A0A077ZB34_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZB34, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 454 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	27.5	Very low	25.8	Very low	250 Å²	250	143.9 Å²	143.9	100%	1.232	83%	0.826	S	S	*	*				0	130.8	0	-82.6	174	162.6	0	0	108.1
2	A	26.5	Very low	25.4	Very low	93 Å²	93	143.4 Å²	143.4	77%	0.769	83%	0.827	S	S	*	*			trans	-71	145.9	162.2	0	0	0	0	0	110
3	Q	24.9	Very low	25.4	Very low	173 Å²	173	143.8 Å²	143.8	81%	0.808	82%	0.823	S	S	*	*				168.2	141	128.3	-94.7	179.9	6.9	0	0	112.1
4	N	25.6	Very low	25.2	Very low	126 Å²	126	140 Å²	140	67%	0.674	81%	0.806	S	S	*	*			trans	75.2	97.1	150.2	-61.2	-11.7	0	0	0	120
5	L	28.1	Very low	25.2	Very low	174 Å²	174	138.1 Å²	138.1	91%	0.911	81%	0.814	S	S	*	*			trans	-128	78.4	143.7	-78.1	166	0	0	0	108.1
6	T	25.8	Very low	25.1	Very low	121 Å²	121	136.3 Å²	136.3	74%	0.742	81%	0.805	S	S	*	*			trans	-101.7	85.9	154.7	44.4	0	0	0	0	106.3
7	D	25.2	Very low	24.9	Very low	168 Å²	168	138.5 Å²	138.5	90%	0.898	81%	0.805	S	S	*	*			trans	-176.7	62	162.6	-104.4	-10.9	0	0	0	110.6
8	S	27.9	Very low	25	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	81%	0.809	S	S	*	*			trans	-121.4	94.2	162.4	54.2	0	0	0	0	108.1	D10	S8-D10 PolarHBondContact O-N 2.92Å
9	G	21.9	Very low	24.9	Very low	70 Å²	70	137.5 Å²	137.5	72%	0.722	81%	0.81	S	S	*	*			trans	-57.2	123	146	0	0	0	0	0	107.6
10	D	23.9	Very low	24.9	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	81%	0.811	S	S	*	*			trans	163.9	100.4	164.8	-85.9	-21	0	0	0	104.5	S8	S8-D10 PolarHBondContact O-N 2.92Å
11	L	26.1	Very low	24.8	Very low	157 Å²	157	135.7 Å²	135.7	82%	0.822	81%	0.806	S	S	*	*				-158.7	101.1	75	-82.6	143.7	0	0	0	108.6	L13	L11-L13 PolarHBondContact O-N 3.02Å
12	V	21.6	Very low	24.8	Very low	138 Å²	138	132.1 Å²	132.1	84%	0.836	79%	0.789	S	S	*	*			trans	-74.1	99.7	156	178.6	0	0	0	0	105.5	P14	V12-P14 WeakPolarHBondContact O-CD 3.14Å
13	L	25.2	Very low	25.1	Very low	149 Å²	149	132.2 Å²	132.2	78%	0.78	78%	0.784	S	S	*	*			trans	-60.8	120.1	166.5	-80.6	167	0	0	0	107.1	L11 A15	L11-L13 PolarHBondContact O-N 3.02Å; L13-A15 PolarHBondContact O-N 3.03Å
14	P	22.8	Very low	25.3	Very low	90 Å²	90	130.9 Å²	130.9	58%	0.584	78%	0.783	S	S	*	*			trans	-60.7	131.9	-175.6	22.7	-31.1	0	0	0	109.7	V12 T16	V12-P14 WeakPolarHBondContact O-CD 3.14Å; P14-T16 HydrophobicContact CB-CG2 4.24Å; P14-T16 PolarHBondContact O-N 3.49Å; P14-T16 PolarHBondContact O-OG1 3.12Å
15	A	24.6	Very low	25.4	Very low	111 Å²	111	135.5 Å²	135.5	92%	0.917	79%	0.792	S	S	*	*			trans	-68.1	76.3	163.3	0	0	0	0	0	108.4	L13	L13-A15 PolarHBondContact O-N 3.03Å
16	T	24.5	Very low	25.6	Very low	109 Å²	109	134.6 Å²	134.6	67%	0.669	79%	0.787	S	S	*	*			trans	-119.4	104.7	172.5	40.9	0	0	0	0	108.4	P14	P14-T16 HydrophobicContact CB-CG2 4.24Å; P14-T16 PolarHBondContact O-N 3.49Å; P14-T16 PolarHBondContact O-OG1 3.12Å
17	E	21.6	Very low	26.3	Very low	175 Å²	175	132.1 Å²	132.1	82%	0.818	77%	0.77	S	S	*	*			trans	19.7	118.8	153.3	-62.9	178.3	165.7	0	0	117.7	C19	E17-C19 PolarHBondContact O-N 2.97Å
18	P	26.1	Very low	26.8	Very low	134 Å²	134	130.2 Å²	130.2	87%	0.87	76%	0.755	S	S	*	*			trans	-64.9	111.9	164.3	26.4	-29	0	0	0	108.5	T20	P18-T20 PolarHBondContact O-N 3.44Å
19	C	24.2	Very low	27.1	Very low	123 Å²	123	132.8 Å²	132.8	83%	0.831	76%	0.756	S	S	*	*			trans	-35.9	122.9	175.4	-60.8	0	0	0	0	112.8	E17	E17-C19 PolarHBondContact O-N 2.97Å
20	T	23.2	Very low	27.9	Very low	134 Å²	134	133.2 Å²	133.2	82%	0.822	74%	0.742	S	S	*	*			trans	-80.6	142.3	153.1	23.9	0	0	0	0	108.8	P18	P18-T20 PolarHBondContact O-N 3.44Å
21	S	24.6	Very low	28.3	Very low	103 Å²	103	130.7 Å²	130.7	72%	0.72	73%	0.728	S	S	*	*			trans	80	131.4	170	90.7	0	0	0	0	115.5
22	M	27	Very low	28.7	Very low	176 Å²	176	128.3 Å²	128.3	87%	0.867	71%	0.711	S	S	*	*	S	Bend	cis	-151.9	122.2	12.9	-73	179.1	-99	0	0	108.2
23	S	31.8	Very low	29.3	Very low	94 Å²	94	126.1 Å²	126.1	66%	0.657	70%	0.695	S	S	*	*	S	Bend	trans	178.1	-19.1	148.6	53.8	0	0	0	0	117.3	Y25	S23-Y25 VanDerWaalsContact C-N 3.33Å; S23-Y25 PolarHBondContact O-N 2.94Å
24	N	29.9	Very low	29.6	Very low	146 Å²	146	123.8 Å²	123.8	78%	0.781	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-81.4	0.6	-169.4	-72.4	6.3	0	0	0	116.7	L26	N24-L26 PolarHBondContact O-N 3.41Å
25	Y	28.5	Very low	30	Very low	223 Å²	223	120.9 Å²	120.9	88%	0.875	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-70.5	-15.9	172.2	-85.5	-77.4	0	0	0	113.4	S23 D27	S23-Y25 VanDerWaalsContact C-N 3.33Å; S23-Y25 PolarHBondContact O-N 2.94Å; Y25-D27 PolarHBondContact O-N 3.18Å
26	L	31.4	Very low	30.3	Very low	155 Å²	155	116.5 Å²	116.5	81%	0.812	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-81.8	-6.4	-172.8	-98.2	167.6	0	0	0	115.8	N24	N24-L26 PolarHBondContact O-N 3.41Å
27	D	40.5	Very low	30.6	Very low	69 Å²	69	114.6 Å²	114.6	37%	0.369	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-139.5	33.1	-176.9	-94	0.7	0	0	0	113.2	Y25 E29 N30 N31	Y25-D27 PolarHBondContact O-N 3.18Å; D27-E29 VanDerWaalsContact C-N 3.28Å; D27-E29 PolarHBondContact O-N 3.46Å; D27-N30 HydrophobicContact CB-CB 3.72Å; D27-N30 WeakPolarHBondContact OD1-CB 3.42Å; D27-N30 VanDerWaalsContact OD1-CG 3.29Å; D27-N30 PolarHBondContact OD1-ND2 2.93Å; D27-N30 PolarHBondContact OD2-ND2 3.31Å; D27-N31 WeakPolarHBondContact O-CA 3.41Å; D27-N31 WeakPolarHBondContact O-CB 3.45Å; D27-N31 PolarHBondContact O-N 3.42Å; D27-N31 PolarHBondContact O-ND2 3.46Å
28	E	36.2	Very low	31.1	Very low	128 Å²	128	111.6 Å²	111.6	60%	0.598	60%	0.6	S	S	*	*	H	α-helix	trans	-63.3	-38.4	168.2	-90.8	-167.8	-179.8	0	0	111.6	K32	E28-K32 WeakPolarHBondContact O-CB 3.3Å; E28-K32 WeakPolarHBondContact O-CG 3.43Å; E28-K32 PolarHBondContact O-N 3.21Å
29	E	34.2	Very low	31.6	Very low	155 Å²	155	106.9 Å²	106.9	72%	0.724	57%	0.565	S	S	*	*	H	α-helix	trans	-76.6	-40.1	178.4	-159	167.8	-157.5	0	0	111.4	D27 K32 N33	D27-E29 VanDerWaalsContact C-N 3.28Å; D27-E29 PolarHBondContact O-N 3.46Å; E29-K32 WeakPolarHBondContact O-CB 3.42Å; E29-K32 PolarHBondContact O-N 3.13Å; E29-N33 WeakPolarHBondContact O-CB 3.26Å; E29-N33 PolarHBondContact O-N 3.03Å
30	N	38.3	Very low	32.1	Very low	80 Å²	80	106.3 Å²	106.3	43%	0.428	55%	0.55	S	S	.	.	H	α-helix	trans	-66	-39.3	171.1	-106.4	-0.3	0	0	0	112.2	D27 K32 N33 I34	D27-N30 HydrophobicContact CB-CB 3.72Å; D27-N30 WeakPolarHBondContact OD1-CB 3.42Å; D27-N30 VanDerWaalsContact OD1-CG 3.29Å; D27-N30 PolarHBondContact OD1-ND2 2.93Å; D27-N30 PolarHBondContact OD2-ND2 3.31Å; N30-K32 VanDerWaalsContact C-N 3.34Å; N30-N33 CarbonylContact O-C 3.57Å; N30-N33 PolarHBondContact O-N 3.05Å; N30-I34 WeakPolarHBondContact O-CB 3.48Å; N30-I34 WeakPolarHBondContact O-CD1 3.3Å; N30-I34 WeakPolarHBondContact O-CG1 3.29Å; N30-I34 PolarHBondContact O-N 2.84Å
31	N	31.9	Very low	32.6	Very low	95 Å²	95	105.9 Å²	105.9	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-66.6	-35.7	173.2	-77.1	-37.2	0	0	0	111.6	D27 A35	D27-N31 WeakPolarHBondContact O-CA 3.41Å; D27-N31 WeakPolarHBondContact O-CB 3.45Å; D27-N31 PolarHBondContact O-N 3.42Å; D27-N31 PolarHBondContact O-ND2 3.46Å; N31-A35 WeakPolarHBondContact O-CB 3.13Å; N31-A35 PolarHBondContact O-N 3.17Å
32	K	34.8	Very low	33.1	Very low	107 Å²	107	101.8 Å²	101.8	47%	0.465	52%	0.515	S	S	.	.	H	α-helix	trans	-64.4	-42.2	171	-78.5	171.1	-173.7	173.8	0	111.4	E28 E29 N30 A36	E28-K32 WeakPolarHBondContact O-CB 3.3Å; E28-K32 WeakPolarHBondContact O-CG 3.43Å; E28-K32 PolarHBondContact O-N 3.21Å; E29-K32 WeakPolarHBondContact O-CB 3.42Å; E29-K32 PolarHBondContact O-N 3.13Å; N30-K32 VanDerWaalsContact C-N 3.34Å; K32-A36 VanDerWaalsContact O-CB 3.23Å; K32-A36 WeakPolarHBondContact O-CB 3.15Å; K32-A36 PolarHBondContact O-N 3.42Å
33	N	33.4	Very low	33.8	Very low	92 Å²	92	95.8 Å²	95.8	49%	0.492	49%	0.49	S	S	.	.	H	α-helix	trans	-66.6	-47.8	175.7	-74.8	-19.2	0	0	0	111.2	E29 N30 A35 A36 T37	E29-N33 WeakPolarHBondContact O-CB 3.26Å; E29-N33 PolarHBondContact O-N 3.03Å; N30-N33 CarbonylContact O-C 3.57Å; N30-N33 PolarHBondContact O-N 3.05Å; N33-A35 VanDerWaalsContact C-N 3.32Å; N33-A35 PolarHBondContact O-N 3.16Å; N33-A36 PolarHBondContact O-N 3.48Å; N33-T37 VanDerWaalsContact O-CB 3.28Å; N33-T37 WeakPolarHBondContact O-CB 3.34Å; N33-T37 PolarHBondContact O-N 2.79Å; N33-T37 PolarHBondContact O-OG1 2.82Å
34	I	32.1	Very low	34.4	Very low	100 Å²	100	93.1 Å²	93.1	51%	0.513	47%	0.469	S	S	.	.	H	α-helix	trans	-58.8	-44.5	175.6	-68.1	161.7	0	0	0	110.2	N30 Y38	N30-I34 WeakPolarHBondContact O-CB 3.48Å; N30-I34 WeakPolarHBondContact O-CD1 3.3Å; N30-I34 WeakPolarHBondContact O-CG1 3.29Å; N30-I34 PolarHBondContact O-N 2.84Å; I34-Y38 WeakPolarHBondContact O-CA 3.22Å; I34-Y38 WeakPolarHBondContact O-CB 3.32Å; I34-Y38 PolarHBondContact O-N 3.38Å
35	A	32.4	Very low	35.2	Very low	30 Å²	30	89.7 Å²	89.7	25%	0.248	45%	0.448	C	S	.	.	H	α-helix	trans	-64.2	-48.5	176	0	0	0	0	0	111	N31 N33 T37 Y38 W39	N31-A35 WeakPolarHBondContact O-CB 3.13Å; N31-A35 PolarHBondContact O-N 3.17Å; N33-A35 VanDerWaalsContact C-N 3.32Å; N33-A35 PolarHBondContact O-N 3.16Å; A35-T37 PolarHBondContact O-N 3.44Å; A35-Y38 WeakPolarHBondContact O-CB 3.33Å; A35-Y38 PolarHBondContact O-N 2.8Å; A35-W39 PolarHBondContact O-N 2.77Å
36	A	30.7	Very low	35.9	Very low	18 Å²	18	79.8 Å²	79.8	15%	0.149	41%	0.411	C	S	.	.	H	α-helix	trans	-58.5	-48.6	177.5	0	0	0	0	0	111.4	K32 N33 Y38 W39 E40	K32-A36 VanDerWaalsContact O-CB 3.23Å; K32-A36 WeakPolarHBondContact O-CB 3.15Å; K32-A36 PolarHBondContact O-N 3.42Å; N33-A36 PolarHBondContact O-N 3.48Å; A36-Y38 VanDerWaalsContact C-N 3.34Å; A36-Y38 PolarHBondContact O-N 3.12Å; A36-W39 PolarHBondContact O-N 2.7Å; A36-E40 VanDerWaalsContact O-CB 3.3Å; A36-E40 WeakPolarHBondContact O-CB 3.37Å; A36-E40 VanDerWaalsContact O-CG 3.25Å; A36-E40 WeakPolarHBondContact O-CG 3.32Å; A36-E40 PolarHBondContact O-N 3.01Å
37	T	31.1	Very low	36.5	Very low	69 Å²	69	73.4 Å²	73.4	42%	0.423	38%	0.378	S	S	.	.	H	α-helix	trans	-64	-36.3	175.9	-53.5	0	0	0	0	112	N33 A35 N41	N33-T37 VanDerWaalsContact O-CB 3.28Å; N33-T37 WeakPolarHBondContact O-CB 3.34Å; N33-T37 PolarHBondContact O-N 2.79Å; N33-T37 PolarHBondContact O-OG1 2.82Å; A35-T37 PolarHBondContact O-N 3.44Å; T37-N41 VanDerWaalsContact CG2-ND2 3.25Å; T37-N41 WeakPolarHBondContact CG2-ND2 3.17Å; T37-N41 VanDerWaalsContact O-CB 3.28Å; T37-N41 WeakPolarHBondContact O-CB 3.4Å; T37-N41 PolarHBondContact O-N 3.46Å; T37-N41 PolarHBondContact O-ND2 3.16Å
38	Y	31.3	Very low	36.8	Very low	112 Å²	112	70.3 Å²	70.3	44%	0.439	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-44.1	173.5	179.6	-93	0	0	0	110.7	I34 A35 A36 N41 A42	I34-Y38 WeakPolarHBondContact O-CA 3.22Å; I34-Y38 WeakPolarHBondContact O-CB 3.32Å; I34-Y38 PolarHBondContact O-N 3.38Å; A35-Y38 WeakPolarHBondContact O-CB 3.33Å; A35-Y38 PolarHBondContact O-N 2.8Å; A36-Y38 VanDerWaalsContact C-N 3.34Å; A36-Y38 PolarHBondContact O-N 3.12Å; Y38-N41 CarbonylContact O-C 3.52Å; Y38-A42 WeakPolarHBondContact O-CA 3.24Å; Y38-A42 WeakPolarHBondContact O-CB 3.11Å; Y38-A42 PolarHBondContact O-N 3.11Å
