159 HydrophobicContact CE-CB 3.91Å; M144-F159 HydrophobicContact CE-CD2 4.41Å
145	Q	94.2	Very high	94.4	Very high	104 Å²	104	58.3 Å²	58.3	49%	0.486	31%	0.306	S	S	.	.	H	α-helix	trans	-68.9	-44.8	-178.6	-172.1	58.6	34.5	0	0	111	S143 Y147 K148 D149	S143-Q145 PolarHBondContact O-N 3.15Å; Q145-Y147 PolarHBondContact O-N 3.32Å; Q145-K148 WeakPolarHBondContact O-CB 3.33Å; Q145-K148 PolarHBondContact O-N 2.84Å; Q145-K148 VanDerWaalsContact O-N 3.15Å; Q145-D149 WeakPolarHBondContact CG-OD2 3.47Å; Q145-D149 PolarHBondContact NE2-OD1 3.05Å; Q145-D149 PolarHBondContact NE2-OD2 3.23Å; Q145-D149 VanDerWaalsContact O-CG 3.27Å; Q145-D149 PolarHBondContact O-N 3.31Å
146	F	95.9	Very high	94.1	Very high	38 Å²	38	62 Å²	62	17%	0.167	33%	0.326	C	S	.	.	H	α-helix	trans	-56.2	-51.3	176.4	177.4	-90.8	0	0	0	111.7	F136 Y141 S143 K148 D149 E150	F136-F146 HydrophobicContact CB-CE1 3.92Å; F136-F146 AromaticContact CD1-CE1 3.82Å; F136-F146 HydrophobicContact CD1-CE1 3.82Å; F136-F146 AromaticContact CD1-CZ 3.59Å; F136-F146 HydrophobicContact CD1-CZ 3.59Å; F136-F146 HydrophobicContact CD2-CE1 4.14Å; F136-F146 HydrophobicContact CE1-CE1 4.37Å; F136-F146 AromaticContact CE1-CZ 3.84Å; F136-F146 HydrophobicContact CE1-CZ 3.84Å; F136-F146 AromaticContact CG-CE1 3.7Å; F136-F146 HydrophobicContact CG-CE1 3.7Å; F136-F146 AromaticContact CG-CZ 3.98Å; F136-F146 HydrophobicContact CG-CZ 3.98Å; F136-F146 HydrophobicContact CZ-CZ 4.42Å; Y141-F146 AromaticContact CD1-CD2 3.79Å; Y141-F146 HydrophobicContact CD1-CD2 3.79Å; Y141-F146 HydrophobicContact CD1-CE1 4.33Å; Y141-F146 AromaticContact CD1-CE2 3.53Å; Y141-F146 HydrophobicContact CD1-CE2 3.53Å; Y141-F146 HydrophobicContact CD1-CG 4.28Å; Y141-F146 AromaticContact CD1-CZ 3.83Å; Y141-F146 HydrophobicContact CD1-CZ 3.83Å; Y141-F146 HydrophobicContact CD2-CZ 4.36Å; Y141-F146 HydrophobicContact CE1-CD2 4.42Å; Y141-F146 AromaticContact CE1-CE2 3.94Å; Y141-F146 HydrophobicContact CE1-CE2 3.94Å; Y141-F146 HydrophobicContact CE1-CZ 4.41Å; Y141-F146 HydrophobicContact CG-CD1 4.44Å; Y141-F146 HydrophobicContact CG-CD2 4.44Å; Y141-F146 HydrophobicContact CG-CE1 4.04Å; Y141-F146 HydrophobicContact CG-CE2 4.01Å; Y141-F146 AromaticContact CG-CZ 3.8Å; Y141-F146 HydrophobicContact CG-CZ 3.8Å; S143-F146 PolarHBondContact O-N 3.13Å; S143-F146 WeakPolarHBondContact OG-CB 3.32Å; S143-F146 PolarHBondContact OG-N 3.04Å; S143-F146 VanDerWaalsContact OG-N 3.14Å; F146-K148 VanDerWaalsContact C-N 3.26Å; F146-K148 PolarHBondContact O-N 3.42Å; F146-D149 PolarHBondContact O-N 3.03Å; F146-E150 HydrophobicContact CD1-CG 4.39Å; F146-E150 HydrophobicContact CD2-CG 3.93Å; F146-E150 HydrophobicContact CE1-CB 4.36Å; F146-E150 HydrophobicContact CE1-CG 4.12Å; F146-E150 HydrophobicContact CE2-CG 3.64Å; F146-E150 HydrophobicContact CG-CG 4.3Å; F146-E150 HydrophobicContact CZ-CB 4.37Å; F146-E150 HydrophobicContact CZ-CG 3.74Å; F146-E150 WeakPolarHBondContact O-CB 3.34Å; F146-E150 WeakPolarHBondContact O-CG 3.5Å; F146-E150 PolarHBondContact O-N 3.48Å
147	Y	95.3	Very high	93.8	Very high	1 Å²	1	63.2 Å²	63.2	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-65.8	-28.2	179.8	-80.6	-72.3	0	0	0	114	I133 F136 W137 Y141 S143 Q145 L151 G152 L153 T158	I133-Y147 HydrophobicContact CB-CE1 4.09Å; I133-Y147 HydrophobicContact CG1-CD1 4.17Å; I133-Y147 HydrophobicContact CG1-CE1 3.68Å; I133-Y147 HydrophobicContact CG2-CE1 4.1Å; I133-Y147 PolarHBondContact O-OH 2.9Å; F136-Y147 HydrophobicContact CB-CE1 4.4Å; W137-Y147 PolarHBondContact N-OH 2.97Å; Y141-Y147 VanDerWaalsContact O-CE2 3.22Å; Y141-Y147 WeakPolarHBondContact O-CE2 3.28Å; Y141-Y147 PolarHBondContact O-OH 3.47Å; S143-Y147 VanDerWaalsContact O-CD2 3.29Å; S143-Y147 WeakPolarHBondContact O-CD2 3.29Å; S143-Y147 PolarHBondContact O-N 3.32Å; Q145-Y147 PolarHBondContact O-N 3.32Å; Y147-L151 HydrophobicContact CD1-CD1 3.72Å; Y147-L151 HydrophobicContact CD1-CG 4.27Å; Y147-L151 HydrophobicContact CE1-CD1 3.89Å; Y147-L151 CarbonylContact O-C 3.59Å; Y147-L151 WeakPolarHBondContact O-CA 3.34Å; Y147-L151 WeakPolarHBondContact O-CB 3.43Å; Y147-L151 PolarHBondContact O-N 2.99Å; Y147-L151 VanDerWaalsContact O-N 3.16Å; Y147-G152 PolarHBondContact O-N 3.46Å; Y147-L153 HydrophobicContact CD1-CD1 3.79Å; Y147-L153 HydrophobicContact CG-CD1 4.35Å; Y147-L153 PolarHBondContact O-N 3.34Å; Y147-T158 WeakPolarHBondContact CB-OG1 3.42Å; Y147-T158 HydrophobicContact CD2-CG2 3.29Å; Y147-T158 HydrophobicContact CE2-CG2 4.1Å; Y147-T158 HydrophobicContact CG-CG2 3.64Å
148	K	95.7	Very high	93.6	Very high	123 Å²	123	63.2 Å²	63.2	54%	0.535	33%	0.334	S	S	.	.	H	α-helix	trans	-69	-46.8	173.7	-177.7	-170.1	173.5	-165.3	0	110.5	M144 Q145 F146 G152	M144-K148 WeakPolarHBondContact O-CB 3.46Å; M144-K148 PolarHBondContact O-N 3.44Å; M144-K148 VanDerWaalsContact O-N 3.13Å; Q145-K148 WeakPolarHBondContact O-CB 3.33Å; Q145-K148 PolarHBondContact O-N 2.84Å; Q145-K148 VanDerWaalsContact O-N 3.15Å; F146-K148 VanDerWaalsContact C-N 3.26Å; F146-K148 PolarHBondContact O-N 3.42Å; K148-G152 WeakPolarHBondContact O-CA 3.48Å; K148-G152 PolarHBondContact O-N 3.44Å; K148-G152 VanDerWaalsContact O-N 3.11Å
149	D	96.6	Very high	93.3	Very high	101 Å²	101	67.1 Å²	67.1	54%	0.54	35%	0.351	S	S	.	.	H	α-helix	trans	-75.7	-42.8	-173.5	-62.3	-18.7	0	0	0	111.6	Q145 F146	Q145-D149 WeakPolarHBondContact CG-OD2 3.47Å; Q145-D149 PolarHBondContact NE2-OD1 3.05Å; Q145-D149 PolarHBondContact NE2-OD2 3.23Å; Q145-D149 VanDerWaalsContact O-CG 3.27Å; Q145-D149 PolarHBondContact O-N 3.31Å; F146-D149 PolarHBondContact O-N 3.03Å
150	E	94.5	Very high	93.2	Very high	110 Å²	110	65.8 Å²	65.8	51%	0.514	35%	0.352	S	S	.	.	H	α-helix	trans	-84.8	-39.2	-176.2	-62.3	-60.8	143.4	0	0	113.2	F146	F146-E150 HydrophobicContact CD1-CG 4.39Å; F146-E150 HydrophobicContact CD2-CG 3.93Å; F146-E150 HydrophobicContact CE1-CB 4.36Å; F146-E150 HydrophobicContact CE1-CG 4.12Å; F146-E150 HydrophobicContact CE2-CG 3.64Å; F146-E150 HydrophobicContact CG-CG 4.3Å; F146-E150 HydrophobicContact CZ-CB 4.37Å; F146-E150 HydrophobicContact CZ-CG 3.74Å; F146-E150 WeakPolarHBondContact O-CB 3.34Å; F146-E150 WeakPolarHBondContact O-CG 3.5Å; F146-E150 PolarHBondContact O-N 3.48Å
151	L	93.8	Very high	93.2	Very high	28 Å²	28	64.5 Å²	64.5	15%	0.147	34%	0.336	C	S	.	.	H	α-helix	trans	-118	1.8	-171.7	-57.5	-167.5	0	0	0	113.9	T129 E132 I133 F136 Y147 L153	T129-L151 HydrophobicContact CG2-CD1 4.21Å; E132-L151 HydrophobicContact CB-CD1 3.84Å; E132-L151 HydrophobicContact CB-CD2 4.15Å; E132-L151 WeakPolarHBondContact OE2-CD2 3.35Å; I133-L151 HydrophobicContact CG1-CD1 3.95Å; F136-L151 HydrophobicContact CD2-CD1 4.3Å; F136-L151 HydrophobicContact CE2-CD2 4.1Å; Y147-L151 HydrophobicContact CD1-CD1 3.72Å; Y147-L151 HydrophobicContact CD1-CG 4.27Å; Y147-L151 HydrophobicContact CE1-CD1 3.89Å; Y147-L151 CarbonylContact O-C 3.59Å; Y147-L151 WeakPolarHBondContact O-CA 3.34Å; Y147-L151 WeakPolarHBondContact O-CB 3.43Å; Y147-L151 PolarHBondContact O-N 2.99Å; Y147-L151 VanDerWaalsContact O-N 3.16Å; L151-L153 HydrophobicContact CB-CD1 4.12Å; L151-L153 HydrophobicContact CB-CG 3.81Å; L151-L153 HydrophobicContact CD1-CD1 4.22Å; L151-L153 PolarHBondContact O-N 2.96Å
152	G	94.7	Very high	93.2	Very high	66 Å²	66	59 Å²	59	68%	0.68	31%	0.314	S	S	*	.			trans	64	21.6	-178.7	0	0	0	0	0	114.3	Y147 K148	Y147-G152 PolarHBondContact O-N 3.46Å; K148-G152 WeakPolarHBondContact O-CA 3.48Å; K148-G152 PolarHBondContact O-N 3.44Å; K148-G152 VanDerWaalsContact O-N 3.11Å
153	L	93.6	Very high	93.1	Very high	17 Å²	17	59.3 Å²	59.3	9%	0.089	31%	0.312	C	S	.	.			trans	-82.3	142.7	-174.4	-61.3	-177.8	0	0	0	112.5	L125 T129 I133 Y147 L151 T157 T158	L125-L153 HydrophobicContact CD1-CD2 3.9Å; T129-L153 HydrophobicContact CG2-CD1 4.4Å; T129-L153 HydrophobicContact CG2-CD2 3.95Å; I133-L153 HydrophobicContact CD1-CD1 3.55Å; I133-L153 HydrophobicContact CG1-CD1 3.83Å; Y147-L153 HydrophobicContact CD1-CD1 3.79Å; Y147-L153 HydrophobicContact CG-CD1 4.35Å; Y147-L153 PolarHBondContact O-N 3.34Å; L151-L153 HydrophobicContact CB-CD1 4.12Å; L151-L153 HydrophobicContact CB-CG 3.81Å; L151-L153 HydrophobicContact CD1-CD1 4.22Å; L151-L153 PolarHBondContact O-N 2.96Å; L153-T157 HydrophobicContact CD2-CG2 4.24Å; L153-T158 WeakPolarHBondContact CB-OG1 3.49Å
154	N	91.6	Very high	93	Very high	90 Å²	90	57.3 Å²	57.3	48%	0.481	30%	0.295	S	S	.	.			trans	-77.1	157.7	170	72	69.8	0	0	0	111.3	N156 T157 T158	N154-N156 PolarHBondContact O-N 3.49Å; N154-N156 VanDerWaalsContact O-N 3.16Å; N154-N156 WeakPolarHBondContact OD1-CA 3.48Å; N154-N156 WeakPolarHBondContact OD1-CB 3.48Å; N154-N156 PolarHBondContact OD1-N 3.12Å; N154-T157 PolarHBondContact ND2-OG1 2.91Å; N154-T157 PolarHBondContact O-N 3.07Å; N154-T157 PolarHBondContact OD1-N 3Å; N154-T157 PolarHBondContact OD1-OG1 3.27Å; N154-T158 PolarHBondContact O-N 3.08Å; N154-T158 VanDerWaalsContact O-N 3.11Å; N154-T158 PolarHBondContact O-OG1 2.98Å
155	K	91.2	Very high	93.1	Very high	140 Å²	140	54.2 Å²	54.2	61%	0.609	28%	0.28	S	S	*	.	H	α-helix	trans	-53.7	-38	-177.9	-64.2	-178.2	-179.8	178.9	0	113.3	F159	K155-F159 VanDerWaalsContact O-CB 3.26Å; K155-F159 WeakPolarHBondContact O-CB 3.26Å; K155-F159 PolarHBondContact O-N 3.15Å