39	W	36.6	Very low	37.3	Very low	36 Å²	36	66.9 Å²	66.9	14%	0.136	35%	0.347	C	S	.	.	H	α-helix	trans	-72.4	-35.5	177.9	-69.4	112.8	0	0	0	112.7	A35 A36 L47 Y50 I317	A35-W39 PolarHBondContact O-N 2.77Å; A36-W39 PolarHBondContact O-N 2.7Å; W39-L47 HydrophobicContact CD2-CD2 4.44Å; W39-L47 HydrophobicContact CE3-CD2 3.16Å; W39-L47 HydrophobicContact CH2-CD2 4.45Å; W39-L47 HydrophobicContact CZ3-CD2 3.17Å; W39-Y50 AromaticContact CH2-CD1 3.56Å; W39-Y50 HydrophobicContact CH2-CD1 3.56Å; W39-Y50 HydrophobicContact CH2-CD2 4.2Å; W39-Y50 AromaticContact CH2-CE1 3.76Å; W39-Y50 HydrophobicContact CH2-CE1 3.76Å; W39-Y50 HydrophobicContact CH2-CE2 4.37Å; W39-Y50 AromaticContact CH2-CG 3.78Å; W39-Y50 HydrophobicContact CH2-CG 3.78Å; W39-Y50 HydrophobicContact CZ2-CD1 4.36Å; W39-Y50 HydrophobicContact CZ2-CD2 4.47Å; W39-Y50 HydrophobicContact CZ2-CE1 4.21Å; W39-Y50 HydrophobicContact CZ2-CE2 4.31Å; W39-Y50 HydrophobicContact CZ2-CG 4.48Å; W39-Y50 HydrophobicContact CZ3-CD1 4.49Å; W39-I317 HydrophobicContact CH2-CD1 4.36Å; W39-I317 HydrophobicContact CZ2-CG2 4.15Å
40	E	34.5	Very low	38	Very low	111 Å²	111	61.7 Å²	61.7	52%	0.519	32%	0.321	S	S	.	.	H	α-helix	trans	-68.5	-34.6	176	-77.3	175.7	-179.7	0	0	112.3	A36 M402	A36-E40 VanDerWaalsContact O-CB 3.3Å; A36-E40 WeakPolarHBondContact O-CB 3.37Å; A36-E40 VanDerWaalsContact O-CG 3.25Å; A36-E40 WeakPolarHBondContact O-CG 3.32Å; A36-E40 PolarHBondContact O-N 3.01Å; E40-M402 VanDerWaalsContact OE1-CE 3.27Å; E40-M402 WeakPolarHBondContact OE1-CE 3.27Å
41	N	34.3	Very low	38.5	Very low	124 Å²	124	58.6 Å²	58.6	66%	0.663	31%	0.308	S	S	*	.	S	Bend	trans	-104.7	3.5	178.7	-60.8	-53.2	0	0	0	113.5	T37 Y38 S43	T37-N41 VanDerWaalsContact CG2-ND2 3.25Å; T37-N41 WeakPolarHBondContact CG2-ND2 3.17Å; T37-N41 VanDerWaalsContact O-CB 3.28Å; T37-N41 WeakPolarHBondContact O-CB 3.4Å; T37-N41 PolarHBondContact O-N 3.46Å; T37-N41 PolarHBondContact O-ND2 3.16Å; Y38-N41 CarbonylContact O-C 3.52Å; N41-S43 PolarHBondContact O-N 3.42Å; N41-S43 VanDerWaalsContact O-N 3.12Å
42	A	35.1	Very low	39.3	Very low	18 Å²	18	54.2 Å²	54.2	15%	0.149	29%	0.285	C	S	.	.			trans	-64.6	120.4	-178.9	0	0	0	0	0	108	Y38 L47	Y38-A42 WeakPolarHBondContact O-CA 3.24Å; Y38-A42 WeakPolarHBondContact O-CB 3.11Å; Y38-A42 PolarHBondContact O-N 3.11Å; A42-L47 HydrophobicContact CB-CD1 4.38Å; A42-L47 HydrophobicContact CB-CD2 3.64Å; A42-L47 HydrophobicContact CB-CG 3.77Å
43	S	41.8	Very low	40.1	Very low	50 Å²	50	52.6 Å²	52.6	35%	0.35	29%	0.287	S	S	.	.			trans	-56.1	152.1	166.8	75.5	0	0	0	0	109.2	N41 Q45 S46 L47	N41-S43 PolarHBondContact O-N 3.42Å; N41-S43 VanDerWaalsContact O-N 3.12Å; S43-Q45 PolarHBondContact O-N 3.49Å; S43-Q45 VanDerWaalsContact O-N 3.1Å; S43-Q45 PolarHBondContact OG-N 3.43Å; S43-S46 WeakPolarHBondContact O-CB 3.44Å; S43-S46 PolarHBondContact O-N 3.15Å; S43-S46 PolarHBondContact OG-N 3.36Å; S43-S46 VanDerWaalsContact OG-N 3.16Å; S43-S46 PolarHBondContact OG-OG 3.12Å; S43-L47 PolarHBondContact O-N 2.88Å; S43-L47 VanDerWaalsContact O-N 3.16Å
44	L	43.2	Very low	40.7	Very low	38 Å²	38	49.9 Å²	49.9	20%	0.199	27%	0.271	C	S	.	.	H	α-helix	trans	-45.2	-44.2	170.5	171.8	49.8	0	0	0	111.2	S46 L47 L48 K240 C241	L44-S46 PolarHBondContact O-N 3.16Å; L44-L47 PolarHBondContact O-N 3.45Å; L44-L48 HydrophobicContact CD1-CD1 3.9Å; L44-L48 HydrophobicContact CD1-CD2 4.22Å; L44-L48 HydrophobicContact CD1-CG 3.81Å; L44-L48 HydrophobicContact CG-CD1 4.11Å; L44-L48 HydrophobicContact CG-CG 4.42Å; L44-L48 WeakPolarHBondContact O-CG 3.21Å; L44-L48 PolarHBondContact O-N 3.15Å; L44-K240 HydrophobicContact CD2-CB 4.09Å; L44-C241 HydrophobicContact CB-CB 4.15Å; L44-C241 HydrophobicContact CD1-CB 3.68Å; L44-C241 HydrophobicContact CD2-CB 4.42Å; L44-C241 HydrophobicContact CG-CB 4.3Å
45	Q	46.4	Very low	41.5	Very low	74 Å²	74	45.3 Å²	45.3	35%	0.346	25%	0.248	S	C	.	.	H	α-helix	trans	-60.7	-42	179	-168.7	62.8	41.6	0	0	112.7	S43 L47 L48 N49 S99	S43-Q45 PolarHBondContact O-N 3.49Å; S43-Q45 VanDerWaalsContact O-N 3.1Å; S43-Q45 PolarHBondContact OG-N 3.43Å; Q45-L47 VanDerWaalsContact C-N 3.34Å; Q45-L47 PolarHBondContact O-N 3.49Å; Q45-L48 PolarHBondContact O-N 3.32Å; Q45-N49 PolarHBondContact NE2-OD1 3.26Å; Q45-N49 VanDerWaalsContact O-CB 3.27Å; Q45-N49 WeakPolarHBondContact O-CB 3.23Å; Q45-N49 PolarHBondContact O-N 2.93Å; Q45-N49 PolarHBondContact O-ND2 2.85Å; Q45-N49 PolarHBondContact O-OD1 2.83Å; Q45-S99 VanDerWaalsContact NE2-CB 3.29Å
46	S	45.2	Very low	42.3	Very low	15 Å²	15	48.1 Å²	48.1	11%	0.105	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-40.4	176.8	-63.4	0	0	0	0	112.1	S43 L44 Y50	S43-S46 WeakPolarHBondContact O-CB 3.44Å; S43-S46 PolarHBondContact O-N 3.15Å; S43-S46 PolarHBondContact OG-N 3.36Å; S43-S46 VanDerWaalsContact OG-N 3.16Å; S43-S46 PolarHBondContact OG-OG 3.12Å; L44-S46 PolarHBondContact O-N 3.16Å; S46-Y50 WeakPolarHBondContact O-CB 3.35Å; S46-Y50 PolarHBondContact O-N 3.42Å
47	L	43.9	Very low	43.4	Very low	21 Å²	21	54.1 Å²	54.1	11%	0.11	27%	0.271	C	S	.	.	H	α-helix	trans	-66.7	-43.1	177	-61.3	171.6	0	0	0	111.6	W39 A42 S43 L44 Q45 Y50 G51 C241 L245	W39-L47 HydrophobicContact CD2-CD2 4.44Å; W39-L47 HydrophobicContact CE3-CD2 3.16Å; W39-L47 HydrophobicContact CH2-CD2 4.45Å; W39-L47 HydrophobicContact CZ3-CD2 3.17Å; A42-L47 HydrophobicContact CB-CD1 4.38Å; A42-L47 HydrophobicContact CB-CD2 3.64Å; A42-L47 HydrophobicContact CB-CG 3.77Å; S43-L47 PolarHBondContact O-N 2.88Å; S43-L47 VanDerWaalsContact O-N 3.16Å; L44-L47 PolarHBondContact O-N 3.45Å; Q45-L47 VanDerWaalsContact C-N 3.34Å; Q45-L47 PolarHBondContact O-N 3.49Å; L47-Y50 PolarHBondContact O-N 3.13Å; L47-G51 PolarHBondContact O-N 3.29Å; L47-C241 WeakPolarHBondContact CD1-SG 3.43Å; L47-L245 HydrophobicContact CB-CD2 4.39Å; L47-L245 HydrophobicContact CD1-CD1 4.32Å
48	L	45.5	Very low	44.1	Very low	3 Å²	3	55.1 Å²	55.1	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-66.2	-43.1	176.2	-65	-176.6	0	0	0	111.8	L44 Q45 Y50 G51 A52 L96 L248	L44-L48 HydrophobicContact CD1-CD1 3.9Å; L44-L48 HydrophobicContact CD1-CD2 4.22Å; L44-L48 HydrophobicContact CD1-CG 3.81Å; L44-L48 HydrophobicContact CG-CD1 4.11Å; L44-L48 HydrophobicContact CG-CG 4.42Å; L44-L48 WeakPolarHBondContact O-CG 3.21Å; L44-L48 PolarHBondContact O-N 3.15Å; Q45-L48 PolarHBondContact O-N 3.32Å; L48-Y50 VanDerWaalsContact C-N 3.31Å; L48-Y50 PolarHBondContact O-N 2.82Å; L48-G51 PolarHBondContact O-N 2.78Å; L48-A52 VanDerWaalsContact O-CB 3.24Å; L48-A52 WeakPolarHBondContact O-CB 3.43Å; L48-A52 PolarHBondContact O-N 2.98Å; L48-L96 HydrophobicContact CB-CD1 4.47Å; L48-L96 HydrophobicContact CD1-CD1 4.24Å; L48-L96 HydrophobicContact CD2-CD1 3.4Å; L48-L96 HydrophobicContact CG-CD1 4.2Å; L48-L248 HydrophobicContact CD2-CD2 4.35Å
49	N	48	Very low	44.9	Very low	56 Å²	56	52 Å²	52	30%	0.299	26%	0.263	S	S	.	.	H	α-helix	trans	-62.5	-38.2	176.2	-71	-11.5	0	0	0	111.7	Q45 A52 S53	Q45-N49 PolarHBondContact NE2-OD1 3.26Å; Q45-N49 VanDerWaalsContact O-CB 3.27Å; Q45-N49 WeakPolarHBondContact O-CB 3.23Å; Q45-N49 PolarHBondContact O-N 2.93Å; Q45-N49 PolarHBondContact O-ND2 2.85Å; Q45-N49 PolarHBondContact O-OD1 2.83Å; N49-A52 WeakPolarHBondContact O-CB 3.24Å; N49-S53 WeakPolarHBondContact O-CB 3.03Å; N49-S53 PolarHBondContact O-N 3.39Å; N49-S53 PolarHBondContact O-OG 2.94Å
50	Y	48.4	Very low	45.6	Very low	46 Å²	46	51.9 Å²	51.9	18%	0.18	27%	0.272	C	S	.	.	H	α-helix	trans	-66.2	-50.7	173.8	-179.6	-87.8	0	0	0	111.2	W39 S46 L47 L48 A52 S53 E54 I317 S320	W39-Y50 AromaticContact CH2-CD1 3.56Å; W39-Y50 HydrophobicContact CH2-CD1 3.56Å; W39-Y50 HydrophobicContact CH2-CD2 4.2Å; W39-Y50 AromaticContact CH2-CE1 3.76Å; W39-Y50 HydrophobicContact CH2-CE1 3.76Å; W39-Y50 HydrophobicContact CH2-CE2 4.37Å; W39-Y50 AromaticContact CH2-CG 3.78Å; W39-Y50 HydrophobicContact CH2-CG 3.78Å; W39-Y50 HydrophobicContact CZ2-CD1 4.36Å; W39-Y50 HydrophobicContact CZ2-CD2 4.47Å; W39-Y50 HydrophobicContact CZ2-CE1 4.21Å; W39-Y50 HydrophobicContact CZ2-CE2 4.31Å; W39-Y50 HydrophobicContact CZ2-CG 4.48Å; W39-Y50 HydrophobicContact CZ3-CD1 4.49Å; S46-Y50 WeakPolarHBondContact O-CB 3.35Å; S46-Y50 PolarHBondContact O-N 3.42Å; L47-Y50 PolarHBondContact O-N 3.13Å; L48-Y50 VanDerWaalsContact C-N 3.31Å; L48-Y50 PolarHBondContact O-N 2.82Å; Y50-A52 PolarHBondContact O-N 3.28Å; Y50-S53 WeakPolarHBondContact O-CB 3.27Å; Y50-S53 PolarHBondContact O-N 3.34Å; Y50-S53 VanDerWaalsContact O-N 3.08Å; Y50-E54 HydrophobicContact CD1-CG 4.17Å; Y50-E54 HydrophobicContact CE1-CG 3.62Å; Y50-E54 PolarHBondContact O-N 3.08Å; Y50-I317 HydrophobicContact CE1-CG1 4.06Å; Y50-S320 PolarHBondContact OH-OG 3.42Å
51	G	49.2	Very low	46.6	Very low	15 Å²	15	53.2 Å²	53.2	16%	0.155	28%	0.281	C	S	.	.	H	α-helix	trans	-53.4	-45.3	175.9	0	0	0	0	0	111.4	L47 L48 S53 E54 I55	L47-G51 PolarHBondContact O-N 3.29Å; L48-G51 PolarHBondContact O-N 2.78Å; G51-S53 PolarHBondContact O-N 3.2Å; G51-E54 PolarHBondContact O-N 3.36Å; G51-I55 VanDerWaalsContact O-CG1 3.24Å; G51-I55 WeakPolarHBondContact O-CG1 3.49Å; G51-I55 PolarHBondContact O-N 3.01Å
52	A	48.8	Very low	47.4	Very low	4 Å²	4	51.3 Å²	51.3	3%	0.033	27%	0.271	C	S	.	.	H	α-helix	trans	-59.1	-46.2	175.1	0	0	0	0	0	114.2	L48 N49 Y50 E54 I55 R56 T100	L48-A52 VanDerWaalsContact O-CB 3.24Å; L48-A52 WeakPolarHBondContact O-CB 3.43Å; L48-A52 PolarHBondContact O-N 2.98Å; N49-A52 WeakPolarHBondContact O-CB 3.24Å; Y50-A52 PolarHBondContact O-N 3.28Å; A52-E54 VanDerWaalsContact C-N 3.29Å; A52-E54 PolarHBondContact O-N 2.77Å; A52-I55 PolarHBondContact O-N 3.3Å; A52-R56 WeakPolarHBondContact O-CG 3.16Å; A52-R56 PolarHBondContact O-N 3.41Å; A52-T100 VanDerWaalsContact CB-CA 3.47Å; A52-T100 HydrophobicContact CB-CG2 3.78Å
53	S	49.5	Very low	48.2	Very low	72 Å²	72	51.4 Å²	51.4	50%	0.503	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-40.1	177.6	-60.9	0	0	0	0	111	N49 Y50 G51 R56 R57	N49-S53 WeakPolarHBondContact O-CB 3.03Å; N49-S53 PolarHBondContact O-N 3.39Å; N49-S53 PolarHBondContact O-OG 2.94Å; Y50-S53 WeakPolarHBondContact O-CB 3.27Å; Y50-S53 PolarHBondContact O-N 3.34Å; Y50-S53 VanDerWaalsContact O-N 3.08Å; G51-S53 PolarHBondContact O-N 3.2Å; S53-R56 PolarHBondContact O-N 2.91Å; S53-R57 WeakPolarHBondContact O-CB 2.93Å; S53-R57 PolarHBondContact O-N 3.41Å
54	E	48	Very low	48.7	Very low	35 Å²	35	49.5 Å²	49.5	16%	0.164	26%	0.256	C	S	.	.	H	α-helix	trans	-67	-37.6	174.9	-79.8	-60.4	113.3	0	0	112.6	Y50 G51 A52 R57 L58	Y50-E54 HydrophobicContact CD1-CG 4.17Å; Y50-E54 HydrophobicContact CE1-CG 3.62Å; Y50-E54 PolarHBondContact O-N 3.08Å; G51-E54 PolarHBondContact O-N 3.36Å; A52-E54 VanDerWaalsContact C-N 3.29Å; A52-E54 PolarHBondContact O-N 2.77Å; E54-R57 PolarHBondContact O-N 2.97Å; E54-R57 IonicContact OE1-CZ 2.79Å; E54-R57 IonicContact OE1-NE 3.72Å; E54-R57 PolarHBondContact OE1-NE 2.95Å; E54-R57 IonicContact OE1-NH2 3.9Å; E54-R57 IonicContact OE2-CZ 3.66Å; E54-R57 IonicContact OE2-NE 2.8Å; E54-R57 PolarHBondContact OE2-NE 2.96Å; E54-R57 VanDerWaalsContact OE2-NE 3.11Å; E54-R57 IonicContact OE2-NH2 3.7Å; E54-R57 PolarHBondContact OE2-NH2 3.39Å; E54-L58 WeakPolarHBondContact O-CB 3.49Å; E54-L58 VanDerWaalsContact O-CG 3.26Å; E54-L58 WeakPolarHBondContact O-CG 3.42Å; E54-L58 PolarHBondContact O-N 3.48Å
55	I	47.3	Very low	49.1	Very low	4 Å²	4	48.5 Å²	48.5	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-47.4	172.4	-61.9	170.5	0	0	0	110	G51 A52 R57 L58 H59 F64 L74 T100 L248 M252	G51-I55 VanDerWaalsContact O-CG1 3.24Å; G51-I55 WeakPolarHBondContact O-CG1 3.49Å; G51-I55 PolarHBondContact O-N 3.01Å; A52-I55 PolarHBondContact O-N 3.3Å; I55-R57 VanDerWaalsContact C-N 3.3Å; I55-R57 PolarHBondContact O-N 3.11Å; I55-L58 PolarHBondContact O-N 2.76Å; I55-H59 WeakPolarHBondContact O-CB 3.18Å; I55-H59 PolarHBondContact O-CD2 3.05Å; I55-H59 PolarHBondContact O-N 3.46Å; I55-F64 HydrophobicContact CB-CZ 4.32Å; I55-F64 HydrophobicContact CG2-CE1 4.42Å; I55-F64 HydrophobicContact CG2-CE2 4.4Å; I55-F64 HydrophobicContact CG2-CZ 3.62Å; I55-L74 HydrophobicContact CG2-CD1 4.05Å; I55-T100 HydrophobicContact CD1-CG2 3.82Å; I55-L248 HydrophobicContact CD1-CD1 3.79Å; I55-M252 HydrophobicContact CB-CE 4.48Å; I55-M252 HydrophobicContact CB-SD 4.48Å; I55-M252 HydrophobicContact CD1-CE 4.25Å; I55-M252 HydrophobicContact CD1-CG 4.04Å; I55-M252 HydrophobicContact CD1-SD 3.35Å; I55-M252 WeakPolarHBondContact CD1-SD 3.12Å; I55-M252 HydrophobicContact CG1-CE 3.61Å; I55-M252 HydrophobicContact CG1-CG 4.32Å; I55-M252 HydrophobicContact CG1-SD 3.42Å; I55-M252 WeakPolarHBondContact CG1-SD 3.12Å; I55-M252 HydrophobicContact CG2-CE 4.41Å; I55-M252 HydrophobicContact CG2-SD 4.24Å
56	R	50.3	Low	49.3	Very low	89 Å²	89	47.9 Å²	47.9	34%	0.336	25%	0.249	S	C	.	.	H	α-helix	trans	-58.5	-42	176.4	-70.8	-179.7	-169.4	-146.5	2.9	112.2	A52 S53 G60 F64 T100 F102	A52-R56 WeakPolarHBondContact O-CG 3.16Å; A52-R56 PolarHBondContact O-N 3.41Å; S53-R56 PolarHBondContact O-N 2.91Å; R56-G60 CarbonylContact O-C 3.55Å; R56-G60 VanDerWaalsContact O-CA 3.26Å; R56-G60 WeakPolarHBondContact O-CA 3.42Å; R56-G60 PolarHBondContact O-N 3.29Å; R56-F64 HydrophobicContact CB-CE2 4.14Å; R56-F64 HydrophobicContact CB-CZ 4.23Å; R56-F64 HydrophobicContact CG-CD2 4.35Å; R56-F64 HydrophobicContact CG-CE1 4.03Å; R56-F64 HydrophobicContact CG-CE2 3.68Å; R56-F64 HydrophobicContact CG-CZ 3.44Å; R56-F64 VanDerWaalsContact CG-CZ 3.44Å; R56-T100 PolarHBondContact NE-O 3.33Å; R56-T100 PolarHBondContact NH2-O 3.18Å; R56-F102 PolarHBondContact NH2-O 3.48Å
57	R	52.4	Low	49.5	Very low	144 Å²	144	55.2 Å²	55.2	54%	0.543	28%	0.282	S	S	.	.	H	α-helix	trans	-67.7	-45.5	178.6	-167.3	-175.1	69.3	76.8	2.4	112.4	S53 E54 I55	S53-R57 WeakPolarHBondContact O-CB 2.93Å; S53-R57 PolarHBondContact O-N 3.41Å; E54-R57 PolarHBondContact O-N 2.97Å; E54-R57 IonicContact OE1-CZ 2.79Å; E54-R57 IonicContact OE1-NE 3.72Å; E54-R57 PolarHBondContact OE1-NE 2.95Å; E54-R57 IonicContact OE1-NH2 3.9Å; E54-R57 IonicContact OE2-CZ 3.66Å; E54-R57 IonicContact OE2-NE 2.8Å; E54-R57 PolarHBondContact OE2-NE 2.96Å; E54-R57 VanDerWaalsContact OE2-NE 3.11Å; E54-R57 IonicContact OE2-NH2 3.7Å; E54-R57 PolarHBondContact OE2-NH2 3.39Å; I55-R57 VanDerWaalsContact C-N 3.3Å; I55-R57 PolarHBondContact O-N 3.11Å
58	L	47	Very low	49.8	Very low	90 Å²	90	61 Å²	61	47%	0.471	31%	0.307	S	S	.	.	H	α-helix	trans	-70.8	-37.8	-176.9	-73.4	172.7	0	0	0	112.8	E54 I55	E54-L58 WeakPolarHBondContact O-CB 3.49Å; E54-L58 VanDerWaalsContact O-CG 3.26Å; E54-L58 WeakPolarHBondContact O-CG 3.42Å; E54-L58 PolarHBondContact O-N 3.48Å; I55-L58 PolarHBondContact O-N 2.76Å
59	H	48.3	Very low	49.9	Very low	48 Å²	48	64.5 Å²	64.5	22%	0.222	32%	0.32	C	S	.	.	H	α-helix	trans	-94.2	-10	-177.2	-70	-72.2	0	0	0	113.8	I55 S63 F64 L74 F255	I55-H59 WeakPolarHBondContact O-CB 3.18Å; I55-H59 PolarHBondContact O-CD2 3.05Å; I55-H59 PolarHBondContact O-N 3.46Å; H59-S63 WeakPolarHBondContact O-CB 3.13Å; H59-S63 PolarHBondContact O-OG 3.46Å; H59-F64 HydrophobicContact CB-CE2 4.43Å; H59-L74 HydrophobicContact CB-CD1 4.07Å; H59-F255 AromaticContact CE1-CD1 3.41Å; H59-F255 VanDerWaalsContact CE1-CD1 3.41Å; H59-F255 WeakPolarHBondContact CE1-CD1 3.41Å; H59-F255 AromaticContact CE1-CG 3.83Å; H59-F255 WeakPolarHBondContact NE2-CB 3.33Å; H59-F255 AromaticContact NE2-CD1 3.76Å; H59-F255 AromaticContact NE2-CG 3.79Å
60	G	51.3	Low	50.1	Low	32 Å²	32	68.2 Å²	68.2	33%	0.33	35%	0.35	S	S	.	.			trans	70.5	152.9	-168	0	0	0	0	0	111.7	R56 D62 S63	R56-G60 CarbonylContact O-C 3.55Å; R56-G60 VanDerWaalsContact O-CA 3.26Å; R56-G60 WeakPolarHBondContact O-CA 3.42Å; R56-G60 PolarHBondContact O-N 3.29Å; G60-D62 PolarHBondContact O-N 2.68Å; G60-S63 PolarHBondContact O-N 3.3Å
61	I	54.1	Low	50.3	Low	139 Å²	139	67.1 Å²	67.1	71%	0.713	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-58.3	-32.2	179.8	-62.5	168.7	0	0	0	110.8	S63 F64	I61-S63 VanDerWaalsContact C-N 3.32Å; I61-S63 PolarHBondContact O-N 2.8Å; I61-F64 WeakPolarHBondContact O-CB 3.45Å; I61-F64 PolarHBondContact O-N 2.79Å; I61-F64 VanDerWaalsContact O-N 3.16Å
62	D	51.9	Low	50.5	Low	84 Å²	84	70.2 Å²	70.2	45%	0.449	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-66.2	-27.4	-176.7	-62.1	-39.2	0	0	0	114	G60 F64 S65 K68	G60-D62 PolarHBondContact O-N 2.68Å; D62-F64 PolarHBondContact O-N 3.35Å; D62-F64 VanDerWaalsContact O-N 3.11Å; D62-S65 PolarHBondContact O-N 2.73Å; D62-S65 PolarHBondContact O-OG 2.81Å; D62-K68 HydrophobicContact CB-CB 4.31Å; D62-K68 HydrophobicContact CB-CD 4.05Å; D62-K68 WeakPolarHBondContact OD1-CD 3.29Å; D62-K68 IonicContact OD1-NZ 3.85Å; D62-K68 PolarHBondContact OD1-NZ 3.37Å
63	S	52	Low	50.9	Low	21 Å²	21	70.1 Å²	70.1	15%	0.147	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-66.4	-11.3	176.2	-66.6	0	0	0	0	113.7	H59 G60 I61 W69	H59-S63 WeakPolarHBondContact O-CB 3.13Å; H59-S63 PolarHBondContact O-OG 3.46Å; G60-S63 PolarHBondContact O-N 3.3Å; I61-S63 VanDerWaalsContact C-N 3.32Å; I61-S63 PolarHBondContact O-N 2.8Å; S63-W69 VanDerWaalsContact O-CE3 3.3Å
64	F	52.6	Low	51.3	Low	10 Å²	10	66.7 Å²	66.7	4%	0.044	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-97.8	-12.2	175.4	-64.1	-99.8	0	0	0	112.7	I55 R56 H59 I61 D62 L74 F101 C104	I55-F64 HydrophobicContact CB-CZ 4.32Å; I55-F64 HydrophobicContact CG2-CE1 4.42Å; I55-F64 HydrophobicContact CG2-CE2 4.4Å; I55-F64 HydrophobicContact CG2-CZ 3.62Å; R56-F64 HydrophobicContact CB-CE2 4.14Å; R56-F64 HydrophobicContact CB-CZ 4.23Å; R56-F64 HydrophobicContact CG-CD2 4.35Å; R56-F64 HydrophobicContact CG-CE1 4.03Å; R56-F64 HydrophobicContact CG-CE2 3.68Å; R56-F64 HydrophobicContact CG-CZ 3.44Å; R56-F64 VanDerWaalsContact CG-CZ 3.44Å; H59-F64 HydrophobicContact CB-CE2 4.43Å; I61-F64 WeakPolarHBondContact O-CB 3.45Å; I61-F64 PolarHBondContact O-N 2.79Å; I61-F64 VanDerWaalsContact O-N 3.16Å; D62-F64 PolarHBondContact O-N 3.35Å; D62-F64 VanDerWaalsContact O-N 3.11Å; F64-L74 HydrophobicContact CD1-CB 4.44Å; F64-L74 HydrophobicContact CD1-CD1 3.97Å; F64-L74 HydrophobicContact CD2-CD1 3.75Å; F64-L74 HydrophobicContact CE1-CB 4.48Å; F64-L74 HydrophobicContact CE1-CD1 3.68Å; F64-L74 HydrophobicContact CE2-CD1 3.32Å; F64-L74 HydrophobicContact CG-CD1 4.06Å; F64-L74 HydrophobicContact CZ-CD1 3.34Å; F64-F101 AromaticContact CD1-CD1 3.64Å; F64-F101 HydrophobicContact CD1-CD1 3.64Å; F64-F101 AromaticContact CD1-CE1 3.97Å; F64-F101 HydrophobicContact CD1-CE1 3.97Å; F64-F101 AromaticContact CE1-CD1 3.46Å; F64-F101 HydrophobicContact CE1-CD1 3.46Å; F64-F101 VanDerWaalsContact CE1-CD1 3.46Å; F64-F101 AromaticContact CE1-CE1 3.47Å; F64-F101 HydrophobicContact CE1-CE1 3.47Å; F64-F101 VanDerWaalsContact CE1-CE1 3.47Å; F64-F101 HydrophobicContact CZ-CE1 4.46Å; F64-C104 HydrophobicContact CB-CB 4.4Å; F64-C104 WeakPolarHBondContact CD1-SG 3.47Å
65	S	51.7	Low	51.9	Low	17 Å²	17	65 Å²	65	12%	0.119	34%	0.338	C	S	.	.			trans	-89.5	134.4	174	67.8	0	0	0	0	110.2	D62 E67 K68	D62-S65 PolarHBondContact O-N 2.73Å; D62-S65 PolarHBondContact O-OG 2.81Å; S65-E67 VanDerWaalsContact C-N 3.3Å; S65-K68 WeakPolarHBondContact OG-CB 3.35Å
66	H	50	Low	52.6	Low	60 Å²	60	66.5 Å²	66.5	28%	0.278	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-29.3	175.2	-77.4	-83.5	0	0	0	111.7	S73 E105 T107 E110	H66-S73 WeakPolarHBondContact CE1-CB 3.26Å; H66-S73 PolarHBondContact CE1-OG 3.46Å; H66-E105 PolarHBondContact CD2-O 3.09Å; H66-E105 VanDerWaalsContact CD2-O 3.3Å; H66-E105 PolarHBondContact N-OE2 2.73Å; H66-E105 PolarHBondContact NE2-O 2.82Å; H66-T107 HydrophobicContact CB-CG2 4.5Å; H66-T107 VanDerWaalsContact CE1-CG2 3.44Å; H66-T107 WeakPolarHBondContact CE1-CG2 3.24Å; H66-T107 WeakPolarHBondContact NE2-CG2 3.27Å; H66-E110 IonicContact CD2-OE2 2.63Å; H66-E110 IonicContact CE1-OE1 3.43Å; H66-E110 PolarHBondContact CE1-OE1 2.78Å; H66-E110 IonicContact CE1-OE2 2.99Å; H66-E110 PolarHBondContact CE1-OE2 2.77Å; H66-E110 IonicContact NE2-OE1 3.96Å; H66-E110 PolarHBondContact NE2-OE1 3.45Å; H66-E110 VanDerWaalsContact NE2-OE1 3.13Å; H66-E110 IonicContact NE2-OE2 3.13Å; H66-E110 PolarHBondContact NE2-OE2 3.38Å
67	E	50	Low	53.2	Low	169 Å²	169	65.8 Å²	65.8	79%	0.79	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-32.5	-175.3	-65.4	-167	159.2	0	0	113.8	S65	S65-E67 VanDerWaalsContact C-N 3.3Å
68	K	49.9	Very low	53.7	Low	144 Å²	144	59.1 Å²	59.1	63%	0.626	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-13.6	-170	-61.9	175.7	173.2	171.6	0	114.7	D62 S65	D62-K68 HydrophobicContact CB-CB 4.31Å; D62-K68 HydrophobicContact CB-CD 4.05Å; D62-K68 WeakPolarHBondContact OD1-CD 3.29Å; D62-K68 IonicContact OD1-NZ 3.85Å; D62-K68 PolarHBondContact OD1-NZ 3.37Å; S65-K68 WeakPolarHBondContact OG-CB 3.35Å
69	W	46.9	Very low	54.5	Low	76 Å²	76	56 Å²	56	29%	0.288	31%	0.305	S	S	.	.			trans	-110	124.7	-175.8	-170.2	26.6	0	0	0	112.3	S63 G71 P72 L74 K77	S63-W69 VanDerWaalsContact O-CE3 3.3Å; W69-G71 PolarHBondContact O-N 3.31Å; W69-P72 WeakPolarHBondContact CH2-O 3.13Å; W69-P72 WeakPolarHBondContact CZ3-O 3.48Å; W69-L74 HydrophobicContact CZ3-CG 4.22Å; W69-K77 HydrophobicContact CH2-CD 4.49Å
70	S	52.3	Low	55.2	Low	133 Å²	133	57.5 Å²	57.5	93%	0.93	32%	0.321	S	S	*	.	S	Bend	trans	-74.5	-2.7	177.8	63.9	0	0	0	0	114.5
71	G	53.9	Low	55.8	Low	24 Å²	24	57.7 Å²	57.7	25%	0.247	31%	0.313	C	S	.	.	S	Bend	trans	-104.7	170	179.1	0	0	0	0	0	112.3	W69 S73	W69-G71 PolarHBondContact O-N 3.31Å; G71-S73 PolarHBondContact O-N 3.31Å; G71-S73 VanDerWaalsContact O-N 3.14Å
72	P	53.3	Low	56.2	Low	79 Å²	79	51.3 Å²	51.3	51%	0.513	28%	0.28	S	S	.	.			trans	-58.6	121.2	170.2	23	-29.8	0	0	0	109	W69 S76 K77	W69-P72 WeakPolarHBondContact CH2-O 3.13Å; W69-P72 WeakPolarHBondContact CZ3-O 3.48Å; P72-S76 WeakPolarHBondContact CA-OG 3.21Å; P72-S76 WeakPolarHBondContact CB-OG 3.41Å; P72-K77 HydrophobicContact CB-CG 4.3Å; P72-K77 HydrophobicContact CG-CG 4.28Å
73	S	57.5	Low	56.8	Low	3 Å²	3	53.2 Å²	53.2	2%	0.021	28%	0.281	C	S	.	.			trans	-48.1	154.7	177.9	71.9	0	0	0	0	111.9	H66 G71 V75 S76 K77 E110	H66-S73 WeakPolarHBondContact CE1-CB 3.26Å; H66-S73 PolarHBondContact CE1-OG 3.46Å; G71-S73 PolarHBondContact O-N 3.31Å; G71-S73 VanDerWaalsContact O-N 3.14Å; S73-V75 PolarHBondContact O-N 2.9Å; S73-V75 VanDerWaalsContact O-N 3.16Å; S73-S76 PolarHBondContact N-OG 2.63Å; S73-S76 PolarHBondContact O-N 2.99Å; S73-S76 PolarHBondContact O-OG 3.19Å; S73-S76 WeakPolarHBondContact OG-CB 3.01Å; S73-S76 PolarHBondContact OG-N 2.64Å; S73-S76 PolarHBondContact OG-OG 3.35Å; S73-K77 PolarHBondContact O-N 3.38Å; S73-E110 PolarHBondContact OG-OE1 3.3Å
74	L	57.6	Low	57.4	Low	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-57.2	-33.8	175.8	-74.6	169.3	0	0	0	111.2	I55 H59 F64 W69 K77 F78 F101 F255	I55-L74 HydrophobicContact CG2-CD1 4.05Å; H59-L74 HydrophobicContact CB-CD1 4.07Å; F64-L74 HydrophobicContact CD1-CB 4.44Å; F64-L74 HydrophobicContact CD1-CD1 3.97Å; F64-L74 HydrophobicContact CD2-CD1 3.75Å; F64-L74 HydrophobicContact CE1-CB 4.48Å; F64-L74 HydrophobicContact CE1-CD1 3.68Å; F64-L74 HydrophobicContact CE2-CD1 3.32Å; F64-L74 HydrophobicContact CG-CD1 4.06Å; F64-L74 HydrophobicContact CZ-CD1 3.34Å; W69-L74 HydrophobicContact CZ3-CG 4.22Å; L74-K77 PolarHBondContact O-N 3.43Å; L74-F78 VanDerWaalsContact O-CB 3.31Å; L74-F78 WeakPolarHBondContact O-CB 3.43Å; L74-F78 PolarHBondContact O-N 3.4Å; L74-F101 HydrophobicContact CB-CD1 4.49Å; L74-F101 HydrophobicContact CB-CE1 3.67Å; L74-F101 HydrophobicContact CB-CZ 4.39Å; L74-F255 HydrophobicContact CD2-CD1 3.92Å; L74-F255 HydrophobicContact CD2-CE1 3.15Å; L74-F255 HydrophobicContact CD2-CE2 4.17Å; L74-F255 HydrophobicContact CD2-CZ 3.29Å