156	N	89.9	Confident	93.1	Very high	80 Å²	80	50.7 Å²	50.7	43%	0.428	26%	0.262	S	S	.	.	H	α-helix	trans	-72.7	-43.4	-175.1	-62.5	-6.5	0	0	0	111.1	N154 F159 C160 Y256	N154-N156 PolarHBondContact O-N 3.49Å; N154-N156 VanDerWaalsContact O-N 3.16Å; N154-N156 WeakPolarHBondContact OD1-CA 3.48Å; N154-N156 WeakPolarHBondContact OD1-CB 3.48Å; N154-N156 PolarHBondContact OD1-N 3.12Å; N156-F159 PolarHBondContact O-N 3.34Å; N156-C160 WeakPolarHBondContact O-CB 3.19Å; N156-C160 PolarHBondContact O-N 3.38Å; N156-C160 PolarHBondContact O-SG 3.39Å; N156-Y256 WeakPolarHBondContact OD1-CE2 3.3Å
157	T	90.6	Very high	92.9	Very high	36 Å²	36	50.9 Å²	50.9	22%	0.221	26%	0.262	C	S	.	.	H	α-helix	trans	-58.8	-50.8	174.1	-59.9	0	0	0	0	110.2	L125 L153 N154 F159 C160 W161	L125-T157 HydrophobicContact CD1-CG2 4.24Å; L153-T157 HydrophobicContact CD2-CG2 4.24Å; N154-T157 PolarHBondContact ND2-OG1 2.91Å; N154-T157 PolarHBondContact O-N 3.07Å; N154-T157 PolarHBondContact OD1-N 3Å; N154-T157 PolarHBondContact OD1-OG1 3.27Å; T157-F159 VanDerWaalsContact C-N 3.34Å; T157-F159 PolarHBondContact O-N 2.87Å; T157-C160 PolarHBondContact O-N 3.42Å; T157-W161 VanDerWaalsContact O-CD1 3.31Å; T157-W161 PolarHBondContact O-N 2.93Å
158	T	92.4	Very high	92.8	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-60.8	-42.4	-179.6	-57.3	0	0	0	0	112.1	M144 Y147 L153 N154 N162	M144-T158 HydrophobicContact CE-CG2 3.96Å; M144-T158 VanDerWaalsContact SD-CB 3.5Å; M144-T158 HydrophobicContact SD-CG2 3.42Å; M144-T158 WeakPolarHBondContact SD-CG2 3.24Å; Y147-T158 WeakPolarHBondContact CB-OG1 3.42Å; Y147-T158 HydrophobicContact CD2-CG2 3.29Å; Y147-T158 HydrophobicContact CE2-CG2 4.1Å; Y147-T158 HydrophobicContact CG-CG2 3.64Å; L153-T158 WeakPolarHBondContact CB-OG1 3.49Å; N154-T158 PolarHBondContact O-N 3.08Å; N154-T158 VanDerWaalsContact O-N 3.11Å; N154-T158 PolarHBondContact O-OG1 2.98Å; T158-N162 VanDerWaalsContact CG2-ND2 3.32Å; T158-N162 WeakPolarHBondContact CG2-ND2 3.32Å; T158-N162 WeakPolarHBondContact O-CB 3.28Å; T158-N162 PolarHBondContact O-N 3.28Å; T158-N162 PolarHBondContact O-ND2 3.39Å
159	F	90.5	Very high	92.7	Very high	86 Å²	86	45 Å²	45	38%	0.377	24%	0.236	S	C	.	.	H	α-helix	trans	-60.2	-51	175.5	176.3	-96.1	0	0	0	112.3	M144 K155 N156 T157 W161 N162 R163 E254	M144-F159 HydrophobicContact CE-CB 3.91Å; M144-F159 HydrophobicContact CE-CD2 4.41Å; K155-F159 VanDerWaalsContact O-CB 3.26Å; K155-F159 WeakPolarHBondContact O-CB 3.26Å; K155-F159 PolarHBondContact O-N 3.15Å; N156-F159 PolarHBondContact O-N 3.34Å; T157-F159 VanDerWaalsContact C-N 3.34Å; T157-F159 PolarHBondContact O-N 2.87Å; F159-W161 PolarHBondContact O-N 3.27Å; F159-N162 PolarHBondContact O-N 2.91Å; F159-R163 VanDerWaalsContact O-CB 3.26Å; F159-R163 WeakPolarHBondContact O-CB 3.23Å; F159-R163 PolarHBondContact O-N 3.46Å; F159-E254 WeakPolarHBondContact CE1-OE1 3.44Å; F159-E254 WeakPolarHBondContact CE1-OE2 3.35Å
160	C	90.4	Very high	92.5	Very high	43 Å²	43	40.2 Å²	40.2	29%	0.291	21%	0.211	S	C	.	.	H	α-helix	trans	-59.1	-45.7	180	-72.6	0	0	0	0	112	N156 T157 R163 H164	N156-C160 WeakPolarHBondContact O-CB 3.19Å; N156-C160 PolarHBondContact O-N 3.38Å; N156-C160 PolarHBondContact O-SG 3.39Å; T157-C160 PolarHBondContact O-N 3.42Å; C160-R163 PolarHBondContact O-N 3.01Å; C160-H164 PolarHBondContact O-CD2 3.36Å; C160-H164 VanDerWaalsContact O-CG 3.29Å; C160-H164 PolarHBondContact O-N 2.89Å
161	W	93.4	Very high	92.3	Very high	8 Å²	8	37.7 Å²	37.7	3%	0.03	20%	0.199	C	C	.	.	H	α-helix	trans	-66.6	-47.4	-179.9	-86.7	88.9	0	0	0	113	W117 F118 R122 L125 A130 I133 M134 T157 F159 R163 H164 L165	W117-W161 HydrophobicContact CH2-CE3 4.26Å; W117-W161 AromaticContact CH2-CZ3 3.88Å; W117-W161 HydrophobicContact CH2-CZ3 3.88Å; W117-W161 HydrophobicContact CZ3-CE3 4.4Å; W117-W161 HydrophobicContact CZ3-CH2 4.06Å; W117-W161 AromaticContact CZ3-CZ3 3.58Å; W117-W161 HydrophobicContact CZ3-CZ3 3.58Å; F118-W161 HydrophobicContact CD1-CH2 4.04Å; F118-W161 HydrophobicContact CE1-CH2 4.08Å; R122-W161 HydrophobicContact CB-CZ2 4.13Å; R122-W161 HydrophobicContact CG-CZ2 4.29Å; L125-W161 HydrophobicContact CB-CZ2 4.25Å; L125-W161 HydrophobicContact CD2-CD2 4.42Å; L125-W161 HydrophobicContact CD2-CZ2 3.71Å; A130-W161 HydrophobicContact CB-CH2 3.32Å; A130-W161 HydrophobicContact CB-CZ2 3.85Å; A130-W161 HydrophobicContact CB-CZ3 3.99Å; I133-W161 HydrophobicContact CB-CE3 4.36Å; I133-W161 HydrophobicContact CD1-CB 4.23Å; I133-W161 HydrophobicContact CD1-CD2 3.84Å; I133-W161 HydrophobicContact CD1-CE3 4.31Å; I133-W161 HydrophobicContact CD1-CG 3.76Å; I133-W161 HydrophobicContact CG2-CB 3.9Å; I133-W161 HydrophobicContact CG2-CD2 4.23Å; I133-W161 HydrophobicContact CG2-CE3 3.9Å; I133-W161 HydrophobicContact CG2-CG 4.26Å; M134-W161 HydrophobicContact CG-CZ3 4.43Å; T157-W161 VanDerWaalsContact O-CD1 3.31Å; T157-W161 PolarHBondContact O-N 2.93Å; F159-W161 PolarHBondContact O-N 3.27Å; W161-R163 VanDerWaalsContact C-N 3.25Å; W161-R163 PolarHBondContact O-N 2.87Å; W161-H164 PolarHBondContact O-N 3.34Å; W161-H164 VanDerWaalsContact O-N 3.15Å; W161-L165 WeakPolarHBondContact O-CG 3.3Å; W161-L165 PolarHBondContact O-N 3.24Å
162	N	93.4	Very high	92.2	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-55.6	-44.8	173.4	-83.5	-60.9	0	0	0	111.2	T142 T158 F159 H164 L165 R166	T142-N162 WeakPolarHBondContact CA-OD1 3.39Å; T142-N162 VanDerWaalsContact CB-OD1 3.3Å; T142-N162 WeakPolarHBondContact CB-OD1 3.46Å; T142-N162 WeakPolarHBondContact CG2-OD1 3.41Å; T142-N162 PolarHBondContact O-ND2 3.16Å; T142-N162 VanDerWaalsContact O-ND2 3.07Å; T158-N162 VanDerWaalsContact CG2-ND2 3.32Å; T158-N162 WeakPolarHBondContact CG2-ND2 3.32Å; T158-N162 WeakPolarHBondContact O-CB 3.28Å; T158-N162 PolarHBondContact O-N 3.28Å; T158-N162 PolarHBondContact O-ND2 3.39Å; F159-N162 PolarHBondContact O-N 2.91Å; N162-H164 PolarHBondContact O-N 3.46Å; N162-L165 PolarHBondContact O-N 3.43Å; N162-R166 VanDerWaalsContact O-CG 3.26Å; N162-R166 WeakPolarHBondContact O-CG 3.47Å; N162-R166 PolarHBondContact O-N 2.82Å
163	R	91.2	Very high	92	Very high	44 Å²	44	35.8 Å²	35.8	17%	0.166	18%	0.177	C	C	.	.	H	α-helix	trans	-61.7	-42.8	178.3	-176.5	174.8	175.7	-129.7	-13.2	111.6	F159 C160 W161 R166 Y167 L209 E254	F159-R163 VanDerWaalsContact O-CB 3.26Å; F159-R163 WeakPolarHBondContact O-CB 3.23Å; F159-R163 PolarHBondContact O-N 3.46Å; C160-R163 PolarHBondContact O-N 3.01Å; W161-R163 VanDerWaalsContact C-N 3.25Å; W161-R163 PolarHBondContact O-N 2.87Å; R163-R166 PolarHBondContact O-N 2.91Å; R163-Y167 HydrophobicContact CG-CD2 4.06Å; R163-Y167 HydrophobicContact CG-CE2 3.74Å; R163-Y167 PolarHBondContact NH2-OH 3.41Å; R163-Y167 WeakPolarHBondContact O-CD2 3.49Å; R163-Y167 PolarHBondContact O-N 3.16Å; R163-L209 HydrophobicContact CG-CD1 4.35Å; R163-E254 IonicContact CZ-OE1 3.04Å; R163-E254 IonicContact NH1-OE1 3.94Å; R163-E254 PolarHBondContact NH1-OE1 2.89Å
164	H	91.7	Very high	91.3	Very high	22 Å²	22	37.4 Å²	37.4	10%	0.102	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-41.7	177.3	-72.6	-47	0	0	0	113.1	W117 R122 C160 W161 N162 R166 Y167 V168	W117-H164 HydrophobicContact CH2-CB 4.39Å; W117-H164 HydrophobicContact CZ2-CB 3.9Å; R122-H164 PolarHBondContact NH1-CD2 2.98Å; R122-H164 PolarHBondContact NH1-CE1 3.48Å; R122-H164 VanDerWaalsContact NH1-CG 3.31Å; R122-H164 PolarHBondContact NH1-ND1 3.06Å; R122-H164 PolarHBondContact NH1-NE2 3.24Å; R122-H164 VanDerWaalsContact NH1-NE2 3.15Å; C160-H164 PolarHBondContact O-CD2 3.36Å; C160-H164 VanDerWaalsContact O-CG 3.29Å; C160-H164 PolarHBondContact O-N 2.89Å; W161-H164 PolarHBondContact O-N 3.34Å; W161-H164 VanDerWaalsContact O-N 3.15Å; N162-H164 PolarHBondContact O-N 3.46Å; H164-R166 VanDerWaalsContact C-N 3.33Å; H164-Y167 WeakPolarHBondContact O-CB 3.39Å; H164-Y167 PolarHBondContact O-N 3.23Å; H164-V168 WeakPolarHBondContact O-CG2 3.26Å; H164-V168 PolarHBondContact O-N 3.4Å; H164-V168 VanDerWaalsContact O-N 3.16Å
165	L	94.8	Very high	90	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-67.5	-35.7	176.9	-67.4	169.2	0	0	0	112	W117 I133 M134 W137 W161 N162 Y167 V168 A169 I230 I234	W117-L165 HydrophobicContact CH2-CD2 3.78Å; W117-L165 HydrophobicContact CH2-CG 4.34Å; W117-L165 HydrophobicContact CZ2-CD2 4.25Å; I133-L165 HydrophobicContact CG2-CD1 4.08Å; M134-L165 HydrophobicContact CG-CD1 4.47Å; M134-L165 HydrophobicContact CG-CD2 4.01Å; W137-L165 HydrophobicContact CB-CD1 3.5Å; W137-L165 VanDerWaalsContact CB-CD1 3.5Å; W137-L165 HydrophobicContact CD2-CB 3.65Å; W137-L165 HydrophobicContact CD2-CD1 3.8Å; W137-L165 HydrophobicContact CD2-CG 4.29Å; W137-L165 HydrophobicContact CE3-CB 4.12Å; W137-L165 HydrophobicContact CE3-CD1 4.37Å; W137-L165 HydrophobicContact CG-CB 4.01Å; W137-L165 HydrophobicContact CG-CD1 3.36Å; W137-L165 HydrophobicContact CG-CG 4.29Å; W137-L165 HydrophobicContact CH2-CB 4.45Å; W137-L165 HydrophobicContact CZ2-CB 3.98Å; W137-L165 HydrophobicContact CZ3-CB 4.49Å; W161-L165 WeakPolarHBondContact O-CG 3.3Å; W161-L165 PolarHBondContact O-N 3.24Å; N162-L165 PolarHBondContact O-N 3.43Å; L165-Y167 VanDerWaalsContact C-N 3.33Å; L165-Y167 PolarHBondContact O-N 3.02Å; L165-V168 PolarHBondContact O-N 3.36Å; L165-A169 WeakPolarHBondContact O-CB 3.34Å; L165-A169 PolarHBondContact O-N 3.46Å; L165-I230 HydrophobicContact CD2-CD1 4.47Å; L165-I230 HydrophobicContact CD2-CG1 4.04Å; L165-I234 HydrophobicContact CD2-CD1 4.22Å