75	V	60	Low	57.8	Low	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-58.7	-49.3	172.3	174.9	0	0	0	0	111.1	S73 K77 F78 K79 Y97 F101 C104 E110	S73-V75 PolarHBondContact O-N 2.9Å; S73-V75 VanDerWaalsContact O-N 3.16Å; V75-K77 PolarHBondContact O-N 2.73Å; V75-F78 PolarHBondContact O-N 3.25Å; V75-K79 HydrophobicContact CG1-CD 4.01Å; V75-K79 WeakPolarHBondContact O-CB 3.42Å; V75-K79 WeakPolarHBondContact O-CD 3.47Å; V75-K79 WeakPolarHBondContact O-CG 3.49Å; V75-K79 PolarHBondContact O-N 3.36Å; V75-Y97 HydrophobicContact CB-CE2 4.42Å; V75-Y97 HydrophobicContact CG1-CE2 3.84Å; V75-Y97 WeakPolarHBondContact CG1-OH 3.28Å; V75-Y97 HydrophobicContact CG2-CE2 4.24Å; V75-F101 HydrophobicContact CG2-CB 4.34Å; V75-F101 HydrophobicContact CG2-CD1 4.08Å; V75-F101 HydrophobicContact CG2-CG 4.31Å; V75-C104 HydrophobicContact CG2-CB 4.21Å; V75-E110 HydrophobicContact CG1-CG 4.3Å; V75-E110 WeakPolarHBondContact CG1-OE1 3.23Å; V75-E110 VanDerWaalsContact CG1-OE2 3.32Å; V75-E110 WeakPolarHBondContact CG1-OE2 3.25Å
76	S	62.8	Low	58.2	Low	34 Å²	34	64.7 Å²	64.7	24%	0.238	34%	0.336	C	S	.	.	H	α-helix	trans	-66.9	-35.7	178.9	72	0	0	0	0	113.2	P72 S73 K79 S80 E110	P72-S76 WeakPolarHBondContact CA-OG 3.21Å; P72-S76 WeakPolarHBondContact CB-OG 3.41Å; S73-S76 PolarHBondContact N-OG 2.63Å; S73-S76 PolarHBondContact O-N 2.99Å; S73-S76 PolarHBondContact O-OG 3.19Å; S73-S76 WeakPolarHBondContact OG-CB 3.01Å; S73-S76 PolarHBondContact OG-N 2.64Å; S73-S76 PolarHBondContact OG-OG 3.35Å; S76-K79 WeakPolarHBondContact O-CB 2.94Å; S76-K79 PolarHBondContact O-N 3.37Å; S76-S80 PolarHBondContact O-N 2.79Å; S76-E110 PolarHBondContact N-OE1 3.22Å
77	K	62.9	Low	58.5	Low	74 Å²	74	64.1 Å²	64.1	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-67.6	-42.8	173.7	-70.9	-177	177.8	-172.3	0	111.6	W69 P72 S73 L74 V75 K79 S80 F81 F251 F255	W69-K77 HydrophobicContact CH2-CD 4.49Å; P72-K77 HydrophobicContact CB-CG 4.3Å; P72-K77 HydrophobicContact CG-CG 4.28Å; S73-K77 PolarHBondContact O-N 3.38Å; L74-K77 PolarHBondContact O-N 3.43Å; V75-K77 PolarHBondContact O-N 2.73Å; K77-K79 PolarHBondContact O-N 2.63Å; K77-S80 PolarHBondContact O-N 2.71Å; K77-F81 PolarHBondContact O-N 3.19Å; K77-F81 VanDerWaalsContact O-N 3.08Å; K77-F251 HydrophobicContact CB-CE2 4.21Å; K77-F255 HydrophobicContact CB-CZ 4.1Å; K77-F255 HydrophobicContact CD-CE1 3.6Å; K77-F255 HydrophobicContact CD-CE2 4.47Å; K77-F255 HydrophobicContact CD-CZ 3.35Å; K77-F255 HydrophobicContact CG-CZ 4.37Å
78	F	61.5	Low	58.7	Low	4 Å²	4	60 Å²	60	2%	0.018	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-37.2	175.8	-169.7	-90	0	0	0	111.4	L74 V75 F81 S82 A93 L96 Y97 F101 F251	L74-F78 VanDerWaalsContact O-CB 3.31Å; L74-F78 WeakPolarHBondContact O-CB 3.43Å; L74-F78 PolarHBondContact O-N 3.4Å; V75-F78 PolarHBondContact O-N 3.25Å; F78-F81 WeakPolarHBondContact O-CB 3.15Å; F78-F81 PolarHBondContact O-N 3.18Å; F78-S82 PolarHBondContact O-N 3.43Å; F78-A93 HydrophobicContact CE1-CB 3.97Å; F78-A93 WeakPolarHBondContact CE1-O 3.3Å; F78-A93 HydrophobicContact CZ-CB 3.83Å; F78-A93 WeakPolarHBondContact CZ-O 3.28Å; F78-L96 HydrophobicContact CE2-CB 4.32Å; F78-L96 HydrophobicContact CE2-CD2 3.64Å; F78-L96 HydrophobicContact CE2-CG 3.97Å; F78-L96 HydrophobicContact CZ-CB 3.93Å; F78-L96 HydrophobicContact CZ-CD2 3.99Å; F78-L96 HydrophobicContact CZ-CG 4.1Å; F78-Y97 AromaticContact CD1-CD2 3.75Å; F78-Y97 HydrophobicContact CD1-CD2 3.75Å; F78-Y97 HydrophobicContact CD1-CG 4.42Å; F78-Y97 HydrophobicContact CE1-CD2 4.21Å; F78-Y97 HydrophobicContact CE1-CG 4.46Å; F78-Y97 HydrophobicContact CG-CD2 4.44Å; F78-F101 HydrophobicContact CB-CE2 3.83Å; F78-F101 HydrophobicContact CB-CZ 4.07Å; F78-F101 HydrophobicContact CD1-CE2 4.2Å; F78-F101 AromaticContact CD2-CE2 3.5Å; F78-F101 HydrophobicContact CD2-CE2 3.5Å; F78-F101 HydrophobicContact CD2-CZ 4.07Å; F78-F101 HydrophobicContact CE2-CE2 4.14Å; F78-F101 HydrophobicContact CG-CD2 4.32Å; F78-F101 AromaticContact CG-CE2 3.54Å; F78-F101 HydrophobicContact CG-CE2 3.54Å; F78-F101 HydrophobicContact CG-CZ 4.2Å; F78-F251 HydrophobicContact CB-CD2 4.32Å; F78-F251 HydrophobicContact CB-CE2 3.64Å; F78-F251 HydrophobicContact CB-CZ 3.75Å; F78-F251 AromaticContact CD2-CD1 3.77Å; F78-F251 HydrophobicContact CD2-CD1 3.77Å; F78-F251 AromaticContact CD2-CD2 3.68Å; F78-F251 HydrophobicContact CD2-CD2 3.68Å; F78-F251 AromaticContact CD2-CE1 3.79Å; F78-F251 HydrophobicContact CD2-CE1 3.79Å; F78-F251 AromaticContact CD2-CE2 3.72Å; F78-F251 HydrophobicContact CD2-CE2 3.72Å; F78-F251 AromaticContact CD2-CG 3.71Å; F78-F251 HydrophobicContact CD2-CG 3.71Å; F78-F251 AromaticContact CD2-CZ 3.75Å; F78-F251 HydrophobicContact CD2-CZ 3.75Å; F78-F251 HydrophobicContact CE2-CD1 4.24Å; F78-F251 HydrophobicContact CE2-CD2 4.43Å; F78-F251 HydrophobicContact CE2-CG 4.14Å; F78-F251 HydrophobicContact CG-CD2 4.42Å; F78-F251 HydrophobicContact CG-CE2 4.17Å; F78-F251 HydrophobicContact CG-CZ 4.27Å; F78-F251 VanDerWaalsContact N-CE2 3.32Å
79	K	63.7	Low	58.9	Low	25 Å²	25	55.8 Å²	55.8	11%	0.109	31%	0.305	C	S	.	.	H	α-helix	trans	-66.1	-44.6	175.5	-73.3	167.6	-174.6	-176.8	0	112.9	V75 S76 K77 F81 S82 R83 E110	V75-K79 HydrophobicContact CG1-CD 4.01Å; V75-K79 WeakPolarHBondContact O-CB 3.42Å; V75-K79 WeakPolarHBondContact O-CD 3.47Å; V75-K79 WeakPolarHBondContact O-CG 3.49Å; V75-K79 PolarHBondContact O-N 3.36Å; S76-K79 WeakPolarHBondContact O-CB 2.94Å; S76-K79 PolarHBondContact O-N 3.37Å; K77-K79 PolarHBondContact O-N 2.63Å; K79-F81 PolarHBondContact O-N 3.45Å; K79-S82 PolarHBondContact O-N 2.59Å; K79-R83 PolarHBondContact O-N 2.73Å; K79-E110 HydrophobicContact CD-CG 4.04Å; K79-E110 PolarHBondContact NZ-O 2.74Å; K79-E110 IonicContact NZ-OE1 3.71Å; K79-E110 IonicContact NZ-OE2 2.79Å
80	S	64.6	Low	59.5	Low	80 Å²	80	54 Å²	54	56%	0.559	30%	0.298	S	S	*	.	H	α-helix	trans	-59.8	-32.4	173.2	-173.7	0	0	0	0	112.1	S76 K77	S76-S80 PolarHBondContact O-N 2.79Å; K77-S80 PolarHBondContact O-N 2.71Å
81	F	62.7	Low	59.7	Low	36 Å²	36	49.6 Å²	49.6	16%	0.158	26%	0.264	C	S	.	.	H	α-helix	trans	-70.6	-38.5	177.1	175.2	-94.7	0	0	0	112.7	K77 F78 K79 L247 E250 F251	K77-F81 PolarHBondContact O-N 3.19Å; K77-F81 VanDerWaalsContact O-N 3.08Å; F78-F81 WeakPolarHBondContact O-CB 3.15Å; F78-F81 PolarHBondContact O-N 3.18Å; K79-F81 PolarHBondContact O-N 3.45Å; F81-L247 HydrophobicContact CE1-CB 4.38Å; F81-L247 HydrophobicContact CE1-CD2 4.05Å; F81-L247 HydrophobicContact CZ-CB 4.44Å; F81-L247 HydrophobicContact CZ-CD2 3.96Å; F81-L247 VanDerWaalsContact CZ-O 3.27Å; F81-L247 WeakPolarHBondContact CZ-O 3.32Å; F81-E250 HydrophobicContact CE2-CB 3.77Å; F81-E250 HydrophobicContact CZ-CB 3.95Å; F81-F251 HydrophobicContact CB-CD2 4.03Å; F81-F251 HydrophobicContact CD1-CB 4.21Å; F81-F251 HydrophobicContact CD1-CD2 4.42Å; F81-F251 HydrophobicContact CD2-CB 4.31Å; F81-F251 HydrophobicContact CE1-CB 4.11Å; F81-F251 HydrophobicContact CE2-CB 4.21Å; F81-F251 HydrophobicContact CG-CB 4.29Å; F81-F251 HydrophobicContact CG-CD2 4.1Å; F81-F251 HydrophobicContact CZ-CB 4.1Å
82	S	63.6	Low	59.8	Low	4 Å²	4	50 Å²	50	3%	0.028	26%	0.259	C	S	.	.	H	α-helix	trans	-70.2	-40	-180	-175.4	0	0	0	0	113.7	F78 K79 N84 R85 R90	F78-S82 PolarHBondContact O-N 3.43Å; K79-S82 PolarHBondContact O-N 2.59Å; S82-N84 VanDerWaalsContact C-N 3.34Å; S82-N84 PolarHBondContact O-N 2.76Å; S82-R85 WeakPolarHBondContact O-CB 3.49Å; S82-R85 PolarHBondContact O-N 3.49Å; S82-R90 WeakPolarHBondContact O-CG 3.04Å
83	R	63	Low	60.1	Low	125 Å²	125	46.2 Å²	46.2	47%	0.472	24%	0.235	S	C	.	.	H	α-helix	trans	-59.6	-33.2	-169.7	-79.1	-168.2	-175.7	161.3	11.8	116.5	K79 R85 Y113	K79-R83 PolarHBondContact O-N 2.73Å; R83-R85 PolarHBondContact O-N 2.71Å; R83-Y113 PolarHBondContact NH2-OH 2.98Å
84	N	64	Low	60.2	Low	149 Å²	149	46.3 Å²	46.3	80%	0.797	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.9	6.1	-174.4	-65.9	-31.7	0	0	0	112.9	S82	S82-N84 VanDerWaalsContact C-N 3.34Å; S82-N84 PolarHBondContact O-N 2.76Å
85	R	61.1	Low	60.1	Low	56 Å²	56	47.6 Å²	47.6	21%	0.211	24%	0.244	C	C	.	.	S	Bend	trans	-105.8	161.1	-172.4	-64.6	-174.2	173.4	-90.5	1.7	112.5	S82 R83 E89 R90 L247 E250	S82-R85 WeakPolarHBondContact O-CB 3.49Å; S82-R85 PolarHBondContact O-N 3.49Å; R83-R85 PolarHBondContact O-N 2.71Å; R85-E89 HydrophobicContact CB-CB 3.77Å; R85-E89 WeakPolarHBondContact CB-OE2 3.4Å; R85-E89 VanDerWaalsContact CD-OE2 3.27Å; R85-E89 WeakPolarHBondContact CD-OE2 3.41Å; R85-E89 HydrophobicContact CG-CB 4.4Å; R85-E89 VanDerWaalsContact CG-OE2 3.31Å; R85-E89 WeakPolarHBondContact CG-OE2 3.45Å; R85-E89 IonicContact CZ-OE2 3.51Å; R85-E89 IonicContact NE-OE2 3.64Å; R85-E89 IonicContact NH1-OE2 2.64Å; R85-E89 PolarHBondContact NH1-OE2 3.22Å; R85-R90 HydrophobicContact CB-CG 4.41Å; R85-R90 WeakPolarHBondContact O-CD 3.14Å; R85-L247 VanDerWaalsContact NH1-CD2 3.3Å; R85-E250 IonicContact CZ-OE2 3.69Å; R85-E250 IonicContact NH1-OE2 4Å; R85-E250 IonicContact NH2-OE2 2.76Å; R85-E250 PolarHBondContact NH2-OE2 2.85Å
86	N	60.4	Low	59.9	Low	83 Å²	83	47.6 Å²	47.6	44%	0.444	24%	0.244	S	C	.	.			trans	-67.5	166.4	173.4	62.4	41.5	0	0	0	111.1	P88 E89 R90	N86-P88 WeakPolarHBondContact OD1-CD 3.44Å; N86-E89 PolarHBondContact ND2-OE1 2.71Å; N86-E89 PolarHBondContact O-N 3.24Å; N86-E89 VanDerWaalsContact OD1-CB 3.27Å; N86-E89 WeakPolarHBondContact OD1-CB 3.16Å; N86-E89 WeakPolarHBondContact OD1-CG 3.27Å; N86-E89 PolarHBondContact OD1-N 2.85Å; N86-R90 WeakPolarHBondContact O-CG 3.33Å; N86-R90 PolarHBondContact O-N 3.4Å
87	L	56.4	Low	59.7	Low	49 Å²	49	46 Å²	46	26%	0.257	23%	0.233	S	C	.	.	H	α-helix	trans	-59.3	-43.9	-174.8	-174	84.3	0	0	0	114.2	E89 R90 L91 D120 L121 T124	L87-E89 PolarHBondContact O-N 3.3Å; L87-R90 PolarHBondContact O-N 2.75Å; L87-L91 PolarHBondContact O-N 2.85Å; L87-D120 HydrophobicContact CD1-CB 4.48Å; L87-L121 HydrophobicContact CD1-CD2 3.6Å; L87-L121 HydrophobicContact CD1-CG 4.12Å; L87-L121 HydrophobicContact CD2-CD2 4.26Å; L87-L121 HydrophobicContact CG-CD2 3.72Å; L87-T124 HydrophobicContact CD1-CG2 4.08Å; L87-T124 HydrophobicContact CD2-CG2 3.26Å; L87-T124 HydrophobicContact CG-CG2 4.29Å
88	P	54.2	Low	59.3	Low	82 Å²	82	43 Å²	43	53%	0.532	22%	0.22	S	C	.	.	H	α-helix	trans	-58.2	-44.8	174.6	-26.3	35	0	0	0	113.5	N86 L91 E92	N86-P88 WeakPolarHBondContact OD1-CD 3.44Å; P88-L91 WeakPolarHBondContact O-CB 3.49Å; P88-L91 PolarHBondContact O-N 2.83Å; P88-E92 PolarHBondContact O-N 3.5Å
89	E	55.5	Low	58.8	Low	55 Å²	55	43.4 Å²	43.4	26%	0.257	22%	0.224	S	C	.	.	H	α-helix	trans	-68.7	-34	178.4	-73.6	170.1	-145.4	0	0	112.4	R85 N86 L87 L91 E92 A93	R85-E89 HydrophobicContact CB-CB 3.77Å; R85-E89 WeakPolarHBondContact CB-OE2 3.4Å; R85-E89 VanDerWaalsContact CD-OE2 3.27Å; R85-E89 WeakPolarHBondContact CD-OE2 3.41Å; R85-E89 HydrophobicContact CG-CB 4.4Å; R85-E89 VanDerWaalsContact CG-OE2 3.31Å; R85-E89 WeakPolarHBondContact CG-OE2 3.45Å; R85-E89 IonicContact CZ-OE2 3.51Å; R85-E89 IonicContact NE-OE2 3.64Å; R85-E89 IonicContact NH1-OE2 2.64Å; R85-E89 PolarHBondContact NH1-OE2 3.22Å; N86-E89 PolarHBondContact ND2-OE1 2.71Å; N86-E89 PolarHBondContact O-N 3.24Å; N86-E89 VanDerWaalsContact OD1-CB 3.27Å; N86-E89 WeakPolarHBondContact OD1-CB 3.16Å; N86-E89 WeakPolarHBondContact OD1-CG 3.27Å; N86-E89 PolarHBondContact OD1-N 2.85Å; L87-E89 PolarHBondContact O-N 3.3Å; E89-L91 VanDerWaalsContact C-N 3.33Å; E89-E92 PolarHBondContact O-N 2.72Å; E89-A93 VanDerWaalsContact O-CB 3.31Å; E89-A93 WeakPolarHBondContact O-CB 3.47Å; E89-A93 PolarHBondContact O-N 2.7Å