166	R	93.9	Very high	88.2	Confident	30 Å²	30	30.6 Å²	30.6	11%	0.113	17%	0.17	C	C	.	.	H	α-helix	trans	-63.4	-36.7	171.3	-70.6	172.4	179.6	120.4	18.4	113.3	W137 N162 R163 H164 A169 A170 L209 E213	W137-R166 HydrophobicContact CZ2-CG 4.24Å; N162-R166 VanDerWaalsContact O-CG 3.26Å; N162-R166 WeakPolarHBondContact O-CG 3.47Å; N162-R166 PolarHBondContact O-N 2.82Å; R163-R166 PolarHBondContact O-N 2.91Å; H164-R166 VanDerWaalsContact C-N 3.33Å; R166-A169 PolarHBondContact O-N 2.94Å; R166-A170 WeakPolarHBondContact O-CB 3.26Å; R166-A170 PolarHBondContact O-N 2.89Å; R166-L209 HydrophobicContact CB-CB 3.87Å; R166-L209 HydrophobicContact CB-CD1 4.44Å; R166-L209 HydrophobicContact CB-CD2 3.96Å; R166-L209 HydrophobicContact CB-CG 4.32Å; R166-L209 HydrophobicContact CG-CB 4.39Å; R166-E213 HydrophobicContact CG-CB 4.11Å; R166-E213 VanDerWaalsContact CG-OE2 3.31Å; R166-E213 WeakPolarHBondContact CG-OE2 3.39Å; R166-E213 IonicContact CZ-OE2 2.85Å; R166-E213 VanDerWaalsContact CZ-OE2 3.28Å; R166-E213 IonicContact NE-OE2 3.65Å; R166-E213 PolarHBondContact NE-OE2 2.89Å; R166-E213 IonicContact NH2-OE2 3.24Å; R166-E213 PolarHBondContact NH2-OE2 2.91Å
167	Y	91.8	Very high	86.2	Confident	41 Å²	41	32 Å²	32	16%	0.161	18%	0.183	C	C	.	.	H	α-helix	trans	-62.9	-45.1	174.1	-86	-65.8	0	0	0	111.4	R163 H164 L165 A169 A170 E171 L179 L209	R163-Y167 HydrophobicContact CG-CD2 4.06Å; R163-Y167 HydrophobicContact CG-CE2 3.74Å; R163-Y167 PolarHBondContact NH2-OH 3.41Å; R163-Y167 WeakPolarHBondContact O-CD2 3.49Å; R163-Y167 PolarHBondContact O-N 3.16Å; H164-Y167 WeakPolarHBondContact O-CB 3.39Å; H164-Y167 PolarHBondContact O-N 3.23Å; L165-Y167 VanDerWaalsContact C-N 3.33Å; L165-Y167 PolarHBondContact O-N 3.02Å; Y167-A169 VanDerWaalsContact C-N 3.31Å; Y167-A169 PolarHBondContact O-N 3.36Å; Y167-A170 PolarHBondContact O-N 3.08Å; Y167-E171 WeakPolarHBondContact O-CG 3.47Å; Y167-E171 PolarHBondContact O-N 2.92Å; Y167-L179 HydrophobicContact CE1-CB 4.45Å; Y167-L209 HydrophobicContact CD1-CD2 3.97Å; Y167-L209 HydrophobicContact CE1-CD1 4.39Å; Y167-L209 HydrophobicContact CE1-CD2 4.17Å; Y167-L209 HydrophobicContact CE2-CD1 4.19Å; Y167-L209 HydrophobicContact CG-CD2 4.25Å
168	V	93.6	Very high	84.3	Confident	1 Å²	1	36 Å²	36	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-58.7	-45.5	174.7	175.7	0	0	0	0	110.5	W117 H164 L165 A170 E171 A172 I230 D233 I234 L237	W117-V168 HydrophobicContact CZ2-CG2 3.97Å; H164-V168 WeakPolarHBondContact O-CG2 3.26Å; H164-V168 PolarHBondContact O-N 3.4Å; H164-V168 VanDerWaalsContact O-N 3.16Å; L165-V168 PolarHBondContact O-N 3.36Å; V168-A170 PolarHBondContact O-N 3.5Å; V168-E171 PolarHBondContact O-N 2.92Å; V168-A172 VanDerWaalsContact O-CB 3.27Å; V168-A172 WeakPolarHBondContact O-CB 3.35Å; V168-A172 PolarHBondContact O-N 3.23Å; V168-I230 HydrophobicContact CB-CD1 4.3Å; V168-I230 HydrophobicContact CG1-CD1 3.76Å; V168-D233 HydrophobicContact CG1-CB 3.89Å; V168-I234 HydrophobicContact CG1-CG1 3.83Å; V168-I234 HydrophobicContact CG2-CG1 4.08Å; V168-L237 HydrophobicContact CG1-CD1 4.1Å
169	A	93.8	Very high	82.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-44.6	177.1	0	0	0	0	0	112.6	W137 L165 R166 Y167 A172 V173 W216	W137-A169 HydrophobicContact CH2-CB 3.92Å; L165-A169 WeakPolarHBondContact O-CB 3.34Å; L165-A169 PolarHBondContact O-N 3.46Å; R166-A169 PolarHBondContact O-N 2.94Å; Y167-A169 VanDerWaalsContact C-N 3.31Å; Y167-A169 PolarHBondContact O-N 3.36Å; A169-A172 PolarHBondContact O-N 3.32Å; A169-V173 WeakPolarHBondContact O-CG2 3.46Å; A169-V173 PolarHBondContact O-N 2.9Å; A169-W216 HydrophobicContact CB-CB 3.75Å; A169-W216 HydrophobicContact CB-CD2 4.36Å; A169-W216 HydrophobicContact CB-CG 3.71Å
170	A	91.2	Very high	80.5	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-64.7	-43.7	177.7	0	0	0	0	0	112.8	R166 Y167 V168 A172 V173 G174 D175 L179 L209 C212	R166-A170 WeakPolarHBondContact O-CB 3.26Å; R166-A170 PolarHBondContact O-N 2.89Å; Y167-A170 PolarHBondContact O-N 3.08Å; V168-A170 PolarHBondContact O-N 3.5Å; A170-A172 VanDerWaalsContact C-N 3.27Å; A170-A172 PolarHBondContact O-N 3.25Å; A170-V173 PolarHBondContact O-N 3.12Å; A170-G174 PolarHBondContact O-N 3.08Å; A170-D175 PolarHBondContact O-N 2.94Å; A170-L179 HydrophobicContact CB-CD1 3.64Å; A170-L209 HydrophobicContact CB-CD2 4.1Å; A170-C212 HydrophobicContact CB-CB 3.66Å
171	E	90.5	Very high	78.3	Confident	57 Å²	57	38.1 Å²	38.1	27%	0.266	24%	0.235	S	C	.	.	H	α-helix	trans	-61.8	-36.7	172.7	-74.5	-175.9	-119.4	0	0	111.9	Y167 V168 G174 A176 L237 H238	Y167-E171 WeakPolarHBondContact O-CG 3.47Å; Y167-E171 PolarHBondContact O-N 2.92Å; V168-E171 PolarHBondContact O-N 2.92Å; E171-G174 PolarHBondContact O-N 3.21Å; E171-A176 HydrophobicContact CB-CB 4.3Å; E171-A176 HydrophobicContact CG-CB 3.68Å; E171-L237 HydrophobicContact CB-CD1 3.65Å; E171-L237 HydrophobicContact CB-CD2 4.12Å; E171-L237 HydrophobicContact CB-CG 4.48Å; E171-H238 IonicContact OE1-CE1 2.65Å; E171-H238 PolarHBondContact OE1-CE1 3.17Å; E171-H238 IonicContact OE1-NE2 3.28Å; E171-H238 IonicContact OE2-CE1 2.99Å
172	A	92.2	Very high	76.2	Confident	15 Å²	15	43.9 Å²	43.9	12%	0.124	26%	0.26	C	S	.	.	H	α-helix	trans	-73.5	-34.5	178.9	0	0	0	0	0	113.3	V168 A169 A170 G174 R219 D233 L237	V168-A172 VanDerWaalsContact O-CB 3.27Å; V168-A172 WeakPolarHBondContact O-CB 3.35Å; V168-A172 PolarHBondContact O-N 3.23Å; A169-A172 PolarHBondContact O-N 3.32Å; A170-A172 VanDerWaalsContact C-N 3.27Å; A170-A172 PolarHBondContact O-N 3.25Å; A172-G174 VanDerWaalsContact C-N 3.27Å; A172-R219 PolarHBondContact O-NH1 2.94Å; A172-D233 HydrophobicContact CB-CB 4.2Å; A172-D233 WeakPolarHBondContact CB-OD1 3.35Å; A172-L237 HydrophobicContact CB-CD1 4.09Å
173	V	89.8	Confident	73.7	Confident	39 Å²	39	48 Å²	48	24%	0.236	29%	0.287	C	S	.	.	H	α-helix	trans	-72.1	-21.8	175.6	170	0	0	0	0	111.9	A169 A170 M215 W216	A169-V173 WeakPolarHBondContact O-CG2 3.46Å; A169-V173 PolarHBondContact O-N 2.9Å; A170-V173 PolarHBondContact O-N 3.12Å; V173-M215 HydrophobicContact CG1-CB 4.25Å; V173-M215 HydrophobicContact CG1-CE 3.68Å; V173-M215 HydrophobicContact CG1-SD 4.4Å; V173-M215 HydrophobicContact CG2-CB 4.19Å; V173-W216 HydrophobicContact CG2-CB 3.86Å
174	G	79.9	Confident	71.3	Confident	50 Å²	50	48.9 Å²	48.9	52%	0.515	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.4	1.9	-179.3	0	0	0	0	0	114.2	A170 E171 A172 A176 P177	A170-G174 PolarHBondContact O-N 3.08Å; E171-G174 PolarHBondContact O-N 3.21Å; A172-G174 VanDerWaalsContact C-N 3.27Å; G174-A176 VanDerWaalsContact C-N 3.32Å; G174-A176 PolarHBondContact O-N 3.03Å; G174-P177 VanDerWaalsContact O-CD 3.31Å; G174-P177 WeakPolarHBondContact O-CD 3.26Å
175	D	63.5	Low	68.9	Low	71 Å²	71	58.5 Å²	58.5	38%	0.38	34%	0.335	S	S	.	.			trans	-89.6	8.6	-179.6	-76.2	-31.7	0	0	0	113.8	A170 P177	A170-D175 PolarHBondContact O-N 2.94Å; D175-P177 VanDerWaalsContact C-N 3.34Å
176	A	52.7	Low	66.5	Low	17 Å²	17	64.7 Å²	64.7	14%	0.14	37%	0.373	C	S	.	.	H	α-helix	trans	-56.3	-29	175.9	0	0	0	0	0	117.1	E171 G174 V178 L179 L180	E171-A176 HydrophobicContact CB-CB 4.3Å; E171-A176 HydrophobicContact CG-CB 3.68Å; G174-A176 VanDerWaalsContact C-N 3.32Å; G174-A176 PolarHBondContact O-N 3.03Å; A176-V178 PolarHBondContact O-N 3.19Å; A176-V178 VanDerWaalsContact O-N 3.08Å; A176-L179 PolarHBondContact O-N 3.1Å; A176-L179 VanDerWaalsContact O-N 3.12Å; A176-L180 HydrophobicContact CB-CD1 4.36Å; A176-L180 PolarHBondContact O-N 2.96Å
177	P	49.3	Very low	64.2	Low	108 Å²	108	71 Å²	71	70%	0.701	40%	0.404	S	S	*	.	H	α-helix	trans	-59.2	-25.4	-176.6	-24.9	33.8	0	0	0	114.4	G174 D175	G174-P177 VanDerWaalsContact O-CD 3.31Å; G174-P177 WeakPolarHBondContact O-CD 3.26Å; D175-P177 VanDerWaalsContact C-N 3.34Å
178	V	50.9	Low	61.6	Low	120 Å²	120	71.9 Å²	71.9	73%	0.727	41%	0.411	S	S	*	.	H	α-helix	trans	-84.9	-25.4	-179.1	-177.7	0	0	0	0	112.5	A176	A176-V178 PolarHBondContact O-N 3.19Å; A176-V178 VanDerWaalsContact O-N 3.08Å
179	L	51	Low	59.5	Low	17 Å²	17	77.5 Å²	77.5	9%	0.089	45%	0.445	C	S	.	.	H	α-helix	trans	-92.6	-17.6	-171.1	-69.5	168	0	0	0	114.4	Y167 A170 A176 I205 Q208 L209	Y167-L179 HydrophobicContact CE1-CB 4.45Å; A170-L179 HydrophobicContact CB-CD1 3.64Å; A176-L179 PolarHBondContact O-N 3.1Å; A176-L179 VanDerWaalsContact O-N 3.12Å; L179-I205 HydrophobicContact CD2-CB 4.47Å; L179-I205 HydrophobicContact CD2-CG1 4.45Å; L179-I205 HydrophobicContact CD2-CG2 4.1Å; L179-Q208 HydrophobicContact CD2-CB 3.84Å; L179-L209 HydrophobicContact CD1-CD2 3.67Å; L179-L209 HydrophobicContact CD1-CG 4.28Å; L179-L209 HydrophobicContact CD2-CG 4.41Å
180	L	52.5	Low	57.3	Low	95 Å²	95	87.5 Å²	87.5	50%	0.497	49%	0.488	S	S	.	.			trans	-96.1	0.6	-174.8	-65.8	175.7	0	0	0	114.3	A176 K182	A176-L180 HydrophobicContact CB-CD1 4.36Å; A176-L180 PolarHBondContact O-N 2.96Å; L180-K182 PolarHBondContact O-N 3.48Å
181	G	43.3	Very low	55.6	Low	64 Å²	64	89.8 Å²	89.8	66%	0.66	50%	0.504	S	S	*	.			trans	-66.5	69.1	166.7	0	0	0	0	0	111.2	P183	G181-P183 WeakPolarHBondContact O-CD 3.45Å
182	K	49.1	Very low	54.2	Low	129 Å²	129	94.1 Å²	94.1	56%	0.561	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-58.5	117.5	175.1	-71.2	-176.5	-177.2	-178.8	0	108.2	L180 S184 P250	L180-K182 PolarHBondContact O-N 3.48Å; K182-S184 PolarHBondContact O-N 2.89Å; K182-S184 VanDerWaalsContact O-N 3.14Å; K182-P250 PolarHBondContact NZ-O 2.93Å
183	P	40.2	Very low	53.1	Low	87 Å²	87	97.6 Å²	97.6	57%	0.565	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-61.1	122	161.1	-13.7	28.6	0	0	0	106.6	G181 R185	G181-P183 WeakPolarHBondContact O-CD 3.45Å; P183-R185 PolarHBondContact O-N 3.41Å
184	S	41.2	Very low	52.1	Low	63 Å²	63	96 Å²	96	44%	0.441	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-58.3	137.8	175.1	57	0	0	0	0	109.3	K182 T186 Q187	K182-S184 PolarHBondContact O-N 2.89Å; K182-S184 VanDerWaalsContact O-N 3.14Å; S184-T186 PolarHBondContact O-N 2.84Å; S184-T186 PolarHBondContact OG-OG1 3.36Å; S184-Q187 PolarHBondContact O-N 2.98Å
185	R	42.7	Very low	51.8	Low	224 Å²	224	96.3 Å²	96.3	85%	0.845	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-54.1	-16.4	177.7	-178.1	173.7	176.6	168.8	0.1	112.9	P183	P183-R185 PolarHBondContact O-N 3.41Å
186	T	42.9	Very low	52.2	Low	130 Å²	130	95.8 Å²	95.8	80%	0.798	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-86.6	-0.7	-172	40.9	0	0	0	0	115.2	S184	S184-T186 PolarHBondContact O-N 2.84Å; S184-T186 PolarHBondContact OG-OG1 3.36Å
187	Q	46.1	Very low	53.2	Low	163 Å²	163	100.9 Å²	100.9	76%	0.762	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-112	1.2	-179	-76.2	-165	-11.7	0	0	117.4	S184	S184-Q187 PolarHBondContact O-N 2.98Å
188	L	38.2	Very low	54.2	Low	59 Å²	59	100.5 Å²	100.5	31%	0.309	54%	0.54	S	S	.	.			trans	-116.3	90.6	-176.9	-84.7	155.4	0	0	0	113.5	A194 R198	L188-A194 HydrophobicContact CD2-CB 3.46Å; L188-A194 VanDerWaalsContact CD2-CB 3.46Å; L188-R198 HydrophobicContact CD1-CG 3.92Å
189	V	48	Very low	55.4	Low	118 Å²	118	100.2 Å²	100.2	72%	0.715	53%	0.526	S	S	*	.			trans	-40.8	140.7	162	178.6	0	0	0	0	111.6	S191 A194	V189-S191 PolarHBondContact O-N 3.41Å; V189-A194 WeakPolarHBondContact O-CB 3.38Å
190	K	47.1	Very low	56.4	Low	210 Å²	210	106.5 Å²	106.5	91%	0.913	55%	0.549	S	S	*	.	S	Bend	trans	-65.3	89.9	175.1	-64.8	176.1	-179.2	176.2	0	110.1
191	S	56.3	Low	57.5	Low	49 Å²	49	104.7 Å²	104.7	34%	0.343	54%	0.538	S	S	.	.			trans	-139.1	156.4	167.3	73.3	0	0	0	0	111.1	V189 S193 A194 Q195	V189-S191 PolarHBondContact O-N 3.41Å; S191-S193 PolarHBondContact O-N 3.23Å; S191-S193 PolarHBondContact OG-OG 2.91Å; S191-A194 WeakPolarHBondContact O-CB 3.26Å; S191-A194 PolarHBondContact O-N 3.11Å; S191-A194 VanDerWaalsContact O-N 3.17Å; S191-A194 WeakPolarHBondContact OG-CB 3.44Å; S191-A194 PolarHBondContact OG-N 3.01Å; S191-Q195 PolarHBondContact O-N 3.3Å; S191-Q195 VanDerWaalsContact O-N 3.12Å
192	L	60.3	Low	59.1	Low	149 Å²	149	106.6 Å²	106.6	78%	0.78	53%	0.533	S	S	*	.	H	α-helix	trans	-59.3	-34.6	172.8	-75.2	165.9	0	0	0	111.6	Q195 A196	L192-Q195 PolarHBondContact O-N 3.24Å; L192-A196 PolarHBondContact O-N 3.04Å
193	S	69.9	Low	60.5	Low	87 Å²	87	109.4 Å²	109.4	61%	0.608	54%	0.54	S	S	*	.	H	α-helix	trans	-64.3	-39.8	174.9	58.6	0	0	0	0	112.3	S191 Q195 A196 K197	S191-S193 PolarHBondContact O-N 3.23Å; S191-S193 PolarHBondContact OG-OG 2.91Å; S193-Q195 VanDerWaalsContact C-N 3.33Å; S193-Q195 PolarHBondContact O-N 3.16Å; S193-A196 PolarHBondContact O-N 3.21Å; S193-K197 WeakPolarHBondContact O-CB 3.37Å; S193-K197 PolarHBondContact O-N 3.38Å
194	A	69.9	Low	62.4	Low	5 Å²	5	108.8 Å²	108.8	4%	0.041	53%	0.529	C	S	.	.	H	α-helix	trans	-64.7	-36.1	173.5	0	0	0	0	0	112.1	L188 V189 S191 R198	L188-A194 HydrophobicContact CD2-CB 3.46Å; L188-A194 VanDerWaalsContact CD2-CB 3.46Å; V189-A194 WeakPolarHBondContact O-CB 3.38Å; S191-A194 WeakPolarHBondContact O-CB 3.26Å; S191-A194 PolarHBondContact O-N 3.11Å; S191-A194 VanDerWaalsContact O-N 3.17Å; S191-A194 WeakPolarHBondContact OG-CB 3.44Å; S191-A194 PolarHBondContact OG-N 3.01Å; A194-R198 WeakPolarHBondContact O-CB 3.38Å; A194-R198 WeakPolarHBondContact O-CG 3.47Å; A194-R198 PolarHBondContact O-N 3.42Å; A194-R198 VanDerWaalsContact O-N 3.1Å; A194-R198 PolarHBondContact O-NE 3Å
195	Q	72	Confident	64.2	Low	58 Å²	58	108 Å²	108	27%	0.271	52%	0.52	S	S	.	.	H	α-helix	trans	-70.1	-42.7	175.4	-168.2	178.5	29.6	0	0	112.2	S191 L192 S193 R198 R199	S191-Q195 PolarHBondContact O-N 3.3Å; S191-Q195 VanDerWaalsContact O-N 3.12Å; L192-Q195 PolarHBondContact O-N 3.24Å; S193-Q195 VanDerWaalsContact C-N 3.33Å; S193-Q195 PolarHBondContact O-N 3.16Å; Q195-R198 PolarHBondContact O-N 2.92Å; Q195-R199 WeakPolarHBondContact O-CG 3.4Å; Q195-R199 PolarHBondContact O-N 2.91Å
196	A	73.5	Confident	66.1	Low	60 Å²	60	99.7 Å²	99.7	50%	0.496	50%	0.499	S	S	.	.	H	α-helix	trans	-62.6	-46.5	176.6	0	0	0	0	0	111.7	L192 S193 R198 R199 Y200	L192-A196 PolarHBondContact O-N 3.04Å; S193-A196 PolarHBondContact O-N 3.21Å; A196-R198 PolarHBondContact O-N 3.37Å; A196-R199 PolarHBondContact O-N 3.33Å; A196-R199 VanDerWaalsContact O-N 3.17Å; A196-Y200 PolarHBondContact O-N 3.14Å
197	K	73	Confident	68.1	Low	123 Å²	123	97.7 Å²	97.7	54%	0.535	48%	0.483	S	S	.	.	H	α-helix	trans	-57.4	-47.8	175.2	-176	173.4	177.5	178	0	111.5	S193 R199 Y200 E201	S193-K197 WeakPolarHBondContact O-CB 3.37Å; S193-K197 PolarHBondContact O-N 3.38Å; K197-R199 PolarHBondContact O-N 2.68Å; K197-Y200 WeakPolarHBondContact O-CB 3.41Å; K197-Y200 PolarHBondContact O-N 2.68Å; K197-E201 WeakPolarHBondContact CE-OE1 3.46Å; K197-E201 WeakPolarHBondContact CG-OE1 3.29Å; K197-E201 WeakPolarHBondContact O-CG 3.26Å; K197-E201 PolarHBondContact O-N 3.03Å
198	R	70.2	Confident	69.9	Low	100 Å²	100	93.7 Å²	93.7	38%	0.377	46%	0.464	S	S	.	.	H	α-helix	trans	-58.3	-43.7	174.7	-77.5	179.5	-71.4	-167.2	0.5	112.6	L188 A194 Q195 A196 Y200 E201 L202	L188-R198 HydrophobicContact CD1-CG 3.92Å; A194-R198 WeakPolarHBondContact O-CB 3.38Å; A194-R198 WeakPolarHBondContact O-CG 3.47Å; A194-R198 PolarHBondContact O-N 3.42Å; A194-R198 VanDerWaalsContact O-N 3.1Å; A194-R198 PolarHBondContact O-NE 3Å; Q195-R198 PolarHBondContact O-N 2.92Å; A196-R198 PolarHBondContact O-N 3.37Å; R198-Y200 VanDerWaalsContact C-N 3.34Å; R198-Y200 PolarHBondContact O-N 3.48Å; R198-E201 PolarHBondContact O-N 3.09Å; R198-L202 WeakPolarHBondContact O-CB 3.29Å; R198-L202 WeakPolarHBondContact O-CG 3.45Å; R198-L202 PolarHBondContact O-N 3.37Å
199	R	75.6	Confident	72.3	Confident	115 Å²	115	91.1 Å²	91.1	43%	0.434	45%	0.45	S	S	.	.	H	α-helix	trans	-62.7	-41	177.2	-76.3	176.8	174.5	176.7	-1.5	111.7	Q195 A196 K197 R203	Q195-R199 WeakPolarHBondContact O-CG 3.4Å; Q195-R199 PolarHBondContact O-N 2.91Å; A196-R199 PolarHBondContact O-N 3.33Å; A196-R199 VanDerWaalsContact O-N 3.17Å; K197-R199 PolarHBondContact O-N 2.68Å; R199-R203 VanDerWaalsContact O-CG 3.29Å; R199-R203 WeakPolarHBondContact O-CG 3.31Å; R199-R203 PolarHBondContact O-N 3.04Å
200	Y	73.4	Confident	74.2	Confident	148 Å²	148	90.5 Å²	90.5	58%	0.58	44%	0.44	S	S	*	.	H	α-helix	trans	-63.6	-49.7	176.3	177.4	-98.4	0	0	0	111.7	A196 K197 R198 L202 R203 Q204	A196-Y200 PolarHBondContact O-N 3.14Å; K197-Y200 WeakPolarHBondContact O-CB 3.41Å; K197-Y200 PolarHBondContact O-N 2.68Å; R198-Y200 VanDerWaalsContact C-N 3.34Å; R198-Y200 PolarHBondContact O-N 3.48Å; Y200-L202 VanDerWaalsContact C-N 3.33Å; Y200-L202 PolarHBondContact O-N 3.15Å; Y200-R203 WeakPolarHBondContact O-CB 3.39Å; Y200-R203 PolarHBondContact O-N 3.02Å; Y200-R203 VanDerWaalsContact O-N 3.14Å; Y200-Q204 HydrophobicContact CD1-CG 4.29Å; Y200-Q204 HydrophobicContact CE1-CG 3.85Å; Y200-Q204 HydrophobicContact CE2-CG 4.34Å; Y200-Q204 WeakPolarHBondContact O-CG 3.45Å; Y200-Q204 PolarHBondContact O-N 3.45Å; Y200-Q204 PolarHBondContact OH-NE2 2.93Å; Y200-Q204 VanDerWaalsContact OH-NE2 3.08Å
201	E	75.6	Confident	76.3	Confident	57 Å²	57	84.4 Å²	84.4	27%	0.266	42%	0.417	S	S	.	.	H	α-helix	trans	-58.9	-43.4	177.2	-70.9	168	176.5	0	0	111.8	K197 R198 R203 Q204 I205	K197-E201 WeakPolarHBondContact CE-OE1 3.46Å; K197-E201 WeakPolarHBondContact CG-OE1 3.29Å; K197-E201 WeakPolarHBondContact O-CG 3.26Å; K197-E201 PolarHBondContact O-N 3.03Å; R198-E201 PolarHBondContact O-N 3.09Å; E201-R203 VanDerWaalsContact C-N 3.34Å; E201-R203 PolarHBondContact O-N 2.88Å; E201-Q204 PolarHBondContact O-N 3.14Å; E201-I205 VanDerWaalsContact O-CG1 3.31Å; E201-I205 WeakPolarHBondContact O-CG1 3.46Å; E201-I205 PolarHBondContact O-N 3.4Å
202	L	76.7	Confident	77.9	Confident	104 Å²	104	82.2 Å²	82.2	55%	0.545	40%	0.401	S	S	.	.	H	α-helix	trans	-64.3	-37.2	176.3	-72.4	172.6	0	0	0	112.7	R198 Y200 A206	R198-L202 WeakPolarHBondContact O-CB 3.29Å; R198-L202 WeakPolarHBondContact O-CG 3.45Å; R198-L202 PolarHBondContact O-N 3.37Å; Y200-L202 VanDerWaalsContact C-N 3.33Å; Y200-L202 PolarHBondContact O-N 3.15Å; L202-A206 VanDerWaalsContact O-CB 3.3Å; L202-A206 WeakPolarHBondContact O-CB 3.41Å; L202-A206 PolarHBondContact O-N 3.49Å