90	R	58.5	Low	58.1	Low	38 Å²	38	42.2 Å²	42.2	14%	0.143	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-41.9	171.2	-75.9	173.4	70.5	-163.3	5.2	111	S82 R85 N86 L87 A93 L94 D117 D120	S82-R90 WeakPolarHBondContact O-CG 3.04Å; R85-R90 HydrophobicContact CB-CG 4.41Å; R85-R90 WeakPolarHBondContact O-CD 3.14Å; N86-R90 WeakPolarHBondContact O-CG 3.33Å; N86-R90 PolarHBondContact O-N 3.4Å; L87-R90 PolarHBondContact O-N 2.75Å; R90-A93 PolarHBondContact O-N 3Å; R90-L94 WeakPolarHBondContact O-CG 3.48Å; R90-L94 PolarHBondContact O-N 3.1Å; R90-D117 IonicContact CZ-OD1 3.32Å; R90-D117 IonicContact NE-OD1 2.88Å; R90-D117 IonicContact NH2-OD1 2.77Å; R90-D117 PolarHBondContact NH2-OD1 3Å; R90-D120 IonicContact CZ-OD2 3.9Å; R90-D120 IonicContact NH1-OD2 3.46Å; R90-D120 PolarHBondContact NH1-OD2 3.29Å; R90-D120 IonicContact NH2-OD2 2.8Å; R90-D120 PolarHBondContact NH2-OD2 2.96Å
91	L	55.7	Low	57.6	Low	41 Å²	41	38.5 Å²	38.5	22%	0.215	19%	0.193	C	C	.	.	H	α-helix	trans	-63.6	-46.1	175.8	-179.9	67.3	0	0	0	111.6	L87 P88 E89 A93 L94 C95 L121 I126 L131 L135	L87-L91 PolarHBondContact O-N 2.85Å; P88-L91 WeakPolarHBondContact O-CB 3.49Å; P88-L91 PolarHBondContact O-N 2.83Å; E89-L91 VanDerWaalsContact C-N 3.33Å; L91-A93 VanDerWaalsContact C-N 3.32Å; L91-A93 PolarHBondContact O-N 2.89Å; L91-L94 WeakPolarHBondContact O-CB 3.25Å; L91-L94 PolarHBondContact O-N 2.73Å; L91-L94 VanDerWaalsContact O-N 3.12Å; L91-C95 PolarHBondContact O-N 3.39Å; L91-C95 PolarHBondContact O-SG 2.97Å; L91-C95 VanDerWaalsContact O-SG 3.37Å; L91-L121 HydrophobicContact CB-CD1 4.41Å; L91-L121 HydrophobicContact CB-CD2 4Å; L91-L121 HydrophobicContact CD1-CD1 3.69Å; L91-L121 HydrophobicContact CD1-CD2 4.19Å; L91-I126 HydrophobicContact CD2-CD1 4.44Å; L91-L131 HydrophobicContact CD1-CD2 3.5Å; L91-L131 VanDerWaalsContact CD1-CD2 3.5Å; L91-L135 HydrophobicContact CD1-CD1 3.84Å
92	E	57.8	Low	57.1	Low	33 Å²	33	41.8 Å²	41.8	15%	0.154	21%	0.207	C	C	.	.	H	α-helix	trans	-62.4	-39.9	176.1	-72.7	179.7	-179.9	0	0	111.9	P88 E89 L94 C95 L96 Q243 L247	P88-E92 PolarHBondContact O-N 3.5Å; E89-E92 PolarHBondContact O-N 2.72Å; E92-L94 VanDerWaalsContact C-N 3.33Å; E92-L94 PolarHBondContact O-N 3.48Å; E92-C95 WeakPolarHBondContact O-CB 2.92Å; E92-C95 PolarHBondContact O-N 3.38Å; E92-L96 WeakPolarHBondContact O-CB 3.41Å; E92-L96 PolarHBondContact O-N 2.82Å; E92-Q243 PolarHBondContact OE1-OE1 2.9Å; E92-Q243 VanDerWaalsContact OE2-CB 3.29Å; E92-Q243 WeakPolarHBondContact OE2-CB 3.22Å; E92-L247 HydrophobicContact CB-CD1 3.62Å; E92-L247 VanDerWaalsContact OE2-CD1 3.23Å; E92-L247 WeakPolarHBondContact OE2-CD1 3.09Å
93	A	59.5	Low	56.7	Low	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.6	-40.1	172.4	0	0	0	0	0	111.3	F78 E89 R90 L91 C95 L96 Y97	F78-A93 HydrophobicContact CE1-CB 3.97Å; F78-A93 WeakPolarHBondContact CE1-O 3.3Å; F78-A93 HydrophobicContact CZ-CB 3.83Å; F78-A93 WeakPolarHBondContact CZ-O 3.28Å; E89-A93 VanDerWaalsContact O-CB 3.31Å; E89-A93 WeakPolarHBondContact O-CB 3.47Å; E89-A93 PolarHBondContact O-N 2.7Å; R90-A93 PolarHBondContact O-N 3Å; L91-A93 VanDerWaalsContact C-N 3.32Å; L91-A93 PolarHBondContact O-N 2.89Å; A93-C95 VanDerWaalsContact C-N 3.32Å; A93-C95 PolarHBondContact O-N 3.32Å; A93-L96 CarbonylContact O-C 3.59Å; A93-L96 WeakPolarHBondContact O-CB 3.5Å; A93-L96 PolarHBondContact O-N 2.84Å; A93-Y97 WeakPolarHBondContact O-CB 3.09Å; A93-Y97 PolarHBondContact O-N 3.21Å
94	L	59.3	Low	56.4	Low	4 Å²	4	39.9 Å²	39.9	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-65.3	-33.5	174.1	-71.9	170.2	0	0	0	113.2	R90 L91 E92 Y97 S98 L114 D117 L118 L121 L135 T138	R90-L94 WeakPolarHBondContact O-CG 3.48Å; R90-L94 PolarHBondContact O-N 3.1Å; L91-L94 WeakPolarHBondContact O-CB 3.25Å; L91-L94 PolarHBondContact O-N 2.73Å; L91-L94 VanDerWaalsContact O-N 3.12Å; E92-L94 VanDerWaalsContact C-N 3.33Å; E92-L94 PolarHBondContact O-N 3.48Å; L94-Y97 WeakPolarHBondContact O-CB 3.14Å; L94-Y97 PolarHBondContact O-N 3.48Å; L94-S98 PolarHBondContact O-N 2.78Å; L94-S98 PolarHBondContact O-OG 3.01Å; L94-L114 HydrophobicContact CD2-CD2 3.37Å; L94-D117 HydrophobicContact CD1-CB 3.98Å; L94-L118 HydrophobicContact CD1-CD2 4.31Å; L94-L121 HydrophobicContact CD1-CD1 3.52Å; L94-L135 VanDerWaalsContact C-CD2 3.43Å; L94-L135 HydrophobicContact CB-CD1 4.22Å; L94-L135 HydrophobicContact CB-CD2 4.11Å; L94-L135 WeakPolarHBondContact O-CD2 3.42Å; L94-T138 PolarHBondContact O-OG1 3.34Å
95	C	55.5	Low	56	Low	27 Å²	27	37.2 Å²	37.2	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-66.7	-42.1	172.4	-65.9	0	0	0	0	110.9	L91 E92 A93 Y97 S98 S99 L135	L91-C95 PolarHBondContact O-N 3.39Å; L91-C95 PolarHBondContact O-SG 2.97Å; L91-C95 VanDerWaalsContact O-SG 3.37Å; E92-C95 WeakPolarHBondContact O-CB 2.92Å; E92-C95 PolarHBondContact O-N 3.38Å; A93-C95 VanDerWaalsContact C-N 3.32Å; A93-C95 PolarHBondContact O-N 3.32Å; C95-Y97 PolarHBondContact O-N 2.75Å; C95-S98 WeakPolarHBondContact CA-OG 3.42Å; C95-S98 PolarHBondContact O-N 3.22Å; C95-S98 PolarHBondContact O-OG 2.95Å; C95-S99 PolarHBondContact O-N 3.46Å; C95-S99 PolarHBondContact O-OG 2.74Å; C95-L135 HydrophobicContact CB-CD2 4Å; C95-L135 WeakPolarHBondContact SG-CD2 3.35Å
96	L	55	Low	55.8	Low	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-35.3	172.7	-171.7	63	0	0	0	111.1	L48 F78 E92 A93 S99 T100 L248	L48-L96 HydrophobicContact CB-CD1 4.47Å; L48-L96 HydrophobicContact CD1-CD1 4.24Å; L48-L96 HydrophobicContact CD2-CD1 3.4Å; L48-L96 HydrophobicContact CG-CD1 4.2Å; F78-L96 HydrophobicContact CE2-CB 4.32Å; F78-L96 HydrophobicContact CE2-CD2 3.64Å; F78-L96 HydrophobicContact CE2-CG 3.97Å; F78-L96 HydrophobicContact CZ-CB 3.93Å; F78-L96 HydrophobicContact CZ-CD2 3.99Å; F78-L96 HydrophobicContact CZ-CG 4.1Å; E92-L96 WeakPolarHBondContact O-CB 3.41Å; E92-L96 PolarHBondContact O-N 2.82Å; A93-L96 CarbonylContact O-C 3.59Å; A93-L96 WeakPolarHBondContact O-CB 3.5Å; A93-L96 PolarHBondContact O-N 2.84Å; L96-S99 VanDerWaalsContact CA-OG 3.31Å; L96-S99 WeakPolarHBondContact CA-OG 3.46Å; L96-S99 PolarHBondContact O-N 3.49Å; L96-S99 PolarHBondContact O-OG 3.48Å; L96-T100 WeakPolarHBondContact O-CB 3.48Å; L96-T100 PolarHBondContact O-N 2.73Å; L96-T100 PolarHBondContact O-OG1 2.84Å; L96-L248 HydrophobicContact CD1-CB 4.13Å; L96-L248 HydrophobicContact CD1-CD1 4.05Å; L96-L248 HydrophobicContact CD1-CD2 4.32Å; L96-L248 HydrophobicContact CD1-CG 4.39Å; L96-L248 HydrophobicContact CD2-CB 3.8Å; L96-L248 HydrophobicContact CD2-CD1 4Å; L96-L248 HydrophobicContact CD2-CG 4.48Å; L96-L248 HydrophobicContact CG-CD1 4.4Å
97	Y	59.6	Low	55.8	Low	2 Å²	2	34.2 Å²	34.2	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-65.3	-48.5	177.2	-177.1	-92.1	0	0	0	112.2	V75 F78 A93 L94 C95 S99 T100 F101 V106 L114 I141	V75-Y97 HydrophobicContact CB-CE2 4.42Å; V75-Y97 HydrophobicContact CG1-CE2 3.84Å; V75-Y97 WeakPolarHBondContact CG1-OH 3.28Å; V75-Y97 HydrophobicContact CG2-CE2 4.24Å; F78-Y97 AromaticContact CD1-CD2 3.75Å; F78-Y97 HydrophobicContact CD1-CD2 3.75Å; F78-Y97 HydrophobicContact CD1-CG 4.42Å; F78-Y97 HydrophobicContact CE1-CD2 4.21Å; F78-Y97 HydrophobicContact CE1-CG 4.46Å; F78-Y97 HydrophobicContact CG-CD2 4.44Å; A93-Y97 WeakPolarHBondContact O-CB 3.09Å; A93-Y97 PolarHBondContact O-N 3.21Å; L94-Y97 WeakPolarHBondContact O-CB 3.14Å; L94-Y97 PolarHBondContact O-N 3.48Å; C95-Y97 PolarHBondContact O-N 2.75Å; Y97-S99 VanDerWaalsContact C-N 3.33Å; Y97-S99 PolarHBondContact O-N 3.24Å; Y97-T100 PolarHBondContact O-N 3.04Å; Y97-F101 HydrophobicContact CD2-CB 3.91Å; Y97-F101 AromaticContact CD2-CD2 3.32Å; Y97-F101 HydrophobicContact CD2-CD2 3.32Å; Y97-F101 HydrophobicContact CD2-CE2 4.16Å; Y97-F101 AromaticContact CD2-CG 3.91Å; Y97-F101 HydrophobicContact CD2-CG 3.91Å; Y97-F101 HydrophobicContact CE1-CB 4.4Å; Y97-F101 HydrophobicContact CE2-CB 3.59Å; Y97-F101 AromaticContact CE2-CD2 3.72Å; Y97-F101 HydrophobicContact CE2-CD2 3.72Å; Y97-F101 AromaticContact CE2-CG 3.83Å; Y97-F101 HydrophobicContact CE2-CG 3.83Å; Y97-F101 HydrophobicContact CG-CB 4.42Å; Y97-F101 HydrophobicContact CG-CD2 4.05Å; Y97-F101 WeakPolarHBondContact O-CA 3.43Å; Y97-F101 PolarHBondContact O-N 2.87Å; Y97-V106 WeakPolarHBondContact OH-CG2 3.17Å; Y97-L114 HydrophobicContact CD1-CD2 4.36Å; Y97-L114 HydrophobicContact CE1-CD1 3.79Å; Y97-L114 HydrophobicContact CE1-CD2 4.42Å; Y97-I141 HydrophobicContact CE1-CD1 4.06Å
98	S	53.8	Low	56.1	Low	9 Å²	9	36.8 Å²	36.8	6%	0.063	22%	0.217	C	C	.	.	H	α-helix	trans	-59.7	-43.6	176	21.5	0	0	0	0	111.8	L94 C95 T100 F102 L135 T138	L94-S98 PolarHBondContact O-N 2.78Å; L94-S98 PolarHBondContact O-OG 3.01Å; C95-S98 WeakPolarHBondContact CA-OG 3.42Å; C95-S98 PolarHBondContact O-N 3.22Å; C95-S98 PolarHBondContact O-OG 2.95Å; S98-T100 VanDerWaalsContact C-N 3.33Å; S98-F102 WeakPolarHBondContact O-CB 3.36Å; S98-L135 WeakPolarHBondContact OG-CD2 3.23Å; S98-T138 WeakPolarHBondContact CA-OG1 3.13Å; S98-T138 WeakPolarHBondContact CB-OG1 3.5Å; S98-T138 PolarHBondContact N-OG1 3.45Å; S98-T138 PolarHBondContact OG-OG1 2.74Å
99	S	49.9	Very low	56.4	Low	13 Å²	13	38.6 Å²	38.6	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-70.1	-33.2	179.3	50.7	0	0	0	0	112.4	Q45 C95 L96 Y97	Q45-S99 VanDerWaalsContact NE2-CB 3.29Å; C95-S99 PolarHBondContact O-N 3.46Å; C95-S99 PolarHBondContact O-OG 2.74Å; L96-S99 VanDerWaalsContact CA-OG 3.31Å; L96-S99 WeakPolarHBondContact CA-OG 3.46Å; L96-S99 PolarHBondContact O-N 3.49Å; L96-S99 PolarHBondContact O-OG 3.48Å; Y97-S99 VanDerWaalsContact C-N 3.33Å; Y97-S99 PolarHBondContact O-N 3.24Å
100	T	50.1	Low	56.5	Low	1 Å²	1	36.6 Å²	36.6	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-95.5	-46.2	-169.9	-54.5	0	0	0	0	114.8	A52 I55 R56 L96 Y97 S98	A52-T100 VanDerWaalsContact CB-CA 3.47Å; A52-T100 HydrophobicContact CB-CG2 3.78Å; I55-T100 HydrophobicContact CD1-CG2 3.82Å; R56-T100 PolarHBondContact NE-O 3.33Å; R56-T100 PolarHBondContact NH2-O 3.18Å; L96-T100 WeakPolarHBondContact O-CB 3.48Å; L96-T100 PolarHBondContact O-N 2.73Å; L96-T100 PolarHBondContact O-OG1 2.84Å; Y97-T100 PolarHBondContact O-N 3.04Å; S98-T100 VanDerWaalsContact C-N 3.33Å
101	F	53.7	Low	56.6	Low	1 Å²	1	37 Å²	37	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-108	10.9	-170.8	-55.2	-75.6	0	0	0	113.1	F64 L74 V75 F78 Y97 G103 C104 F251	F64-F101 AromaticContact CD1-CD1 3.64Å; F64-F101 HydrophobicContact CD1-CD1 3.64Å; F64-F101 AromaticContact CD1-CE1 3.97Å; F64-F101 HydrophobicContact CD1-CE1 3.97Å; F64-F101 AromaticContact CE1-CD1 3.46Å; F64-F101 HydrophobicContact CE1-CD1 3.46Å; F64-F101 VanDerWaalsContact CE1-CD1 3.46Å; F64-F101 AromaticContact CE1-CE1 3.47Å; F64-F101 HydrophobicContact CE1-CE1 3.47Å; F64-F101 VanDerWaalsContact CE1-CE1 3.47Å; F64-F101 HydrophobicContact CZ-CE1 4.46Å; L74-F101 HydrophobicContact CB-CD1 4.49Å; L74-F101 HydrophobicContact CB-CE1 3.67Å; L74-F101 HydrophobicContact CB-CZ 4.39Å; V75-F101 HydrophobicContact CG2-CB 4.34Å; V75-F101 HydrophobicContact CG2-CD1 4.08Å; V75-F101 HydrophobicContact CG2-CG 4.31Å; F78-F101 HydrophobicContact CB-CE2 3.83Å; F78-F101 HydrophobicContact CB-CZ 4.07Å; F78-F101 HydrophobicContact CD1-CE2 4.2Å; F78-F101 AromaticContact CD2-CE2 3.5Å; F78-F101 HydrophobicContact CD2-CE2 3.5Å; F78-F101 HydrophobicContact CD2-CZ 4.07Å; F78-F101 HydrophobicContact CE2-CE2 4.14Å; F78-F101 HydrophobicContact CG-CD2 4.32Å; F78-F101 AromaticContact CG-CE2 3.54Å; F78-F101 HydrophobicContact CG-CE2 3.54Å; F78-F101 HydrophobicContact CG-CZ 4.2Å; Y97-F101 HydrophobicContact CD2-CB 3.91Å; Y97-F101 AromaticContact CD2-CD2 3.32Å; Y97-F101 HydrophobicContact CD2-CD2 3.32Å; Y97-F101 HydrophobicContact CD2-CE2 4.16Å; Y97-F101 AromaticContact CD2-CG 3.91Å; Y97-F101 HydrophobicContact CD2-CG 3.91Å; Y97-F101 HydrophobicContact CE1-CB 4.4Å; Y97-F101 HydrophobicContact CE2-CB 3.59Å; Y97-F101 AromaticContact CE2-CD2 3.72Å; Y97-F101 HydrophobicContact CE2-CD2 3.72Å; Y97-F101 AromaticContact CE2-CG 3.83Å; Y97-F101 HydrophobicContact CE2-CG 3.83Å; Y97-F101 HydrophobicContact CG-CB 4.42Å; Y97-F101 HydrophobicContact CG-CD2 4.05Å; Y97-F101 WeakPolarHBondContact O-CA 3.43Å; Y97-F101 PolarHBondContact O-N 2.87Å; F101-G103 PolarHBondContact O-N 3.48Å; F101-C104 HydrophobicContact CB-CB 4.4Å; F101-C104 VanDerWaalsContact O-CB 3.25Å; F101-C104 WeakPolarHBondContact O-CB 3.11Å; F101-C104 PolarHBondContact O-N 3.28Å; F101-C104 PolarHBondContact O-SG 3.01Å; F101-F251 AromaticContact CZ-CE1 3.84Å; F101-F251 HydrophobicContact CZ-CE1 3.84Å; F101-F251 AromaticContact CZ-CZ 3.99Å; F101-F251 HydrophobicContact CZ-CZ 3.99Å