203	R	78.6	Confident	79.5	Confident	189 Å²	189	75.7 Å²	75.7	71%	0.713	37%	0.367	S	S	*	.	H	α-helix	trans	-65.6	-41.5	173.9	-76	174.1	-179.5	-173.6	-0.6	111.5	R199 Y200 E201 A206 L207	R199-R203 VanDerWaalsContact O-CG 3.29Å; R199-R203 WeakPolarHBondContact O-CG 3.31Å; R199-R203 PolarHBondContact O-N 3.04Å; Y200-R203 WeakPolarHBondContact O-CB 3.39Å; Y200-R203 PolarHBondContact O-N 3.02Å; Y200-R203 VanDerWaalsContact O-N 3.14Å; E201-R203 VanDerWaalsContact C-N 3.34Å; E201-R203 PolarHBondContact O-N 2.88Å; R203-A206 PolarHBondContact O-N 3.19Å; R203-L207 WeakPolarHBondContact O-CB 3.48Å; R203-L207 PolarHBondContact O-N 3.05Å
204	Q	78.9	Confident	80.6	Confident	74 Å²	74	77.9 Å²	77.9	35%	0.346	37%	0.366	S	S	.	.	H	α-helix	trans	-62.9	-48.2	175.9	-71.6	-64.2	-10.6	0	0	111.2	Y200 E201 A206 L207 Q208	Y200-Q204 HydrophobicContact CD1-CG 4.29Å; Y200-Q204 HydrophobicContact CE1-CG 3.85Å; Y200-Q204 HydrophobicContact CE2-CG 4.34Å; Y200-Q204 WeakPolarHBondContact O-CG 3.45Å; Y200-Q204 PolarHBondContact O-N 3.45Å; Y200-Q204 PolarHBondContact OH-NE2 2.93Å; Y200-Q204 VanDerWaalsContact OH-NE2 3.08Å; E201-Q204 PolarHBondContact O-N 3.14Å; Q204-A206 VanDerWaalsContact C-N 3.3Å; Q204-A206 PolarHBondContact O-N 2.94Å; Q204-L207 PolarHBondContact O-N 3.02Å; Q204-Q208 WeakPolarHBondContact O-CB 3.36Å; Q204-Q208 VanDerWaalsContact O-CG 3.26Å; Q204-Q208 WeakPolarHBondContact O-CG 3.49Å; Q204-Q208 PolarHBondContact O-N 3.37Å
205	I	79.7	Confident	81.6	Confident	47 Å²	47	81.8 Å²	81.8	24%	0.241	38%	0.384	C	S	.	.	H	α-helix	trans	-57.4	-44.2	174.4	-69.6	166	0	0	0	110.8	L179 E201 L207 Q208 L209	L179-I205 HydrophobicContact CD2-CB 4.47Å; L179-I205 HydrophobicContact CD2-CG1 4.45Å; L179-I205 HydrophobicContact CD2-CG2 4.1Å; E201-I205 VanDerWaalsContact O-CG1 3.31Å; E201-I205 WeakPolarHBondContact O-CG1 3.46Å; E201-I205 PolarHBondContact O-N 3.4Å; I205-L207 PolarHBondContact O-N 3.46Å; I205-Q208 PolarHBondContact O-N 2.92Å; I205-L209 HydrophobicContact CG2-CD1 3.92Å; I205-L209 HydrophobicContact CG2-CG 4.36Å; I205-L209 WeakPolarHBondContact O-CB 3.11Å; I205-L209 VanDerWaalsContact O-CG 3.26Å; I205-L209 WeakPolarHBondContact O-CG 3.49Å; I205-L209 PolarHBondContact O-N 3.15Å
206	A	82.7	Confident	82.7	Confident	49 Å²	49	79 Å²	79	41%	0.405	37%	0.371	S	S	.	.	H	α-helix	trans	-62.6	-42.9	179.1	0	0	0	0	0	112.4	L202 R203 Q204 L209 Q210	L202-A206 VanDerWaalsContact O-CB 3.3Å; L202-A206 WeakPolarHBondContact O-CB 3.41Å; L202-A206 PolarHBondContact O-N 3.49Å; R203-A206 PolarHBondContact O-N 3.19Å; Q204-A206 VanDerWaalsContact C-N 3.3Å; Q204-A206 PolarHBondContact O-N 2.94Å; A206-L209 PolarHBondContact O-N 3.5Å; A206-Q210 WeakPolarHBondContact O-CG 3.45Å; A206-Q210 PolarHBondContact O-N 3.47Å
207	L	84.1	Confident	83.7	Confident	87 Å²	87	79.1 Å²	79.1	46%	0.455	36%	0.359	S	S	.	.	H	α-helix	trans	-64.7	-45.2	176.9	-176.6	63.8	0	0	0	111.4	R203 Q204 I205 L209 Q210 L211	R203-L207 WeakPolarHBondContact O-CB 3.48Å; R203-L207 PolarHBondContact O-N 3.05Å; Q204-L207 PolarHBondContact O-N 3.02Å; I205-L207 PolarHBondContact O-N 3.46Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 3.01Å; L207-Q210 WeakPolarHBondContact O-CB 3.41Å; L207-Q210 PolarHBondContact O-N 3.34Å; L207-Q210 VanDerWaalsContact O-N 3.13Å; L207-L211 WeakPolarHBondContact O-CG 3.44Å; L207-L211 PolarHBondContact O-N 3.29Å
208	Q	85.1	Confident	84.5	Confident	80 Å²	80	78.2 Å²	78.2	37%	0.374	36%	0.36	S	S	.	.	H	α-helix	trans	-59.6	-43.4	176.3	-71.1	-62.6	-28.6	0	0	111.8	L179 Q204 I205 Q210 L211 C212	L179-Q208 HydrophobicContact CD2-CB 3.84Å; Q204-Q208 WeakPolarHBondContact O-CB 3.36Å; Q204-Q208 VanDerWaalsContact O-CG 3.26Å; Q204-Q208 WeakPolarHBondContact O-CG 3.49Å; Q204-Q208 PolarHBondContact O-N 3.37Å; I205-Q208 PolarHBondContact O-N 2.92Å; Q208-Q210 VanDerWaalsContact C-N 3.32Å; Q208-Q210 PolarHBondContact O-N 3.33Å; Q208-L211 PolarHBondContact O-N 2.98Å; Q208-C212 PolarHBondContact O-N 3.14Å; Q208-C212 PolarHBondContact O-SG 2.66Å
209	L	88.1	Confident	85.5	Confident	4 Å²	4	78.5 Å²	78.5	2%	0.021	36%	0.361	C	S	.	.	H	α-helix	trans	-64.1	-34.7	175.4	-77.2	177.2	0	0	0	112.8	R163 R166 Y167 A170 L179 I205 A206 L207 E213	R163-L209 HydrophobicContact CG-CD1 4.35Å; R166-L209 HydrophobicContact CB-CB 3.87Å; R166-L209 HydrophobicContact CB-CD1 4.44Å; R166-L209 HydrophobicContact CB-CD2 3.96Å; R166-L209 HydrophobicContact CB-CG 4.32Å; R166-L209 HydrophobicContact CG-CB 4.39Å; Y167-L209 HydrophobicContact CD1-CD2 3.97Å; Y167-L209 HydrophobicContact CE1-CD1 4.39Å; Y167-L209 HydrophobicContact CE1-CD2 4.17Å; Y167-L209 HydrophobicContact CE2-CD1 4.19Å; Y167-L209 HydrophobicContact CG-CD2 4.25Å; A170-L209 HydrophobicContact CB-CD2 4.1Å; L179-L209 HydrophobicContact CD1-CD2 3.67Å; L179-L209 HydrophobicContact CD1-CG 4.28Å; L179-L209 HydrophobicContact CD2-CG 4.41Å; I205-L209 HydrophobicContact CG2-CD1 3.92Å; I205-L209 HydrophobicContact CG2-CG 4.36Å; I205-L209 WeakPolarHBondContact O-CB 3.11Å; I205-L209 VanDerWaalsContact O-CG 3.26Å; I205-L209 WeakPolarHBondContact O-CG 3.49Å; I205-L209 PolarHBondContact O-N 3.15Å; A206-L209 PolarHBondContact O-N 3.5Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 3.01Å; L209-E213 WeakPolarHBondContact O-CB 3.48Å; L209-E213 PolarHBondContact O-N 3.42Å
210	Q	88.5	Confident	86.2	Confident	105 Å²	105	74.9 Å²	74.9	49%	0.491	35%	0.35	S	S	.	.	H	α-helix	trans	-68.9	-39.6	173.6	-76	179.8	-35.8	0	0	112.3	A206 L207 Q208 E213 F214	A206-Q210 WeakPolarHBondContact O-CG 3.45Å; A206-Q210 PolarHBondContact O-N 3.47Å; L207-Q210 WeakPolarHBondContact O-CB 3.41Å; L207-Q210 PolarHBondContact O-N 3.34Å; L207-Q210 VanDerWaalsContact O-N 3.13Å; Q208-Q210 VanDerWaalsContact C-N 3.32Å; Q208-Q210 PolarHBondContact O-N 3.33Å; Q210-E213 PolarHBondContact O-N 2.9Å; Q210-F214 PolarHBondContact O-N 3.15Å
211	L	90	Very high	86.8	Confident	83 Å²	83	69.5 Å²	69.5	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-64	-45.5	174.1	-68.6	173.9	0	0	0	111.2	L207 Q208 E213 F214 M215	L207-L211 WeakPolarHBondContact O-CG 3.44Å; L207-L211 PolarHBondContact O-N 3.29Å; Q208-L211 PolarHBondContact O-N 2.98Å; L211-E213 VanDerWaalsContact C-N 3.31Å; L211-E213 PolarHBondContact O-N 2.99Å; L211-F214 WeakPolarHBondContact O-CB 3.41Å; L211-F214 PolarHBondContact O-N 3.27Å; L211-F214 VanDerWaalsContact O-N 3.11Å; L211-M215 WeakPolarHBondContact O-CG 3.44Å; L211-M215 PolarHBondContact O-N 3.07Å
212	C	91	Very high	87.1	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.014	37%	0.374	C	S	.	.	H	α-helix	trans	-59.5	-41.9	174.8	-70.3	0	0	0	0	111.9	A170 Q208 F214 M215 W216	A170-C212 HydrophobicContact CB-CB 3.66Å; Q208-C212 PolarHBondContact O-N 3.14Å; Q208-C212 PolarHBondContact O-SG 2.66Å; C212-F214 VanDerWaalsContact C-N 3.35Å; C212-M215 PolarHBondContact O-N 2.76Å; C212-W216 WeakPolarHBondContact O-CB 3.01Å; C212-W216 PolarHBondContact O-N 2.93Å
213	E	93.4	Very high	87.2	Confident	13 Å²	13	71.1 Å²	71.1	6%	0.061	37%	0.373	C	S	.	.	H	α-helix	trans	-60.4	-43	173.7	163.8	-178.4	169.3	0	0	111.8	W137 T142 R166 L209 Q210 L211 W216 R217	W137-E213 HydrophobicContact CH2-CG 4.14Å; W137-E213 HydrophobicContact CZ2-CB 4.08Å; W137-E213 HydrophobicContact CZ2-CG 3.64Å; T142-E213 WeakPolarHBondContact CG2-OE1 3.22Å; R166-E213 HydrophobicContact CG-CB 4.11Å; R166-E213 VanDerWaalsContact CG-OE2 3.31Å; R166-E213 WeakPolarHBondContact CG-OE2 3.39Å; R166-E213 IonicContact CZ-OE2 2.85Å; R166-E213 VanDerWaalsContact CZ-OE2 3.28Å; R166-E213 IonicContact NE-OE2 3.65Å; R166-E213 PolarHBondContact NE-OE2 2.89Å; R166-E213 IonicContact NH2-OE2 3.24Å; R166-E213 PolarHBondContact NH2-OE2 2.91Å; L209-E213 WeakPolarHBondContact O-CB 3.48Å; L209-E213 PolarHBondContact O-N 3.42Å; Q210-E213 PolarHBondContact O-N 2.9Å; L211-E213 VanDerWaalsContact C-N 3.31Å; L211-E213 PolarHBondContact O-N 2.99Å; E213-W216 PolarHBondContact O-N 3.14Å; E213-R217 VanDerWaalsContact CD-NH1 3.28Å; E213-R217 PolarHBondContact O-N 3.01Å; E213-R217 VanDerWaalsContact O-N 3.11Å; E213-R217 IonicContact OE1-CZ 2.72Å; E213-R217 IonicContact OE1-NH1 3.16Å; E213-R217 PolarHBondContact OE1-NH1 2.99Å; E213-R217 IonicContact OE1-NH2 3.3Å; E213-R217 PolarHBondContact OE1-NH2 3.27Å
214	F	92.1	Very high	87.6	Confident	132 Å²	132	66.2 Å²	66.2	58%	0.579	36%	0.361	S	S	*	.	H	α-helix	trans	-63.6	-48.9	175.1	176.2	-97.6	0	0	0	111.7	Q210 L211 C212 W216 R217 N218	Q210-F214 PolarHBondContact O-N 3.15Å; L211-F214 WeakPolarHBondContact O-CB 3.41Å; L211-F214 PolarHBondContact O-N 3.27Å; L211-F214 VanDerWaalsContact O-N 3.11Å; C212-F214 VanDerWaalsContact C-N 3.35Å; F214-W216 VanDerWaalsContact C-N 3.29Å; F214-W216 PolarHBondContact O-N 2.66Å; F214-R217 PolarHBondContact O-N 3.39Å; F214-N218 VanDerWaalsContact CD1-ND2 3.3Å; F214-N218 WeakPolarHBondContact CD1-ND2 3.42Å; F214-N218 WeakPolarHBondContact CD2-ND2 3.37Å; F214-N218 WeakPolarHBondContact CE1-ND2 3.38Å; F214-N218 WeakPolarHBondContact CE2-ND2 3.37Å; F214-N218 WeakPolarHBondContact CG-ND2 3.2Å; F214-N218 WeakPolarHBondContact CZ-ND2 3.22Å; F214-N218 PolarHBondContact O-N 3.17Å; F214-N218 PolarHBondContact O-ND2 2.79Å
215	M	92.3	Very high	88.2	Confident	88 Å²	88	63.3 Å²	63.3	43%	0.433	35%	0.348	S	S	.	.	H	α-helix	trans	-59.8	-41.6	176.8	-69.2	171.8	69.8	0	0	111.6	V173 L211 C212 R217 N218 R219	V173-M215 HydrophobicContact CG1-CB 4.25Å; V173-M215 HydrophobicContact CG1-CE 3.68Å; V173-M215 HydrophobicContact CG1-SD 4.4Å; V173-M215 HydrophobicContact CG2-CB 4.19Å; L211-M215 WeakPolarHBondContact O-CG 3.44Å; L211-M215 PolarHBondContact O-N 3.07Å; C212-M215 PolarHBondContact O-N 2.76Å; M215-R217 VanDerWaalsContact C-N 3.33Å; M215-R217 PolarHBondContact O-N 3.45Å; M215-N218 PolarHBondContact O-N 2.82Å; M215-R219 PolarHBondContact O-N 3.4Å
216	W	95	Very high	88.9	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-60.9	-39.1	177	-178.7	93.1	0	0	0	112.5	W137 A169 V173 C212 E213 F214 R219 L220 A226 A229 I230 D233	W137-W216 HydrophobicContact CH2-CE3 4.1Å; W137-W216 HydrophobicContact CH2-CZ3 4.44Å; W137-W216 HydrophobicContact CZ3-CD2 4.49Å; W137-W216 AromaticContact CZ3-CE3 3.91Å; W137-W216 HydrophobicContact CZ3-CE3 3.91Å; W137-W216 HydrophobicContact CZ3-CH2 4.27Å; W137-W216 AromaticContact CZ3-CZ3 3.79Å; W137-W216 HydrophobicContact CZ3-CZ3 3.79Å; A169-W216 HydrophobicContact CB-CB 3.75Å; A169-W216 HydrophobicContact CB-CD2 4.36Å; A169-W216 HydrophobicContact CB-CG 3.71Å; V173-W216 HydrophobicContact CG2-CB 3.86Å; C212-W216 WeakPolarHBondContact O-CB 3.01Å; C212-W216 PolarHBondContact O-N 2.93Å; E213-W216 PolarHBondContact O-N 3.14Å; F214-W216 VanDerWaalsContact C-N 3.29Å; F214-W216 PolarHBondContact O-N 2.66Å; W216-R219 VanDerWaalsContact CD1-NH2 3.29Å; W216-R219 VanDerWaalsContact O-CG 3.31Å; W216-R219 WeakPolarHBondContact O-CG 3.48Å; W216-L220 HydrophobicContact CH2-CD1 3.95Å; W216-L220 HydrophobicContact CZ2-CD2 4.49Å; W216-L220 HydrophobicContact CZ3-CD1 3.94Å; W216-A226 WeakPolarHBondContact CH2-O 3.48Å; W216-A229 HydrophobicContact CH2-CB 4.21Å; W216-A229 HydrophobicContact CZ2-CB 3.96Å; W216-I230 HydrophobicContact CH2-CB 3.77Å; W216-I230 HydrophobicContact CH2-CD1 4.48Å; W216-I230 HydrophobicContact CZ2-CB 3.73Å; W216-I230 HydrophobicContact CZ2-CD1 3.98Å; W216-I230 HydrophobicContact CZ2-CG1 4.43Å; W216-D233 PolarHBondContact NE1-OD2 3.05Å
217	R	93	Very high	89.6	Confident	62 Å²	62	59.7 Å²	59.7	23%	0.234	33%	0.325	C	S	.	.	H	α-helix	trans	-71.5	-39.1	175.1	-69.9	-163.9	-172.2	89.6	5.3	112.7	W137 E213 F214 M215 R219 L220	W137-R217 PolarHBondContact O-NH2 3.34Å; E213-R217 VanDerWaalsContact CD-NH1 3.28Å; E213-R217 PolarHBondContact O-N 3.01Å; E213-R217 VanDerWaalsContact O-N 3.11Å; E213-R217 IonicContact OE1-CZ 2.72Å; E213-R217 IonicContact OE1-NH1 3.16Å; E213-R217 PolarHBondContact OE1-NH1 2.99Å; E213-R217 IonicContact OE1-NH2 3.3Å; E213-R217 PolarHBondContact OE1-NH2 3.27Å; F214-R217 PolarHBondContact O-N 3.39Å; M215-R217 VanDerWaalsContact C-N 3.33Å; M215-R217 PolarHBondContact O-N 3.45Å; R217-R219 VanDerWaalsContact C-N 3.28Å; R217-R219 PolarHBondContact O-N 3.09Å; R217-L220 PolarHBondContact O-N 3.17Å
218	N	91.2	Very high	90.2	Very high	104 Å²	104	57.7 Å²	57.7	56%	0.556	32%	0.315	S	S	*	.	H	α-helix	trans	-72.8	-18.4	-177.9	-73.9	-65.8	0	0	0	113.9	F214 M215 L220	F214-N218 VanDerWaalsContact CD1-ND2 3.3Å; F214-N218 WeakPolarHBondContact CD1-ND2 3.42Å; F214-N218 WeakPolarHBondContact CD2-ND2 3.37Å; F214-N218 WeakPolarHBondContact CE1-ND2 3.38Å; F214-N218 WeakPolarHBondContact CE2-ND2 3.37Å; F214-N218 WeakPolarHBondContact CG-ND2 3.2Å; F214-N218 WeakPolarHBondContact CZ-ND2 3.22Å; F214-N218 PolarHBondContact O-N 3.17Å; F214-N218 PolarHBondContact O-ND2 2.79Å; M215-N218 PolarHBondContact O-N 2.82Å; N218-L220 VanDerWaalsContact C-N 3.32Å
219	R	91.3	Very high	90.7	Very high	106 Å²	106	54.8 Å²	54.8	40%	0.4	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-16	176.4	87.5	-163.5	177	146	10.7	113.6	A172 M215 W216 R217 D233	A172-R219 PolarHBondContact O-NH1 2.94Å; M215-R219 PolarHBondContact O-N 3.4Å; W216-R219 VanDerWaalsContact CD1-NH2 3.29Å; W216-R219 VanDerWaalsContact O-CG 3.31Å; W216-R219 WeakPolarHBondContact O-CG 3.48Å; R217-R219 VanDerWaalsContact C-N 3.28Å; R217-R219 PolarHBondContact O-N 3.09Å; R219-D233 IonicContact CZ-OD2 3.54Å; R219-D233 VanDerWaalsContact NH2-CG 3.32Å; R219-D233 IonicContact NH2-OD1 2.67Å; R219-D233 PolarHBondContact NH2-OD1 3.17Å; R219-D233 IonicContact NH2-OD2 2.7Å; R219-D233 PolarHBondContact NH2-OD2 3.41Å
220	L	90.5	Very high	91.1	Very high	39 Å²	39	54.6 Å²	54.6	20%	0.204	30%	0.304	C	S	.	.	S	Bend	trans	-70.8	133.3	-177.4	-59.8	179.8	0	0	0	109.6	W216 R217 N218 D224 A226 A229	W216-L220 HydrophobicContact CH2-CD1 3.95Å; W216-L220 HydrophobicContact CZ2-CD2 4.49Å; W216-L220 HydrophobicContact CZ3-CD1 3.94Å; R217-L220 PolarHBondContact O-N 3.17Å; N218-L220 VanDerWaalsContact C-N 3.32Å; L220-D224 HydrophobicContact CB-CB 4.22Å; L220-A226 HydrophobicContact CD1-CB 3.66Å; L220-A229 HydrophobicContact CD1-CB 4.39Å; L220-A229 HydrophobicContact CD2-CB 3.59Å
221	G	85.9	Confident	91.5	Very high	35 Å²	35	49.9 Å²	49.9	36%	0.361	28%	0.281	S	S	.	.			trans	-68.2	161.7	174.6	0	0	0	0	0	111.9	S223 D224	G221-S223 PolarHBondContact O-N 3.1Å; G221-S223 VanDerWaalsContact O-N 3.13Å; G221-D224 PolarHBondContact N-OD2 3.39Å; G221-D224 WeakPolarHBondContact O-CB 3.47Å; G221-D224 PolarHBondContact O-N 2.92Å
222	A	80.3	Confident	91.9	Very high	120 Å²	120	49.3 Å²	49.3	99%	0.992	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.6	179.6	0	0	0	0	0	113.6
223	S	80.1	Confident	92.1	Very high	74 Å²	74	49.8 Å²	49.8	52%	0.517	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-7.9	176.7	55.3	0	0	0	0	114	S49 G221	S49-S223 VanDerWaalsContact CB-O 3.24Å; S49-S223 WeakPolarHBondContact CB-O 3.34Å; S49-S223 PolarHBondContact OG-O 3.46Å; G221-S223 PolarHBondContact O-N 3.1Å; G221-S223 VanDerWaalsContact O-N 3.13Å
224	D	86.2	Confident	92.3	Very high	86 Å²	86	49.1 Å²	49.1	46%	0.46	28%	0.284	S	S	.	.			trans	-82.1	126.7	-172.7	-65.1	-19.5	0	0	0	110.7	L220 G221 A226	L220-D224 HydrophobicContact CB-CB 4.22Å; G221-D224 PolarHBondContact N-OD2 3.39Å; G221-D224 WeakPolarHBondContact O-CB 3.47Å; G221-D224 PolarHBondContact O-N 2.92Å; D224-A226 PolarHBondContact O-N 3.14Å
225	D	92.6	Very high	92.4	Very high	14 Å²	14	45.9 Å²	45.9	8%	0.075	27%	0.272	C	S	.	.			trans	-78.5	110.2	169.6	-178.8	-107.2	0	0	0	108.9	K52 R139 F227 D228 A229	K52-D225 WeakPolarHBondContact CD-OD1 3.25Å; K52-D225 PolarHBondContact N-OD2 2.98Å; K52-D225 VanDerWaalsContact NZ-CG 3.35Å; K52-D225 IonicContact NZ-OD1 3.7Å; K52-D225 PolarHBondContact NZ-OD1 2.92Å; R139-D225 IonicContact NH2-OD2 3.73Å; D225-F227 PolarHBondContact O-N 2.78Å; D225-F227 WeakPolarHBondContact OD1-CB 3.14Å; D225-D228 HydrophobicContact CB-CB 4.38Å; D225-D228 PolarHBondContact O-N 2.75Å; D225-D228 PolarHBondContact OD1-N 2.74Å; D225-D228 VanDerWaalsContact OD1-N 3.13Å; D225-A229 PolarHBondContact O-N 2.99Å
226	A	94.5	Very high	92.6	Very high	20 Å²	20	48.4 Å²	48.4	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-54.6	-30.1	-176.2	0	0	0	0	0	113.5	S138 W216 L220 D224 I230	S138-A226 WeakPolarHBondContact CB-O 3.45Å; W216-A226 WeakPolarHBondContact CH2-O 3.48Å; L220-A226 HydrophobicContact CD1-CB 3.66Å; D224-A226 PolarHBondContact O-N 3.14Å; A226-I230 PolarHBondContact O-N 3.43Å; A226-I230 VanDerWaalsContact O-N 3.14Å
227	F	96.8	Very high	92.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69.2	-48.4	175.5	177.9	-120	0	0	0	111.9	K52 W56 F70 V131 M134 F135 S138 D225 A229 I230 L231	K52-F227 HydrophobicContact CD-CD1 4.02Å; W56-F227 HydrophobicContact CH2-CD1 4.28Å; W56-F227 AromaticContact CH2-CE1 3.8Å; W56-F227 HydrophobicContact CH2-CE1 3.8Å; W56-F227 HydrophobicContact CZ3-CD1 4.01Å; W56-F227 AromaticContact CZ3-CE1 3.67Å; W56-F227 HydrophobicContact CZ3-CE1 3.67Å; F70-F227 HydrophobicContact CE1-CE1 4.14Å; F70-F227 AromaticContact CE1-CZ 3.94Å; F70-F227 HydrophobicContact CE1-CZ 3.94Å; F70-F227 AromaticContact CZ-CE1 3.68Å; F70-F227 HydrophobicContact CZ-CE1 3.68Å; F70-F227 AromaticContact CZ-CZ 3.97Å; F70-F227 HydrophobicContact CZ-CZ 3.97Å; V131-F227 HydrophobicContact CG1-CE2 4.45Å; V131-F227 HydrophobicContact CG1-CZ 3.81Å; M134-F227 HydrophobicContact CB-CD2 4.41Å; M134-F227 HydrophobicContact CB-CE2 3.86Å; F135-F227 VanDerWaalsContact CA-CD2 3.41Å; F135-F227 HydrophobicContact CB-CD2 3.85Å; F135-F227 HydrophobicContact CB-CE2 3.87Å; F135-F227 HydrophobicContact CB-CG 4.39Å; F135-F227 HydrophobicContact CB-CZ 4.44Å; F135-F227 HydrophobicContact CD2-CB 4.28Å; F135-F227 HydrophobicContact CD2-CD1 4.07Å; F135-F227 HydrophobicContact CD2-CD2 4.27Å; F135-F227 HydrophobicContact CD2-CE1 4.45Å; F135-F227 AromaticContact CD2-CG 3.94Å; F135-F227 HydrophobicContact CD2-CG 3.94Å; S138-F227 WeakPolarHBondContact OG-CA 3.48Å; S138-F227 PolarHBondContact OG-N 2.82Å; D225-F227 PolarHBondContact O-N 2.78Å; D225-F227 WeakPolarHBondContact OD1-CB 3.14Å; F227-A229 VanDerWaalsContact C-N 3.26Å; F227-A229 PolarHBondContact O-N 2.82Å; F227-I230 HydrophobicContact CD2-CG2 4.4Å; F227-I230 WeakPolarHBondContact O-CG2 3.41Å; F227-I230 PolarHBondContact O-N 3.44Å; F227-L231 HydrophobicContact CD1-CD1 4.27Å; F227-L231 HydrophobicContact CD2-CG 4.41Å; F227-L231 HydrophobicContact CE1-CD1 3.77Å; F227-L231 HydrophobicContact CE2-CD1 4.05Å; F227-L231 HydrophobicContact CE2-CD2 4Å; F227-L231 HydrophobicContact CE2-CG 4.1Å; F227-L231 HydrophobicContact CZ-CD1 3.64Å; F227-L231 HydrophobicContact CZ-CD2 4.24Å; F227-L231 HydrophobicContact CZ-CG 4.2Å; F227-L231 WeakPolarHBondContact O-CG 3.21Å; F227-L231 PolarHBondContact O-N 3.38Å