102	F	53.4	Low	56.8	Low	105 Å²	105	38.5 Å²	38.5	46%	0.461	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	129.4	174.2	-177.8	-105.3	0	0	0	111.4	R56 S98 A137	R56-F102 PolarHBondContact NH2-O 3.48Å; S98-F102 WeakPolarHBondContact O-CB 3.36Å; F102-A137 HydrophobicContact CB-CB 4.33Å; F102-A137 HydrophobicContact CD2-CB 3.41Å; F102-A137 VanDerWaalsContact CD2-CB 3.41Å; F102-A137 HydrophobicContact CE2-CB 3.71Å; F102-A137 WeakPolarHBondContact CE2-O 3.09Å; F102-A137 HydrophobicContact CG-CB 3.91Å; F102-A137 HydrophobicContact CZ-CB 4.46Å
103	G	53.8	Low	57	Low	71 Å²	71	41.4 Å²	41.4	73%	0.732	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.2	2.2	-173.7	0	0	0	0	0	115.4	F101	F101-G103 PolarHBondContact O-N 3.48Å
104	C	56.9	Low	57.1	Low	18 Å²	18	41.7 Å²	41.7	12%	0.122	24%	0.238	C	C	.	.	S	Bend	trans	-76.8	150.6	170.5	-59.4	0	0	0	0	110.8	F64 V75 F101 V106	F64-C104 HydrophobicContact CB-CB 4.4Å; F64-C104 WeakPolarHBondContact CD1-SG 3.47Å; V75-C104 HydrophobicContact CG2-CB 4.21Å; F101-C104 HydrophobicContact CB-CB 4.4Å; F101-C104 VanDerWaalsContact O-CB 3.25Å; F101-C104 WeakPolarHBondContact O-CB 3.11Å; F101-C104 PolarHBondContact O-N 3.28Å; F101-C104 PolarHBondContact O-SG 3.01Å; C104-V106 WeakPolarHBondContact O-CG2 3.17Å; C104-V106 PolarHBondContact O-N 3.45Å
105	E	55	Low	57.2	Low	94 Å²	94	46.3 Å²	46.3	44%	0.439	26%	0.258	S	S	.	.			trans	-62	124.3	172.1	-72.4	174.5	173.9	0	0	109.6	H66	H66-E105 PolarHBondContact CD2-O 3.09Å; H66-E105 VanDerWaalsContact CD2-O 3.3Å; H66-E105 PolarHBondContact N-OE2 2.73Å; H66-E105 PolarHBondContact NE2-O 2.82Å
106	V	57.7	Low	57.7	Low	44 Å²	44	49.7 Å²	49.7	27%	0.267	27%	0.271	S	S	.	.			trans	-109.7	122.8	176.4	-172.7	0	0	0	0	107.6	Y97 C104 E110 H111 L114 I141	Y97-V106 WeakPolarHBondContact OH-CG2 3.17Å; C104-V106 WeakPolarHBondContact O-CG2 3.17Å; C104-V106 PolarHBondContact O-N 3.45Å; V106-E110 WeakPolarHBondContact CA-OE2 3.49Å; V106-E110 HydrophobicContact CG1-CB 3.69Å; V106-H111 HydrophobicContact CG1-CB 4.32Å; V106-L114 HydrophobicContact CG1-CD1 4.29Å; V106-I141 HydrophobicContact CG2-CG2 4.4Å
107	T	59.5	Low	58.1	Low	31 Å²	31	50.5 Å²	50.5	19%	0.19	28%	0.275	C	S	.	.			trans	-70.2	161.4	175.4	84.7	0	0	0	0	111.7	H66 E109 E110 H111	H66-T107 HydrophobicContact CB-CG2 4.5Å; H66-T107 VanDerWaalsContact CE1-CG2 3.44Å; H66-T107 WeakPolarHBondContact CE1-CG2 3.24Å; H66-T107 WeakPolarHBondContact NE2-CG2 3.27Å; T107-E109 VanDerWaalsContact C-N 3.31Å; T107-E109 VanDerWaalsContact CB-OE2 3.28Å; T107-E109 WeakPolarHBondContact CB-OE2 2.98Å; T107-E109 PolarHBondContact O-N 2.78Å; T107-E109 PolarHBondContact OG1-N 3.45Å; T107-E109 PolarHBondContact OG1-OE2 2.87Å; T107-E110 HydrophobicContact CG2-CG 4.39Å; T107-E110 PolarHBondContact N-OE2 2.93Å; T107-E110 CarbonylContact O-C 3.53Å; T107-E110 WeakPolarHBondContact O-CA 3.41Å; T107-E110 WeakPolarHBondContact O-CB 3.34Å; T107-E110 PolarHBondContact O-N 2.81Å; T107-E110 VanDerWaalsContact O-N 3.13Å; T107-E110 WeakPolarHBondContact OG1-CB 3.23Å; T107-E110 WeakPolarHBondContact OG1-CG 3.44Å; T107-E110 PolarHBondContact OG1-N 2.67Å; T107-H111 PolarHBondContact O-N 3.23Å
108	P	63.1	Low	58.1	Low	103 Å²	103	51.3 Å²	51.3	67%	0.669	28%	0.28	S	S	*	.	H	α-helix	trans	-57.8	-39.5	174.3	-26.1	36	0	0	0	113.8	E110 H111 S112	P108-E110 VanDerWaalsContact C-N 3.3Å; P108-H111 PolarHBondContact O-N 3.19Å; P108-S112 PolarHBondContact O-N 3.39Å
109	E	61.6	Low	58.5	Low	121 Å²	121	54 Å²	54	57%	0.565	30%	0.299	S	S	*	.	H	α-helix	trans	-63.2	-43.7	175.1	-57.9	73.5	-159	0	0	110.2	T107 H111 S112 Y113	T107-E109 VanDerWaalsContact C-N 3.31Å; T107-E109 VanDerWaalsContact CB-OE2 3.28Å; T107-E109 WeakPolarHBondContact CB-OE2 2.98Å; T107-E109 PolarHBondContact O-N 2.78Å; T107-E109 PolarHBondContact OG1-N 3.45Å; T107-E109 PolarHBondContact OG1-OE2 2.87Å; E109-H111 VanDerWaalsContact C-N 3.31Å; E109-H111 PolarHBondContact O-N 3.34Å; E109-S112 WeakPolarHBondContact O-CB 3.14Å; E109-S112 PolarHBondContact O-N 2.92Å; E109-Y113 WeakPolarHBondContact O-CD2 3.33Å; E109-Y113 PolarHBondContact O-N 3.43Å
110	E	57.8	Low	59.1	Low	12 Å²	12	56 Å²	56	6%	0.056	31%	0.308	C	S	.	.	H	α-helix	trans	-63.3	-33.6	177.7	-90.1	-169.1	162.9	0	0	113.7	H66 S73 V75 S76 K79 V106 T107 P108 L114	H66-E110 IonicContact CD2-OE2 2.63Å; H66-E110 IonicContact CE1-OE1 3.43Å; H66-E110 PolarHBondContact CE1-OE1 2.78Å; H66-E110 IonicContact CE1-OE2 2.99Å; H66-E110 PolarHBondContact CE1-OE2 2.77Å; H66-E110 IonicContact NE2-OE1 3.96Å; H66-E110 PolarHBondContact NE2-OE1 3.45Å; H66-E110 VanDerWaalsContact NE2-OE1 3.13Å; H66-E110 IonicContact NE2-OE2 3.13Å; H66-E110 PolarHBondContact NE2-OE2 3.38Å; S73-E110 PolarHBondContact OG-OE1 3.3Å; V75-E110 HydrophobicContact CG1-CG 4.3Å; V75-E110 WeakPolarHBondContact CG1-OE1 3.23Å; V75-E110 VanDerWaalsContact CG1-OE2 3.32Å; V75-E110 WeakPolarHBondContact CG1-OE2 3.25Å; S76-E110 PolarHBondContact N-OE1 3.22Å; K79-E110 HydrophobicContact CD-CG 4.04Å; K79-E110 PolarHBondContact NZ-O 2.74Å; K79-E110 IonicContact NZ-OE1 3.71Å; K79-E110 IonicContact NZ-OE2 2.79Å; V106-E110 WeakPolarHBondContact CA-OE2 3.49Å; V106-E110 HydrophobicContact CG1-CB 3.69Å; T107-E110 HydrophobicContact CG2-CG 4.39Å; T107-E110 PolarHBondContact N-OE2 2.93Å; T107-E110 CarbonylContact O-C 3.53Å; T107-E110 WeakPolarHBondContact O-CA 3.41Å; T107-E110 WeakPolarHBondContact O-CB 3.34Å; T107-E110 PolarHBondContact O-N 2.81Å; T107-E110 VanDerWaalsContact O-N 3.13Å; T107-E110 WeakPolarHBondContact OG1-CB 3.23Å; T107-E110 WeakPolarHBondContact OG1-CG 3.44Å; T107-E110 PolarHBondContact OG1-N 2.67Å; P108-E110 VanDerWaalsContact C-N 3.3Å; E110-L114 WeakPolarHBondContact O-CB 3.37Å; E110-L114 PolarHBondContact O-N 3.35Å
111	H	59.2	Low	59.4	Low	48 Å²	48	56 Å²	56	22%	0.222	31%	0.308	C	S	.	.	H	α-helix	trans	-70.9	-38.9	172.2	177	-103	0	0	0	111.6	V106 T107 P108 E109 Y113 L114 K115 I141 F142	V106-H111 HydrophobicContact CG1-CB 4.32Å; T107-H111 PolarHBondContact O-N 3.23Å; P108-H111 PolarHBondContact O-N 3.19Å; E109-H111 VanDerWaalsContact C-N 3.31Å; E109-H111 PolarHBondContact O-N 3.34Å; H111-Y113 PolarHBondContact O-N 3.37Å; H111-L114 WeakPolarHBondContact O-CB 3.42Å; H111-L114 PolarHBondContact O-N 2.67Å; H111-K115 WeakPolarHBondContact O-CB 3.31Å; H111-K115 PolarHBondContact O-N 3.39Å; H111-I141 PolarHBondContact NE2-O 3.09Å; H111-F142 AromaticContact CD2-CD1 3.94Å; H111-F142 AromaticContact NE2-CD1 3.67Å
112	S	61.5	Low	59.5	Low	72 Å²	72	58.7 Å²	58.7	50%	0.503	33%	0.33	S	S	.	.	H	α-helix	trans	-60.3	-41.9	177.7	-171.3	0	0	0	0	113	P108 E109 K115 E116	P108-S112 PolarHBondContact O-N 3.39Å; E109-S112 WeakPolarHBondContact O-CB 3.14Å; E109-S112 PolarHBondContact O-N 2.92Å; S112-K115 WeakPolarHBondContact O-CB 3.22Å; S112-K115 PolarHBondContact O-N 2.74Å; S112-E116 PolarHBondContact O-N 3.31Å
113	Y	61.4	Low	59.7	Low	94 Å²	94	58.2 Å²	58.2	37%	0.369	34%	0.34	S	S	.	.	H	α-helix	trans	-69.5	-41.9	178.8	-71.5	-59	0	0	0	113.2	R83 E109 H111 K115 E116 D117	R83-Y113 PolarHBondContact NH2-OH 2.98Å; E109-Y113 WeakPolarHBondContact O-CD2 3.33Å; E109-Y113 PolarHBondContact O-N 3.43Å; H111-Y113 PolarHBondContact O-N 3.37Å; Y113-K115 PolarHBondContact O-N 3.45Å; Y113-E116 WeakPolarHBondContact CD1-OE2 3.46Å; Y113-E116 WeakPolarHBondContact O-CA 3.47Å; Y113-E116 WeakPolarHBondContact O-CB 3.48Å; Y113-E116 PolarHBondContact O-N 2.84Å; Y113-E116 VanDerWaalsContact O-N 3.09Å; Y113-D117 PolarHBondContact O-N 2.69Å
114	L	60.8	Low	59.9	Low	5 Å²	5	58.2 Å²	58.2	3%	0.026	33%	0.326	C	S	.	.	H	α-helix	trans	-57	-38.1	175.1	-104.9	-170.3	0	0	0	109.2	L94 Y97 V106 E110 H111 L118 F142	L94-L114 HydrophobicContact CD2-CD2 3.37Å; Y97-L114 HydrophobicContact CD1-CD2 4.36Å; Y97-L114 HydrophobicContact CE1-CD1 3.79Å; Y97-L114 HydrophobicContact CE1-CD2 4.42Å; V106-L114 HydrophobicContact CG1-CD1 4.29Å; E110-L114 WeakPolarHBondContact O-CB 3.37Å; E110-L114 PolarHBondContact O-N 3.35Å; H111-L114 WeakPolarHBondContact O-CB 3.42Å; H111-L114 PolarHBondContact O-N 2.67Å; L114-L118 PolarHBondContact O-N 3.22Å; L114-L118 VanDerWaalsContact O-N 3.13Å; L114-F142 HydrophobicContact CB-CE1 3.41Å; L114-F142 VanDerWaalsContact CB-CE1 3.41Å; L114-F142 HydrophobicContact CB-CE2 4.36Å; L114-F142 HydrophobicContact CB-CZ 3.19Å; L114-F142 HydrophobicContact CD1-CZ 4.14Å; L114-F142 HydrophobicContact CD2-CZ 3.95Å; L114-F142 HydrophobicContact CG-CE1 4.5Å; L114-F142 HydrophobicContact CG-CZ 3.92Å; L114-F142 WeakPolarHBondContact O-CZ 3.4Å
115	K	62	Low	59.5	Low	101 Å²	101	60.5 Å²	60.5	44%	0.439	35%	0.353	S	S	.	.	H	α-helix	trans	-73.4	-34.4	177.5	-176.2	177.5	180	173.8	0	111.9	H111 S112 Y113 S119 F142	H111-K115 WeakPolarHBondContact O-CB 3.31Å; H111-K115 PolarHBondContact O-N 3.39Å; S112-K115 WeakPolarHBondContact O-CB 3.22Å; S112-K115 PolarHBondContact O-N 2.74Å; Y113-K115 PolarHBondContact O-N 3.45Å; K115-S119 VanDerWaalsContact O-CB 3.27Å; K115-S119 WeakPolarHBondContact O-CB 3Å; K115-S119 PolarHBondContact O-N 2.78Å; K115-S119 PolarHBondContact O-OG 3.02Å; K115-F142 HydrophobicContact CB-CD1 4.18Å; K115-F142 HydrophobicContact CB-CE1 3.92Å
116	E	65.9	Low	59.1	Low	99 Å²	99	58.4 Å²	58.4	46%	0.463	34%	0.344	S	S	.	.	H	α-helix	trans	-62.9	-51	171.8	-173.4	-178.4	-179.1	0	0	110.9	S112 Y113 L118 S119 D120	S112-E116 PolarHBondContact O-N 3.31Å; Y113-E116 WeakPolarHBondContact CD1-OE2 3.46Å; Y113-E116 WeakPolarHBondContact O-CA 3.47Å; Y113-E116 WeakPolarHBondContact O-CB 3.48Å; Y113-E116 PolarHBondContact O-N 2.84Å; Y113-E116 VanDerWaalsContact O-N 3.09Å; E116-L118 VanDerWaalsContact C-N 3.32Å; E116-L118 PolarHBondContact O-N 2.74Å; E116-S119 CarbonylContact O-C 3.59Å; E116-S119 WeakPolarHBondContact O-CA 3.17Å; E116-S119 WeakPolarHBondContact O-CB 3.46Å; E116-S119 PolarHBondContact O-N 2.73Å; E116-D120 PolarHBondContact O-N 2.8Å
117	D	63.3	Low	58.5	Low	16 Å²	16	60.4 Å²	60.4	9%	0.086	35%	0.354	C	S	.	.	H	α-helix	trans	-58.3	-42.9	177.7	-70	-2.4	0	0	0	111.9	R90 L94 Y113 D120 L121	R90-D117 IonicContact CZ-OD1 3.32Å; R90-D117 IonicContact NE-OD1 2.88Å; R90-D117 IonicContact NH2-OD1 2.77Å; R90-D117 PolarHBondContact NH2-OD1 3Å; L94-D117 HydrophobicContact CD1-CB 3.98Å; Y113-D117 PolarHBondContact O-N 2.69Å; D117-D120 PolarHBondContact O-N 3.44Å; D117-L121 WeakPolarHBondContact O-CB 3.1Å; D117-L121 VanDerWaalsContact O-CG 3.26Å; D117-L121 WeakPolarHBondContact O-CG 3.14Å; D117-L121 PolarHBondContact O-N 2.95Å
118	L	60	Low	57.7	Low	20 Å²	20	63.9 Å²	63.9	11%	0.105	37%	0.37	C	S	.	.	H	α-helix	trans	-67.7	-35.5	174.6	-76.6	-170.7	0	0	0	113.1	L94 L114 E116 L121 A122 L135 L139 F142	L94-L118 HydrophobicContact CD1-CD2 4.31Å; L114-L118 PolarHBondContact O-N 3.22Å; L114-L118 VanDerWaalsContact O-N 3.13Å; E116-L118 VanDerWaalsContact C-N 3.32Å; E116-L118 PolarHBondContact O-N 2.74Å; L118-L121 HydrophobicContact CD2-CD1 4.27Å; L118-L121 PolarHBondContact O-N 3.12Å; L118-A122 WeakPolarHBondContact O-CB 3.42Å; L118-A122 PolarHBondContact O-N 3.18Å; L118-L135 HydrophobicContact CD2-CD1 4.29Å; L118-L139 HydrophobicContact CD1-CD2 3.9Å; L118-F142 HydrophobicContact CD1-CB 4.48Å; L118-F142 HydrophobicContact CD1-CD1 4.3Å; L118-F142 HydrophobicContact CD1-CD2 3.17Å; L118-F142 HydrophobicContact CD1-CE1 4.26Å; L118-F142 HydrophobicContact CD1-CE2 3.12Å; L118-F142 HydrophobicContact CD1-CG 3.75Å; L118-F142 HydrophobicContact CD1-CZ 3.63Å; L118-F142 HydrophobicContact CG-CD2 4.34Å; L118-F142 HydrophobicContact CG-CE2 3.84Å; L118-F142 HydrophobicContact CG-CZ 4.03Å
119	S	62.3	Low	56.7	Low	65 Å²	65	65 Å²	65	46%	0.455	37%	0.366	S	S	.	.	H	α-helix	trans	-67.6	-40.8	176.4	-61.3	0	0	0	0	110.8	K115 E116 A122 S123	K115-S119 VanDerWaalsContact O-CB 3.27Å; K115-S119 WeakPolarHBondContact O-CB 3Å; K115-S119 PolarHBondContact O-N 2.78Å; K115-S119 PolarHBondContact O-OG 3.02Å; E116-S119 CarbonylContact O-C 3.59Å; E116-S119 WeakPolarHBondContact O-CA 3.17Å; E116-S119 WeakPolarHBondContact O-CB 3.46Å; E116-S119 PolarHBondContact O-N 2.73Å; S119-A122 PolarHBondContact O-N 3.38Å; S119-S123 WeakPolarHBondContact O-CB 3.22Å; S119-S123 PolarHBondContact O-N 3.32Å
120	D	62.9	Low	55.8	Low	54 Å²	54	63 Å²	63	29%	0.289	36%	0.362	S	S	.	.	H	α-helix	trans	-58.5	-49.2	172	-75.1	-7.5	0	0	0	110.1	L87 R90 E116 D117 A122 S123 T124	L87-D120 HydrophobicContact CD1-CB 4.48Å; R90-D120 IonicContact CZ-OD2 3.9Å; R90-D120 IonicContact NH1-OD2 3.46Å; R90-D120 PolarHBondContact NH1-OD2 3.29Å; R90-D120 IonicContact NH2-OD2 2.8Å; R90-D120 PolarHBondContact NH2-OD2 2.96Å; E116-D120 PolarHBondContact O-N 2.8Å; D117-D120 PolarHBondContact O-N 3.44Å; D120-A122 PolarHBondContact O-N 3.24Å; D120-S123 PolarHBondContact O-N 3.41Å; D120-S123 PolarHBondContact O-OG 3.46Å; D120-T124 WeakPolarHBondContact O-CG2 3.2Å; D120-T124 PolarHBondContact O-N 2.77Å; D120-T124 VanDerWaalsContact O-N 3.14Å
121	L	56.5	Low	55	Low	2 Å²	2	62.7 Å²	62.7	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-61.8	-43.8	177.6	-72.6	166.3	0	0	0	112.4	L87 L91 L94 D117 L118 S123 T124 I126 L131	L87-L121 HydrophobicContact CD1-CD2 3.6Å; L87-L121 HydrophobicContact CD1-CG 4.12Å; L87-L121 HydrophobicContact CD2-CD2 4.26Å; L87-L121 HydrophobicContact CG-CD2 3.72Å; L91-L121 HydrophobicContact CB-CD1 4.41Å; L91-L121 HydrophobicContact CB-CD2 4Å; L91-L121 HydrophobicContact CD1-CD1 3.69Å; L91-L121 HydrophobicContact CD1-CD2 4.19Å; L94-L121 HydrophobicContact CD1-CD1 3.52Å; D117-L121 WeakPolarHBondContact O-CB 3.1Å; D117-L121 VanDerWaalsContact O-CG 3.26Å; D117-L121 WeakPolarHBondContact O-CG 3.14Å; D117-L121 PolarHBondContact O-N 2.95Å; L118-L121 HydrophobicContact CD2-CD1 4.27Å; L118-L121 PolarHBondContact O-N 3.12Å; L121-S123 VanDerWaalsContact C-N 3.3Å; L121-S123 PolarHBondContact O-N 3.25Å; L121-T124 PolarHBondContact O-N 3.19Å; L121-T124 PolarHBondContact O-OG1 3.15Å; L121-I126 HydrophobicContact CD2-CD1 3.68Å; L121-L131 HydrophobicContact CB-CD1 4.34Å; L121-L131 HydrophobicContact CB-CD2 4.47Å; L121-L131 HydrophobicContact CD1-CD2 4.32Å
122	A	55.2	Low	54.2	Low	57 Å²	57	61.5 Å²	61.5	47%	0.471	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-38.3	175.4	0	0	0	0	0	111.8	L118 S119 D120 T124 G125	L118-A122 WeakPolarHBondContact O-CB 3.42Å; L118-A122 PolarHBondContact O-N 3.18Å; S119-A122 PolarHBondContact O-N 3.38Å; D120-A122 PolarHBondContact O-N 3.24Å; A122-T124 PolarHBondContact O-N 2.85Å; A122-G125 PolarHBondContact O-N 3.31Å
123	S	58.5	Low	53.3	Low	96 Å²	96	61.5 Å²	61.5	67%	0.671	36%	0.357	S	S	*	.	H	α-helix	trans	-66.8	-23.8	177.6	80.1	0	0	0	0	113.3	S119 D120 L121 G125	S119-S123 WeakPolarHBondContact O-CB 3.22Å; S119-S123 PolarHBondContact O-N 3.32Å; D120-S123 PolarHBondContact O-N 3.41Å; D120-S123 PolarHBondContact O-OG 3.46Å; L121-S123 VanDerWaalsContact C-N 3.3Å; L121-S123 PolarHBondContact O-N 3.25Å; S123-G125 PolarHBondContact O-N 3.4Å
124	T	56.9	Low	52.4	Low	70 Å²	70	59.1 Å²	59.1	43%	0.429	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-1.2	179.1	67.6	0	0	0	0	113.9	L87 D120 L121 A122	L87-T124 HydrophobicContact CD1-CG2 4.08Å; L87-T124 HydrophobicContact CD2-CG2 3.26Å; L87-T124 HydrophobicContact CG-CG2 4.29Å; D120-T124 WeakPolarHBondContact O-CG2 3.2Å; D120-T124 PolarHBondContact O-N 2.77Å; D120-T124 VanDerWaalsContact O-N 3.14Å; L121-T124 PolarHBondContact O-N 3.19Å; L121-T124 PolarHBondContact O-OG1 3.15Å; A122-T124 PolarHBondContact O-N 2.85Å
125	G	47.7	Very low	51.8	Low	67 Å²	67	58.9 Å²	58.9	69%	0.691	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	7.8	177.9	0	0	0	0	0	114.3	A122 S123 N127	A122-G125 PolarHBondContact O-N 3.31Å; S123-G125 PolarHBondContact O-N 3.4Å; G125-N127 PolarHBondContact O-N 2.79Å
126	I	46.9	Very low	51.1	Low	50 Å²	50	55.8 Å²	55.8	26%	0.256	35%	0.346	S	S	.	.			trans	-63.8	122.8	170.4	-60.5	172	0	0	0	107.7	L91 L121 I128 L131	L91-I126 HydrophobicContact CD2-CD1 4.44Å; L121-I126 HydrophobicContact CD2-CD1 3.68Å; I126-I128 PolarHBondContact O-N 2.86Å; I126-L131 HydrophobicContact CG2-CD1 4.4Å; I126-L131 HydrophobicContact CG2-CD2 3.97Å; I126-L131 HydrophobicContact CG2-CG 3.85Å
127	N	45.1	Very low	50.2	Low	86 Å²	86	52.2 Å²	52.2	46%	0.46	33%	0.333	S	S	.	.			trans	-57.7	128.1	178.5	-175.4	-17	0	0	0	109.7	G125 H129 T130 L131	G125-N127 PolarHBondContact O-N 2.79Å; N127-H129 PolarHBondContact O-N 3.39Å; N127-H129 VanDerWaalsContact O-N 3.13Å; N127-H129 WeakPolarHBondContact OD1-CB 3.31Å; N127-H129 PolarHBondContact OD1-CD2 2.92Å; N127-H129 PolarHBondContact OD1-N 3.04Å; N127-T130 WeakPolarHBondContact O-CA 3.41Å; N127-T130 VanDerWaalsContact O-CB 3.25Å; N127-T130 WeakPolarHBondContact O-CB 3.21Å; N127-T130 PolarHBondContact O-N 3.43Å; N127-L131 PolarHBondContact O-N 3.39Å; N127-L131 VanDerWaalsContact O-N 3.13Å
128	I	42.9	Very low	49.4	Very low	103 Å²	103	51.4 Å²	51.4	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-56.9	-28.3	176.9	-162.9	158.5	0	0	0	111.9	I126 L131 C132	I126-I128 PolarHBondContact O-N 2.86Å; I128-L131 CarbonylContact O-C 3.53Å; I128-L131 WeakPolarHBondContact O-CB 3.23Å; I128-L131 PolarHBondContact O-N 3.01Å; I128-C132 WeakPolarHBondContact O-CB 3.46Å; I128-C132 PolarHBondContact O-N 3.42Å; I128-C132 PolarHBondContact O-SG 2.94Å
129	H	42	Very low	48.7	Very low	128 Å²	128	51 Å²	51	59%	0.593	33%	0.327	S	S	*	.	H	α-helix	trans	-64	-38.1	171.8	-67.6	-66.4	0	0	0	112.7	N127 C132 S133	N127-H129 PolarHBondContact O-N 3.39Å; N127-H129 VanDerWaalsContact O-N 3.13Å; N127-H129 WeakPolarHBondContact OD1-CB 3.31Å; N127-H129 PolarHBondContact OD1-CD2 2.92Å; N127-H129 PolarHBondContact OD1-N 3.04Å; H129-C132 PolarHBondContact O-N 3.32Å; H129-S133 WeakPolarHBondContact O-CB 3.49Å; H129-S133 PolarHBondContact O-N 3.5Å; H129-S133 PolarHBondContact O-OG 2.8Å
130	T	44	Very low	48	Very low	78 Å²	78	50.5 Å²	50.5	48%	0.479	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-42.7	173.6	-52	0	0	0	0	110.1	N127 S133 A134	N127-T130 WeakPolarHBondContact O-CA 3.41Å; N127-T130 VanDerWaalsContact O-CB 3.25Å; N127-T130 WeakPolarHBondContact O-CB 3.21Å; N127-T130 PolarHBondContact O-N 3.43Å; T130-S133 WeakPolarHBondContact CA-OG 3.1Å; T130-S133 PolarHBondContact O-N 3.45Å; T130-S133 PolarHBondContact O-OG 2.81Å; T130-A134 WeakPolarHBondContact O-CB 3.33Å; T130-A134 PolarHBondContact O-N 3.05Å; T130-A134 VanDerWaalsContact O-N 3.08Å
131	L	41	Very low	47.1	Very low	6 Å²	6	50.1 Å²	50.1	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-61.7	-47	173	-64.1	171.5	0	0	0	111	L91 L121 I126 N127 I128 S133 A134 L135 L139	L91-L131 HydrophobicContact CD1-CD2 3.5Å; L91-L131 VanDerWaalsContact CD1-CD2 3.5Å; L121-L131 HydrophobicContact CB-CD1 4.34Å; L121-L131 HydrophobicContact CB-CD2 4.47Å; L121-L131 HydrophobicContact CD1-CD2 4.32Å; I126-L131 HydrophobicContact CG2-CD1 4.4Å; I126-L131 HydrophobicContact CG2-CD2 3.97Å; I126-L131 HydrophobicContact CG2-CG 3.85Å; N127-L131 PolarHBondContact O-N 3.39Å; N127-L131 VanDerWaalsContact O-N 3.13Å; I128-L131 CarbonylContact O-C 3.53Å; I128-L131 WeakPolarHBondContact O-CB 3.23Å; I128-L131 PolarHBondContact O-N 3.01Å; L131-S133 VanDerWaalsContact C-N 3.3Å; L131-S133 PolarHBondContact O-N 3.36Å; L131-A134 PolarHBondContact O-N 3.42Å; L131-A134 VanDerWaalsContact O-N 3.16Å; L131-L135 HydrophobicContact CD2-CD1 4.19Å; L131-L135 WeakPolarHBondContact O-CA 3.27Å; L131-L135 WeakPolarHBondContact O-CB 3.2Å; L131-L135 PolarHBondContact O-N 3.43Å; L131-L139 HydrophobicContact CB-CD1 4.48Å
132	C	40.7	Very low	46.6	Very low	22 Å²	22	51.1 Å²	51.1	15%	0.149	33%	0.329	C	S	.	.	H	α-helix	trans	-59.5	-35.8	176.2	-66.7	0	0	0	0	113.7	I128 H129 P136 L139 M159	I128-C132 WeakPolarHBondContact O-CB 3.46Å; I128-C132 PolarHBondContact O-N 3.42Å; I128-C132 PolarHBondContact O-SG 2.94Å; H129-C132 PolarHBondContact O-N 3.32Å; C132-P136 WeakPolarHBondContact O-CD 3.38Å; C132-L139 HydrophobicContact CB-CD1 3.99Å; C132-L139 VanDerWaalsContact SG-CD1 3.55Å; C132-M159 HydrophobicContact CB-CE 4.29Å
133	S	42.6	Very low	45.9	Very low	72 Å²	72	50.9 Å²	50.9	50%	0.503	32%	0.319	S	S	.	.	H	α-helix	trans	-73.9	-31.8	176.7	67.6	0	0	0	0	113.3	H129 T130 L131	H129-S133 WeakPolarHBondContact O-CB 3.49Å; H129-S133 PolarHBondContact O-N 3.5Å; H129-S133 PolarHBondContact O-OG 2.8Å; T130-S133 WeakPolarHBondContact CA-OG 3.1Å; T130-S133 PolarHBondContact O-N 3.45Å; T130-S133 PolarHBondContact O-OG 2.81Å; L131-S133 VanDerWaalsContact C-N 3.3Å; L131-S133 PolarHBondContact O-N 3.36Å
134	A	43.7	Very low	45	Very low	44 Å²	44	50.4 Å²	50.4	36%	0.364	31%	0.309	S	S	.	.	H	α-helix	trans	-93.3	-24.9	-177.4	0	0	0	0	0	113.5	T130 L131 P136	T130-A134 WeakPolarHBondContact O-CB 3.33Å; T130-A134 PolarHBondContact O-N 3.05Å; T130-A134 VanDerWaalsContact O-N 3.08Å; L131-A134 PolarHBondContact O-N 3.42Å; L131-A134 VanDerWaalsContact O-N 3.16Å; A134-P136 VanDerWaalsContact C-CD 3.46Å
135	L	48.5	Very low	44.1	Very low	0 Å²	0	54 Å²	54	0%	0	33%	0.326	C	S	.	.			trans	-131.4	39.3	-169.5	-65.7	175.9	0	0	0	113.7	L91 L94 C95 S98 L118 L131 A137 T138 L139	L91-L135 HydrophobicContact CD1-CD1 3.84Å; L94-L135 VanDerWaalsContact C-CD2 3.43Å; L94-L135 HydrophobicContact CB-CD1 4.22Å; L94-L135 HydrophobicContact CB-CD2 4.11Å; L94-L135 WeakPolarHBondContact O-CD2 3.42Å; C95-L135 HydrophobicContact CB-CD2 4Å; C95-L135 WeakPolarHBondContact SG-CD2 3.35Å; S98-L135 WeakPolarHBondContact OG-CD2 3.23Å; L118-L135 HydrophobicContact CD2-CD1 4.29Å; L131-L135 HydrophobicContact CD2-CD1 4.19Å; L131-L135 WeakPolarHBondContact O-CA 3.27Å; L131-L135 WeakPolarHBondContact O-CB 3.2Å; L131-L135 PolarHBondContact O-N 3.43Å; L135-A137 VanDerWaalsContact C-N 3.28Å; L135-A137 PolarHBondContact O-N 3.01Å; L135-T138 PolarHBondContact O-N 2.55Å; L135-T138 VanDerWaalsContact O-N 3.13Å; L135-L139 HydrophobicContact CB-CD1 4.3Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 PolarHBondContact O-N 3.37Å
136	P	46.8	Very low	43.5	Very low	36 Å²	36	59.8 Å²	59.8	23%	0.234	34%	0.335	C	S	.	.	H	α-helix	trans	-58.1	-41.8	-174.3	22.8	-32	0	0	0	112.2	C132 A134 L139 A140	C132-P136 WeakPolarHBondContact O-CD 3.38Å; A134-P136 VanDerWaalsContact C-CD 3.46Å; P136-L139 PolarHBondContact O-N 3.29Å; P136-A140 PolarHBondContact O-N 3.06Å