228	D	96.1	Very high	92.5	Very high	45 Å²	45	49.7 Å²	49.7	24%	0.241	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-35.5	173.4	-80.9	-15.2	0	0	0	112.7	K52 K74 D225 L231 S232	K52-D228 IonicContact NZ-OD1 2.6Å; K52-D228 PolarHBondContact NZ-OD1 2.9Å; K52-D228 IonicContact NZ-OD2 2.85Å; K52-D228 PolarHBondContact NZ-OD2 3.06Å; K74-D228 IonicContact NZ-OD1 3.89Å; K74-D228 PolarHBondContact NZ-OD1 3.14Å; K74-D228 IonicContact NZ-OD2 2.71Å; D225-D228 HydrophobicContact CB-CB 4.38Å; D225-D228 PolarHBondContact O-N 2.75Å; D225-D228 PolarHBondContact OD1-N 2.74Å; D225-D228 VanDerWaalsContact OD1-N 3.13Å; D228-L231 PolarHBondContact O-N 3.06Å; D228-S232 WeakPolarHBondContact O-CB 3.44Å; D228-S232 PolarHBondContact O-N 3.23Å; D228-S232 PolarHBondContact O-OG 3.08Å
229	A	95.8	Very high	92.6	Very high	19 Å²	19	47.9 Å²	47.9	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-60.8	-48.1	177.6	0	0	0	0	0	111.8	W216 L220 D225 F227 L231 S232 D233	W216-A229 HydrophobicContact CH2-CB 4.21Å; W216-A229 HydrophobicContact CZ2-CB 3.96Å; L220-A229 HydrophobicContact CD1-CB 4.39Å; L220-A229 HydrophobicContact CD2-CB 3.59Å; D225-A229 PolarHBondContact O-N 2.99Å; F227-A229 VanDerWaalsContact C-N 3.26Å; F227-A229 PolarHBondContact O-N 2.82Å; A229-L231 PolarHBondContact O-N 2.88Å; A229-S232 PolarHBondContact O-N 3.04Å; A229-D233 PolarHBondContact O-N 2.93Å
230	I	96.9	Very high	92.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.9	-37.7	179.6	-169.9	60.1	0	0	0	111.6	W137 L165 V168 W216 A226 F227 S232 D233 I234	W137-I230 HydrophobicContact CE3-CG1 4.3Å; W137-I230 HydrophobicContact CZ3-CD1 3.92Å; W137-I230 HydrophobicContact CZ3-CG1 4.14Å; L165-I230 HydrophobicContact CD2-CD1 4.47Å; L165-I230 HydrophobicContact CD2-CG1 4.04Å; V168-I230 HydrophobicContact CB-CD1 4.3Å; V168-I230 HydrophobicContact CG1-CD1 3.76Å; W216-I230 HydrophobicContact CH2-CB 3.77Å; W216-I230 HydrophobicContact CH2-CD1 4.48Å; W216-I230 HydrophobicContact CZ2-CB 3.73Å; W216-I230 HydrophobicContact CZ2-CD1 3.98Å; W216-I230 HydrophobicContact CZ2-CG1 4.43Å; A226-I230 PolarHBondContact O-N 3.43Å; A226-I230 VanDerWaalsContact O-N 3.14Å; F227-I230 HydrophobicContact CD2-CG2 4.4Å; F227-I230 WeakPolarHBondContact O-CG2 3.41Å; F227-I230 PolarHBondContact O-N 3.44Å; I230-S232 VanDerWaalsContact C-N 3.32Å; I230-S232 PolarHBondContact O-N 3.07Å; I230-D233 PolarHBondContact O-N 3.07Å; I230-I234 HydrophobicContact CG1-CD1 4.35Å; I230-I234 VanDerWaalsContact O-CG1 3.27Å; I230-I234 WeakPolarHBondContact O-CG1 3.33Å; I230-I234 PolarHBondContact O-N 3.37Å
231	L	97.7	Very high	92.6	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-63.1	-41.5	174.8	-62.3	-179	0	0	0	111.4	F70 K74 L76 M134 F227 D228 A229 I234 L235	F70-L231 HydrophobicContact CE1-CD1 3.88Å; F70-L231 HydrophobicContact CZ-CD1 3.74Å; K74-L231 HydrophobicContact CD-CD1 4.22Å; K74-L231 HydrophobicContact CG-CD1 4.14Å; L76-L231 HydrophobicContact CD1-CB 4.17Å; L76-L231 HydrophobicContact CD1-CD2 3.62Å; L76-L231 HydrophobicContact CD1-CG 4.36Å; M134-L231 HydrophobicContact CE-CD2 3.86Å; M134-L231 HydrophobicContact SD-CD2 3.79Å; F227-L231 HydrophobicContact CD1-CD1 4.27Å; F227-L231 HydrophobicContact CD2-CG 4.41Å; F227-L231 HydrophobicContact CE1-CD1 3.77Å; F227-L231 HydrophobicContact CE2-CD1 4.05Å; F227-L231 HydrophobicContact CE2-CD2 4Å; F227-L231 HydrophobicContact CE2-CG 4.1Å; F227-L231 HydrophobicContact CZ-CD1 3.64Å; F227-L231 HydrophobicContact CZ-CD2 4.24Å; F227-L231 HydrophobicContact CZ-CG 4.2Å; F227-L231 WeakPolarHBondContact O-CG 3.21Å; F227-L231 PolarHBondContact O-N 3.38Å; D228-L231 PolarHBondContact O-N 3.06Å; A229-L231 PolarHBondContact O-N 2.88Å; L231-I234 PolarHBondContact O-N 2.75Å; L231-L235 PolarHBondContact O-N 2.79Å
232	S	96.6	Very high	92	Very high	72 Å²	72	50.3 Å²	50.3	50%	0.503	29%	0.287	S	S	.	.	H	α-helix	trans	-64.7	-40	178	-57.9	0	0	0	0	111.8	D228 A229 I230 L235 R236	D228-S232 WeakPolarHBondContact O-CB 3.44Å; D228-S232 PolarHBondContact O-N 3.23Å; D228-S232 PolarHBondContact O-OG 3.08Å; A229-S232 PolarHBondContact O-N 3.04Å; I230-S232 VanDerWaalsContact C-N 3.32Å; I230-S232 PolarHBondContact O-N 3.07Å; S232-L235 PolarHBondContact O-N 3.1Å; S232-R236 VanDerWaalsContact O-CB 3.26Å; S232-R236 WeakPolarHBondContact O-CB 3.41Å; S232-R236 PolarHBondContact O-N 2.95Å
233	D	96.3	Very high	91.2	Very high	11 Å²	11	50.4 Å²	50.4	6%	0.059	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-42.7	174.1	-79.4	-45.6	0	0	0	112.4	V168 A172 W216 R219 A229 I230 L235 R236 L237	V168-D233 HydrophobicContact CG1-CB 3.89Å; A172-D233 HydrophobicContact CB-CB 4.2Å; A172-D233 WeakPolarHBondContact CB-OD1 3.35Å; W216-D233 PolarHBondContact NE1-OD2 3.05Å; R219-D233 IonicContact CZ-OD2 3.54Å; R219-D233 VanDerWaalsContact NH2-CG 3.32Å; R219-D233 IonicContact NH2-OD1 2.67Å; R219-D233 PolarHBondContact NH2-OD1 3.17Å; R219-D233 IonicContact NH2-OD2 2.7Å; R219-D233 PolarHBondContact NH2-OD2 3.41Å; A229-D233 PolarHBondContact O-N 2.93Å; I230-D233 PolarHBondContact O-N 3.07Å; D233-L235 VanDerWaalsContact C-N 3.32Å; D233-L235 PolarHBondContact O-N 3.12Å; D233-R236 PolarHBondContact O-N 3.04Å; D233-R236 IonicContact OD1-CZ 3.98Å; D233-R236 IonicContact OD1-NE 3.5Å; D233-R236 IonicContact OD1-NH2 3.69Å; D233-R236 PolarHBondContact OD1-NH2 3.47Å; D233-L237 HydrophobicContact CB-CD1 4.45Å; D233-L237 VanDerWaalsContact O-CB 3.28Å; D233-L237 WeakPolarHBondContact O-CB 3.41Å; D233-L237 VanDerWaalsContact O-CG 3.3Å; D233-L237 WeakPolarHBondContact O-CG 3.16Å; D233-L237 PolarHBondContact O-N 2.98Å
234	I	96.4	Very high	90	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-46.3	175.1	-64.9	167	0	0	0	110	L76 W117 M134 L165 V168 I230 L231 H238	L76-I234 HydrophobicContact CD2-CB 3.93Å; L76-I234 HydrophobicContact CD2-CG2 3.63Å; W117-I234 HydrophobicContact CB-CG2 3.71Å; W117-I234 HydrophobicContact CD2-CD1 4.49Å; W117-I234 HydrophobicContact CD2-CG2 3.78Å; W117-I234 HydrophobicContact CE3-CD1 4.27Å; W117-I234 HydrophobicContact CE3-CG2 4.17Å; W117-I234 HydrophobicContact CG-CG2 3.58Å; W117-I234 HydrophobicContact CH2-CD1 4.2Å; W117-I234 HydrophobicContact CZ2-CD1 4.41Å; W117-I234 HydrophobicContact CZ3-CD1 4.12Å; M134-I234 HydrophobicContact SD-CD1 3.61Å; L165-I234 HydrophobicContact CD2-CD1 4.22Å; V168-I234 HydrophobicContact CG1-CG1 3.83Å; V168-I234 HydrophobicContact CG2-CG1 4.08Å; I230-I234 HydrophobicContact CG1-CD1 4.35Å; I230-I234 VanDerWaalsContact O-CG1 3.27Å; I230-I234 WeakPolarHBondContact O-CG1 3.33Å; I230-I234 PolarHBondContact O-N 3.37Å; L231-I234 PolarHBondContact O-N 2.75Å; I234-H238 CarbonylContact O-C 3.46Å; I234-H238 WeakPolarHBondContact O-CA 3.45Å; I234-H238 WeakPolarHBondContact O-CB 3.11Å; I234-H238 PolarHBondContact O-N 3.21Å
235	L	96.2	Very high	88.2	Confident	64 Å²	64	46.8 Å²	46.8	34%	0.335	25%	0.253	S	S	.	.	H	α-helix	trans	-61.9	-46	179.4	178.7	60.5	0	0	0	111.7	G75 L76 L231 S232 D233 P239	G75-L235 VanDerWaalsContact O-CD1 3.24Å; G75-L235 WeakPolarHBondContact O-CD1 3.32Å; L76-L235 HydrophobicContact CD2-CB 3.83Å; L231-L235 PolarHBondContact O-N 2.79Å; S232-L235 PolarHBondContact O-N 3.1Å; D233-L235 VanDerWaalsContact C-N 3.32Å; D233-L235 PolarHBondContact O-N 3.12Å; L235-P239 WeakPolarHBondContact O-CA 3.47Å; L235-P239 WeakPolarHBondContact O-CB 3.29Å; L235-P239 WeakPolarHBondContact O-CD 3.28Å
236	R	95	Very high	85.9	Confident	140 Å²	140	50.7 Å²	50.7	53%	0.528	28%	0.279	S	S	.	.	H	α-helix	trans	-66	-42.7	-178.2	-177.4	-179.2	59.9	74.7	3.7	112.4	S232 D233	S232-R236 VanDerWaalsContact O-CB 3.26Å; S232-R236 WeakPolarHBondContact O-CB 3.41Å; S232-R236 PolarHBondContact O-N 2.95Å; D233-R236 PolarHBondContact O-N 3.04Å; D233-R236 IonicContact OD1-CZ 3.98Å; D233-R236 IonicContact OD1-NE 3.5Å; D233-R236 IonicContact OD1-NH2 3.69Å; D233-R236 PolarHBondContact OD1-NH2 3.47Å
237	L	93.4	Very high	83.4	Confident	41 Å²	41	54.6 Å²	54.6	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-85.9	-30.7	-175.5	-66.6	167.7	0	0	0	112.9	V168 E171 A172 D233	V168-L237 HydrophobicContact CG1-CD1 4.1Å; E171-L237 HydrophobicContact CB-CD1 3.65Å; E171-L237 HydrophobicContact CB-CD2 4.12Å; E171-L237 HydrophobicContact CB-CG 4.48Å; A172-L237 HydrophobicContact CB-CD1 4.09Å; D233-L237 HydrophobicContact CB-CD1 4.45Å; D233-L237 VanDerWaalsContact O-CB 3.28Å; D233-L237 WeakPolarHBondContact O-CB 3.41Å; D233-L237 VanDerWaalsContact O-CG 3.3Å; D233-L237 WeakPolarHBondContact O-CG 3.16Å; D233-L237 PolarHBondContact O-N 2.98Å
238	H	92.9	Very high	80.5	Confident	48 Å²	48	59.8 Å²	59.8	22%	0.222	33%	0.334	C	S	.	.	S	Bend	trans	-136.4	57.6	-173.5	-50.5	-55.4	0	0	0	112.2	W117 E171 I234	W117-H238 HydrophobicContact CB-CB 4.19Å; W117-H238 AromaticContact CD1-CD2 3.26Å; W117-H238 AromaticContact CD1-CG 3.66Å; W117-H238 HydrophobicContact CG-CB 4.35Å; W117-H238 AromaticContact NE1-CD2 3.54Å; E171-H238 IonicContact OE1-CE1 2.65Å; E171-H238 PolarHBondContact OE1-CE1 3.17Å; E171-H238 IonicContact OE1-NE2 3.28Å; E171-H238 IonicContact OE2-CE1 2.99Å; I234-H238 CarbonylContact O-C 3.46Å; I234-H238 WeakPolarHBondContact O-CA 3.45Å; I234-H238 WeakPolarHBondContact O-CB 3.11Å; I234-H238 PolarHBondContact O-N 3.21Å
239	P	93.6	Very high	78	Confident	66 Å²	66	61.4 Å²	61.4	43%	0.429	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-61.6	147.4	179.4	27.1	-34.8	0	0	0	111	L235 R241	L235-P239 WeakPolarHBondContact O-CA 3.47Å; L235-P239 WeakPolarHBondContact O-CB 3.29Å; L235-P239 WeakPolarHBondContact O-CD 3.28Å; P239-R241 PolarHBondContact O-N 3.48Å
240	P	92.9	Very high	75.1	Confident	29 Å²	29	64.7 Å²	64.7	19%	0.188	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-53.8	120.2	173.6	-28.4	36.9	0	0	0	112.5	G75 H78 G115 T116	G75-P240 WeakPolarHBondContact O-CD 3.42Å; G75-P240 VanDerWaalsContact O-CG 3.23Å; G75-P240 WeakPolarHBondContact O-CG 3.49Å; H78-P240 VanDerWaalsContact CE1-C 3.5Å; H78-P240 WeakPolarHBondContact CE1-CB 3.43Å; G115-P240 CarbonylContact O-C 3.57Å; G115-P240 WeakPolarHBondContact O-CA 3.47Å; T116-P240 HydrophobicContact CG2-CB 4.18Å; T116-P240 HydrophobicContact CG2-CG 4.39Å
241	R	88.4	Confident	72.7	Confident	95 Å²	95	68.3 Å²	68.3	36%	0.358	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-87.6	126.4	-178.7	-60.9	-171.9	-56.5	-71.4	-3.3	111.6	H78 G115 E119 P239 D243	H78-R241 PolarHBondContact CE1-O 2.59Å; H78-R241 VanDerWaalsContact CE1-O 3.27Å; H78-R241 PolarHBondContact NE2-O 2.71Å; G115-R241 PolarHBondContact O-N 3.35Å; E119-R241 IonicContact OE2-NH2 3.92Å; P239-R241 PolarHBondContact O-N 3.48Å; R241-D243 VanDerWaalsContact C-N 3.33Å
242	L	73.7	Confident	69.8	Low	107 Å²	107	72.1 Å²	72.1	56%	0.56	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-32.2	-179.4	-64.4	175.6	0	0	0	112.6	A244	L242-A244 PolarHBondContact O-N 3.44Å
243	D	62.9	Low	67.1	Low	122 Å²	122	72.7 Å²	72.7	65%	0.652	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	28.2	-165.3	68.7	-26.7	0	0	0	113.5	R241 S245	R241-D243 VanDerWaalsContact C-N 3.33Å; D243-S245 PolarHBondContact O-N 3.4Å
244	A	55.9	Low	64.5	Low	3 Å²	3	76.9 Å²	76.9	3%	0.025	43%	0.429	C	S	.	.			trans	-64	70.3	-173.5	0	0	0	0	0	113.8	R114 L242	R114-A244 HydrophobicContact CG-CB 4.09Å; R114-A244 VanDerWaalsContact CZ-O 3.32Å; R114-A244 PolarHBondContact NE-O 3.35Å; R114-A244 PolarHBondContact NH2-O 2.9Å; L242-A244 PolarHBondContact O-N 3.44Å
245	S	48.3	Very low	61.7	Low	81 Å²	81	81.6 Å²	81.6	57%	0.566	46%	0.462	S	S	*	.			trans	-45.9	143.4	146.2	-174.8	0	0	0	0	107.5	D243 T247	D243-S245 PolarHBondContact O-N 3.4Å; S245-T247 PolarHBondContact O-N 3.35Å; S245-T247 PolarHBondContact O-OG1 2.86Å
246	P	42.9	Very low	58.9	Low	96 Å²	96	85.9 Å²	85.9	62%	0.623	48%	0.475	S	S	*	.			trans	-69.4	79.2	-177.5	28.6	-31.7	0	0	0	109.7	P248	P246-P248 WeakPolarHBondContact O-CD 3.33Å
247	T	42.3	Very low	56.2	Low	102 Å²	102	83.3 Å²	83.3	63%	0.626	48%	0.475	S	S	*	.			trans	-84.8	112.7	166.3	-18.3	0	0	0	0	106.5	S245 I249	S245-T247 PolarHBondContact O-N 3.35Å; S245-T247 PolarHBondContact O-OG1 2.86Å; T247-I249 PolarHBondContact O-N 3.45Å; T247-I249 VanDerWaalsContact O-N 3.1Å
248	P	37	Very low	53.4	Low	109 Å²	109	88.7 Å²	88.7	71%	0.708	50%	0.499	S	S	*	.			trans	-65.5	116.3	174.9	-10.7	26.2	0	0	0	107.1	P246 P250	P246-P248 WeakPolarHBondContact O-CD 3.33Å; P248-P250 WeakPolarHBondContact O-CD 3.42Å; P248-P250 VanDerWaalsContact O-N 3.13Å
249	I	43.5	Very low	50.7	Low	79 Å²	79	91.1 Å²	91.1	41%	0.405	53%	0.527	S	S	.	.			trans	-61.8	115.1	161.3	-58.3	173.8	0	0	0	105.1	T247 L251	T247-I249 PolarHBondContact O-N 3.45Å; T247-I249 VanDerWaalsContact O-N 3.1Å; I249-L251 HydrophobicContact CG2-CG 4.28Å; I249-L251 PolarHBondContact O-N 2.85Å
250	P	34.6	Very low	48.2	Very low	89 Å²	89	93.8 Å²	93.8	58%	0.578	54%	0.542	S	S	*	.			trans	-71.5	105.6	-178.3	-10.9	26.4	0	0	0	107.5	K182 P248	K182-P250 PolarHBondContact NZ-O 2.93Å; P248-P250 WeakPolarHBondContact O-CD 3.42Å; P248-P250 VanDerWaalsContact O-N 3.13Å
251	L	45.7	Very low	45.4	Very low	75 Å²	75	97.7 Å²	97.7	39%	0.393	57%	0.567	S	S	.	*			trans	-101.7	135.9	173.9	-68.6	148	0	0	0	109.3	P121 I249 S253	P121-L251 HydrophobicContact CB-CD1 3.77Å; P121-L251 HydrophobicContact CG-CD1 3.49Å; P121-L251 VanDerWaalsContact CG-CD1 3.49Å; P121-L251 HydrophobicContact CG-CD2 3.93Å; P121-L251 HydrophobicContact CG-CG 4.28Å; I249-L251 HydrophobicContact CG2-CG 4.28Å; I249-L251 PolarHBondContact O-N 2.85Å; L251-S253 PolarHBondContact O-N 3.1Å
252	P	38	Very low	43.2	Very low	86 Å²	86	99.9 Å²	99.9	56%	0.558	59%	0.591	S	S	*	*			trans	-62.3	130.2	169.3	-11.4	26	0	0	0	108.9	E254	P252-E254 PolarHBondContact O-N 2.76Å
253	S	38.3	Very low	41.6	Very low	83 Å²	83	103.2 Å²	103.2	58%	0.58	60%	0.604	S	S	*	*			trans	-63.5	103.8	163.1	51.2	0	0	0	0	108.5	L251 S255	L251-S253 PolarHBondContact O-N 3.1Å; S253-S255 VanDerWaalsContact C-N 3.32Å; S253-S255 PolarHBondContact O-N 3.39Å; S253-S255 VanDerWaalsContact O-N 3.08Å
254	E	43.2	Very low	40.5	Very low	100 Å²	100	100.7 Å²	100.7	47%	0.467	61%	0.606	S	S	.	*			trans	-77	86.8	168.3	-77.6	178.3	-171.3	0	0	108.7	F159 R163 P252	F159-E254 WeakPolarHBondContact CE1-OE1 3.44Å; F159-E254 WeakPolarHBondContact CE1-OE2 3.35Å; R163-E254 IonicContact CZ-OE1 3.04Å; R163-E254 IonicContact NH1-OE1 3.94Å; R163-E254 PolarHBondContact NH1-OE1 2.89Å; P252-E254 PolarHBondContact O-N 2.76Å
255	S	36.8	Very low	39.9	Very low	99 Å²	99	110 Å²	110	69%	0.692	65%	0.646	S	S	*	*			trans	-80.8	120.3	158.1	56.8	0	0	0	0	108.2	S253	S253-S255 VanDerWaalsContact C-N 3.32Å; S253-S255 PolarHBondContact O-N 3.39Å; S253-S255 VanDerWaalsContact O-N 3.08Å
256	Y	36.8	Very low	39.6	Very low	154 Å²	154	117 Å²	117	60%	0.604	66%	0.66	S	S	*	*			trans	-42.1	135.4	169.1	-120.9	-120.4	0	0	0	111.9	N156 E258	N156-Y256 WeakPolarHBondContact OD1-CE2 3.3Å; Y256-E258 HydrophobicContact CD1-CG 4.24Å
257	V	39.8	Very low	39.7	Very low	86 Å²	86	121.8 Å²	121.8	52%	0.521	67%	0.674	S	S	.	*			trans	-123.3	106.2	151.7	-173.9	0	0	0	0	105.5
258	E	34.4	Very low	40.5	Very low	154 Å²	154	122.6 Å²	122.6	72%	0.72	68%	0.679	S	S	*	*			trans	-45.6	137.6	167.6	-79.1	171.6	132.3	0	0	110.3	Y256 V260	Y256-E258 HydrophobicContact CD1-CG 4.24Å; E258-V260 PolarHBondContact O-N 2.95Å; E258-V260 VanDerWaalsContact O-N 3.14Å
259	A	36.8	Very low	41.1	Very low	98 Å²	98	125.8 Å²	125.8	81%	0.81	72%	0.715	S	S	*	*			trans	-67.9	107.9	165.9	0	0	0	0	0	107.8
260	V	40	Very low	41	Very low	123 Å²	123	128.2 Å²	128.2	75%	0.745	73%	0.731	S	S	*	*			trans	-63.8	132.6	164.9	-178.6	0	0	0	0	107.7	E258 V262	E258-V260 PolarHBondContact O-N 2.95Å; E258-V260 VanDerWaalsContact O-N 3.14Å; V260-V262 PolarHBondContact O-N 2.93Å
261	P	34.3	Very low	41.3	Very low	110 Å²	110	130.2 Å²	130.2	71%	0.714	74%	0.739	S	S	*	*			trans	-63.4	131.9	174.6	-12.6	26.3	0	0	0	109.4	E263	P261-E263 PolarHBondContact O-N 2.89Å; P261-E263 VanDerWaalsContact O-N 3.14Å
262	V	42.8	Very low	41.1	Very low	141 Å²	141	133.3 Å²	133.3	86%	0.855	76%	0.758	S	S	*	*			trans	-74.9	101.9	167.6	177.7	0	0	0	0	106.7	V260 G264	V260-V262 PolarHBondContact O-N 2.93Å; V262-G264 PolarHBondContact O-N 3.13Å
263	E	40.3	Very low	41.3	Very low	178 Å²	178	136.1 Å²	136.1	83%	0.832	77%	0.77	S	S	*	*			trans	-62.2	105.4	163.8	-86.9	168.5	152.3	0	0	108.6	P261 K265	P261-E263 PolarHBondContact O-N 2.89Å; P261-E263 VanDerWaalsContact O-N 3.14Å; E263-K265 PolarHBondContact O-N 2.93Å
264	G	39.2	Very low	41.4	Very low	69 Å²	69	139.4 Å²	139.4	71%	0.711	78%	0.781	S	S	*	*			trans	-63.5	100	166.8	0	0	0	0	0	109	V262 R266	V262-G264 PolarHBondContact O-N 3.13Å; G264-R266 PolarHBondContact O-N 3.15Å
265	K	43.3	Very low	41.3	Very low	199 Å²	199	142 Å²	142	87%	0.865	80%	0.802	S	S	*	*			trans	-62.3	105.7	159.7	-75.9	-174.4	176.9	-177.6	0	107.6	E263 Q267	E263-K265 PolarHBondContact O-N 2.93Å; K265-Q267 PolarHBondContact O-N 3.12Å
266	R	42.2	Very low	41.6	Very low	228 Å²	228	145.1 Å²	145.1	86%	0.86	81%	0.81	S	S	*	*			trans	-53.1	115.6	156.1	-95.2	179.5	173.3	178	-2.8	107.9	G264	G264-R266 PolarHBondContact O-N 3.15Å
267	Q	43.7	Very low	42	Very low	195 Å²	195	144.4 Å²	144.4	91%	0.911	83%	0.826	S	S	*	*			trans	-102.4	99.7	147.8	-85.8	172.9	-19.5	0	0	105.8	K265	K265-Q267 PolarHBondContact O-N 3.12Å
268	T	59	Low	42.2	Very low	119 Å²	119	149.3 Å²	149.3	73%	0.73	85%	0.851	S	S	*	*			trans	-90	144.8	154.8	43.3	0	0	0	0	107.4
269	A	50.6	Low	42.9	Very low	177 Å²	177	148.8 Å²	148.8	100%	1.463	86%	0.863	S	S	*	*			trans	-44.1	0	-179	0	0	0	0	0	115.4

Retrieved 269 of 269 residues in 380.4 ms (Link to these results)

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