137	A	47	Very low	43.1	Very low	24 Å²	24	66.5 Å²	66.5	20%	0.198	36%	0.357	C	S	.	.	H	α-helix	trans	-66.1	-40.7	176.9	0	0	0	0	0	113.4	F102 L135	F102-A137 HydrophobicContact CB-CB 4.33Å; F102-A137 HydrophobicContact CD2-CB 3.41Å; F102-A137 VanDerWaalsContact CD2-CB 3.41Å; F102-A137 HydrophobicContact CE2-CB 3.71Å; F102-A137 WeakPolarHBondContact CE2-O 3.09Å; F102-A137 HydrophobicContact CG-CB 3.91Å; F102-A137 HydrophobicContact CZ-CB 4.46Å; L135-A137 VanDerWaalsContact C-N 3.28Å; L135-A137 PolarHBondContact O-N 3.01Å
138	T	46.2	Very low	42.7	Very low	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-69	-38.1	177.4	-75.2	0	0	0	0	110	L94 S98 L135 I141 F142	L94-T138 PolarHBondContact O-OG1 3.34Å; S98-T138 WeakPolarHBondContact CA-OG1 3.13Å; S98-T138 WeakPolarHBondContact CB-OG1 3.5Å; S98-T138 PolarHBondContact N-OG1 3.45Å; S98-T138 PolarHBondContact OG-OG1 2.74Å; L135-T138 PolarHBondContact O-N 2.55Å; L135-T138 VanDerWaalsContact O-N 3.13Å; T138-I141 WeakPolarHBondContact O-CB 3.28Å; T138-I141 PolarHBondContact O-N 3.08Å; T138-F142 HydrophobicContact CG2-CD2 4.25Å; T138-F142 HydrophobicContact CG2-CE2 3.54Å; T138-F142 WeakPolarHBondContact O-CD2 3.38Å; T138-F142 VanDerWaalsContact O-CE2 3.32Å; T138-F142 WeakPolarHBondContact O-CE2 3.5Å
139	L	44.4	Very low	42.7	Very low	11 Å²	11	61.2 Å²	61.2	6%	0.058	33%	0.334	C	S	.	.	H	α-helix	trans	-70.2	-33.6	178.6	-76.8	160.2	0	0	0	113.8	L118 L131 C132 L135 P136 I141 F142 L143	L118-L139 HydrophobicContact CD1-CD2 3.9Å; L131-L139 HydrophobicContact CB-CD1 4.48Å; C132-L139 HydrophobicContact CB-CD1 3.99Å; C132-L139 VanDerWaalsContact SG-CD1 3.55Å; L135-L139 HydrophobicContact CB-CD1 4.3Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 PolarHBondContact O-N 3.37Å; P136-L139 PolarHBondContact O-N 3.29Å; L139-I141 PolarHBondContact O-N 3.34Å; L139-F142 PolarHBondContact O-N 3.45Å; L139-L143 HydrophobicContact CB-CD1 4.18Å; L139-L143 WeakPolarHBondContact O-CD1 3.37Å; L139-L143 VanDerWaalsContact O-CG 3.22Å; L139-L143 WeakPolarHBondContact O-CG 3.43Å; L139-L143 PolarHBondContact O-N 3.43Å; L139-L143 VanDerWaalsContact O-N 3.17Å
140	A	48.2	Very low	42.9	Very low	55 Å²	55	60.1 Å²	60.1	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-57.4	-28.7	171.8	0	0	0	0	0	112.8	P136 F142	P136-A140 PolarHBondContact O-N 3.06Å; A140-F142 VanDerWaalsContact C-N 3.32Å
141	I	45.1	Very low	42.9	Very low	45 Å²	45	59.4 Å²	59.4	23%	0.231	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.9	176.7	-59.3	168.9	0	0	0	111.9	Y97 V106 H111 T138 L139	Y97-I141 HydrophobicContact CE1-CD1 4.06Å; V106-I141 HydrophobicContact CG2-CG2 4.4Å; H111-I141 PolarHBondContact NE2-O 3.09Å; T138-I141 WeakPolarHBondContact O-CB 3.28Å; T138-I141 PolarHBondContact O-N 3.08Å; L139-I141 PolarHBondContact O-N 3.34Å
142	F	44.1	Very low	42.7	Very low	24 Å²	24	62.6 Å²	62.6	11%	0.105	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-19.7	-172.5	-69.6	-70.4	0	0	0	115.9	H111 L114 K115 L118 T138 L139 A140 D144	H111-F142 AromaticContact CD2-CD1 3.94Å; H111-F142 AromaticContact NE2-CD1 3.67Å; L114-F142 HydrophobicContact CB-CE1 3.41Å; L114-F142 VanDerWaalsContact CB-CE1 3.41Å; L114-F142 HydrophobicContact CB-CE2 4.36Å; L114-F142 HydrophobicContact CB-CZ 3.19Å; L114-F142 HydrophobicContact CD1-CZ 4.14Å; L114-F142 HydrophobicContact CD2-CZ 3.95Å; L114-F142 HydrophobicContact CG-CE1 4.5Å; L114-F142 HydrophobicContact CG-CZ 3.92Å; L114-F142 WeakPolarHBondContact O-CZ 3.4Å; K115-F142 HydrophobicContact CB-CD1 4.18Å; K115-F142 HydrophobicContact CB-CE1 3.92Å; L118-F142 HydrophobicContact CD1-CB 4.48Å; L118-F142 HydrophobicContact CD1-CD1 4.3Å; L118-F142 HydrophobicContact CD1-CD2 3.17Å; L118-F142 HydrophobicContact CD1-CE1 4.26Å; L118-F142 HydrophobicContact CD1-CE2 3.12Å; L118-F142 HydrophobicContact CD1-CG 3.75Å; L118-F142 HydrophobicContact CD1-CZ 3.63Å; L118-F142 HydrophobicContact CG-CD2 4.34Å; L118-F142 HydrophobicContact CG-CE2 3.84Å; L118-F142 HydrophobicContact CG-CZ 4.03Å; T138-F142 HydrophobicContact CG2-CD2 4.25Å; T138-F142 HydrophobicContact CG2-CE2 3.54Å; T138-F142 WeakPolarHBondContact O-CD2 3.38Å; T138-F142 VanDerWaalsContact O-CE2 3.32Å; T138-F142 WeakPolarHBondContact O-CE2 3.5Å; L139-F142 PolarHBondContact O-N 3.45Å; A140-F142 VanDerWaalsContact C-N 3.32Å; F142-D144 PolarHBondContact O-N 2.8Å; F142-D144 VanDerWaalsContact O-N 3.1Å
143	L	41.3	Very low	42.6	Very low	52 Å²	52	64.1 Å²	64.1	27%	0.272	36%	0.363	S	S	.	.			trans	-86.5	92	-172.6	-68.7	168.3	0	0	0	106.3	L139 D145 L148 I156	L139-L143 HydrophobicContact CB-CD1 4.18Å; L139-L143 WeakPolarHBondContact O-CD1 3.37Å; L139-L143 VanDerWaalsContact O-CG 3.22Å; L139-L143 WeakPolarHBondContact O-CG 3.43Å; L139-L143 PolarHBondContact O-N 3.43Å; L139-L143 VanDerWaalsContact O-N 3.17Å; L143-D145 PolarHBondContact O-N 3.45Å; L143-L148 HydrophobicContact CB-CD1 3.4Å; L143-L148 VanDerWaalsContact CB-CD1 3.4Å; L143-L148 HydrophobicContact CB-CD2 3.89Å; L143-L148 HydrophobicContact CB-CG 3.66Å; L143-L148 HydrophobicContact CD1-CD2 3.76Å; L143-L148 HydrophobicContact CD1-CG 4.49Å; L143-L148 HydrophobicContact CD2-CD2 4.33Å; L143-L148 HydrophobicContact CG-CD2 4.2Å; L143-L148 HydrophobicContact CG-CG 4.45Å; L143-L148 WeakPolarHBondContact O-CD1 3.28Å; L143-I156 HydrophobicContact CD1-CD1 3.2Å
144	D	40.7	Very low	42.8	Very low	86 Å²	86	68.4 Å²	68.4	46%	0.46	37%	0.368	S	S	.	.			trans	-47.5	135.4	167.8	-68.1	-43.3	0	0	0	108.7	F142 E146 R147 L148	F142-D144 PolarHBondContact O-N 2.8Å; F142-D144 VanDerWaalsContact O-N 3.1Å; D144-E146 PolarHBondContact O-N 3.49Å; D144-R147 PolarHBondContact O-N 2.72Å; D144-L148 PolarHBondContact O-N 2.82Å
145	D	36.6	Very low	42.7	Very low	144 Å²	144	71.9 Å²	71.9	77%	0.77	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-28.5	177.3	-79.9	-29.8	0	0	0	112.4	L143	L143-D145 PolarHBondContact O-N 3.45Å
146	E	36.5	Very low	42.3	Very low	190 Å²	190	73.6 Å²	73.6	89%	0.888	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-26.8	177.8	-67.5	-168.6	161.8	0	0	114.9	D144	D144-E146 PolarHBondContact O-N 3.49Å
147	R	37.3	Very low	42.1	Very low	191 Å²	191	77.1 Å²	77.1	72%	0.721	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-13.6	-176.3	-77.7	-173.2	143.7	-157.9	-5.7	113.7	D144 S149	D144-R147 PolarHBondContact O-N 2.72Å; R147-S149 PolarHBondContact O-N 3.32Å; R147-S149 VanDerWaalsContact O-N 3.13Å
148	L	37.8	Very low	41.7	Very low	18 Å²	18	80.5 Å²	80.5	9%	0.094	41%	0.409	C	S	.	.	S	Bend	trans	-78.1	91.6	163.4	-70.3	150.5	0	0	0	107.7	L143 D144 S150 N152 L153 I156	L143-L148 HydrophobicContact CB-CD1 3.4Å; L143-L148 VanDerWaalsContact CB-CD1 3.4Å; L143-L148 HydrophobicContact CB-CD2 3.89Å; L143-L148 HydrophobicContact CB-CG 3.66Å; L143-L148 HydrophobicContact CD1-CD2 3.76Å; L143-L148 HydrophobicContact CD1-CG 4.49Å; L143-L148 HydrophobicContact CD2-CD2 4.33Å; L143-L148 HydrophobicContact CG-CD2 4.2Å; L143-L148 HydrophobicContact CG-CG 4.45Å; L143-L148 WeakPolarHBondContact O-CD1 3.28Å; D144-L148 PolarHBondContact O-N 2.82Å; L148-S150 PolarHBondContact O-N 3.49Å; L148-N152 HydrophobicContact CD2-CB 3.99Å; L148-L153 HydrophobicContact CB-CB 4.11Å; L148-L153 HydrophobicContact CB-CD1 3.5Å; L148-L153 VanDerWaalsContact CB-CD1 3.5Å; L148-L153 HydrophobicContact CB-CG 3.56Å; L148-L153 HydrophobicContact CD1-CD1 3.73Å; L148-L153 HydrophobicContact CD1-CD2 3.98Å; L148-L153 HydrophobicContact CD1-CG 3.47Å; L148-L153 VanDerWaalsContact CD1-CG 3.47Å; L148-L153 HydrophobicContact CD2-CB 4.32Å; L148-L153 HydrophobicContact CD2-CG 3.9Å; L148-L153 HydrophobicContact CG-CD1 4.12Å; L148-L153 HydrophobicContact CG-CG 3.77Å; L148-I156 HydrophobicContact CD2-CD1 3.97Å
149	S	42.8	Very low	41.3	Very low	60 Å²	60	83.9 Å²	83.9	42%	0.42	43%	0.425	S	S	.	.			trans	-47.1	136	154.7	75.5	0	0	0	0	106.9	R147 S151 N152 L153	R147-S149 PolarHBondContact O-N 3.32Å; R147-S149 VanDerWaalsContact O-N 3.13Å; S149-S151 CarbonylContact O-C 3.55Å; S149-S151 PolarHBondContact O-N 2.68Å; S149-S151 PolarHBondContact OG-OG 3.45Å; S149-N152 PolarHBondContact O-N 3.28Å; S149-L153 PolarHBondContact O-N 2.72Å
150	S	44.5	Very low	40.9	Very low	105 Å²	105	84.9 Å²	84.9	73%	0.734	44%	0.438	S	S	*	.	H	α-helix	trans	-48.9	-24	-174.5	51.3	0	0	0	0	113.8	L148 R154	L148-S150 PolarHBondContact O-N 3.49Å; S150-R154 VanDerWaalsContact O-CB 3.26Å; S150-R154 WeakPolarHBondContact O-CB 3.18Å; S150-R154 PolarHBondContact O-N 2.78Å
151	S	44	Very low	40.3	Very low	63 Å²	63	88.4 Å²	88.4	44%	0.441	45%	0.445	S	S	.	.	H	α-helix	trans	-68.7	-35.1	172.8	75.7	0	0	0	0	115.6	S149 K155	S149-S151 CarbonylContact O-C 3.55Å; S149-S151 PolarHBondContact O-N 2.68Å; S149-S151 PolarHBondContact OG-OG 3.45Å; S151-K155 WeakPolarHBondContact O-CB 3.47Å; S151-K155 WeakPolarHBondContact O-CG 3.42Å; S151-K155 PolarHBondContact O-N 3.21Å
152	N	37.7	Very low	39.5	Very low	73 Å²	73	93.7 Å²	93.7	39%	0.39	46%	0.463	S	S	.	.	H	α-helix	trans	-79.6	-36.9	179.7	-73.7	-18.6	0	0	0	111.7	L148 S149 K155 I156	L148-N152 HydrophobicContact CD2-CB 3.99Å; S149-N152 PolarHBondContact O-N 3.28Å; N152-K155 PolarHBondContact O-N 3.16Å; N152-I156 WeakPolarHBondContact O-CG1 3.32Å; N152-I156 PolarHBondContact O-N 3.44Å
153	L	39.5	Very low	39	Very low	54 Å²	54	95.6 Å²	95.6	28%	0.283	48%	0.477	S	S	.	.	H	α-helix	trans	-60.1	-51.9	171.9	-113.1	161.6	0	0	0	109.9	L148 S149 K155 I156 E157	L148-L153 HydrophobicContact CB-CB 4.11Å; L148-L153 HydrophobicContact CB-CD1 3.5Å; L148-L153 VanDerWaalsContact CB-CD1 3.5Å; L148-L153 HydrophobicContact CB-CG 3.56Å; L148-L153 HydrophobicContact CD1-CD1 3.73Å; L148-L153 HydrophobicContact CD1-CD2 3.98Å; L148-L153 HydrophobicContact CD1-CG 3.47Å; L148-L153 VanDerWaalsContact CD1-CG 3.47Å; L148-L153 HydrophobicContact CD2-CB 4.32Å; L148-L153 HydrophobicContact CD2-CG 3.9Å; L148-L153 HydrophobicContact CG-CD1 4.12Å; L148-L153 HydrophobicContact CG-CG 3.77Å; S149-L153 PolarHBondContact O-N 2.72Å; L153-K155 VanDerWaalsContact C-N 3.26Å; L153-K155 PolarHBondContact O-N 3.49Å; L153-I156 CarbonylContact O-C 3.34Å; L153-I156 PolarHBondContact O-N 3.41Å; L153-E157 WeakPolarHBondContact O-CB 3.43Å; L153-E157 WeakPolarHBondContact O-CG 3.42Å; L153-E157 PolarHBondContact O-N 3.47Å
154	R	45.6	Very low	38.6	Very low	161 Å²	161	101.7 Å²	101.7	61%	0.608	50%	0.498	S	S	*	.	H	α-helix	trans	-58.6	-38.1	177	-164.7	-177.3	177.4	156	8.6	112	S150 E158	S150-R154 VanDerWaalsContact O-CB 3.26Å; S150-R154 WeakPolarHBondContact O-CB 3.18Å; S150-R154 PolarHBondContact O-N 2.78Å; R154-E158 HydrophobicContact CG-CG 4.38Å; R154-E158 WeakPolarHBondContact CG-OE1 3.23Å; R154-E158 IonicContact NE-OE1 3.54Å; R154-E158 PolarHBondContact NE-OE1 2.84Å; R154-E158 VanDerWaalsContact NE-OE1 3.12Å; R154-E158 WeakPolarHBondContact O-CB 3.41Å; R154-E158 WeakPolarHBondContact O-CG 3.34Å; R154-E158 PolarHBondContact O-N 3.33Å
155	K	41.3	Very low	38.1	Very low	118 Å²	118	102.9 Å²	102.9	51%	0.513	50%	0.502	S	S	.	.	H	α-helix	trans	-67.8	-37.3	173.8	-84.3	177.4	178.3	177.2	0	113.6	S151 N152 L153 M159	S151-K155 WeakPolarHBondContact O-CB 3.47Å; S151-K155 WeakPolarHBondContact O-CG 3.42Å; S151-K155 PolarHBondContact O-N 3.21Å; N152-K155 PolarHBondContact O-N 3.16Å; L153-K155 VanDerWaalsContact C-N 3.26Å; L153-K155 PolarHBondContact O-N 3.49Å; K155-M159 WeakPolarHBondContact O-CB 3.28Å; K155-M159 WeakPolarHBondContact O-CG 3.28Å; K155-M159 PolarHBondContact O-N 3.22Å
156	I	41	Very low	37.8	Very low	35 Å²	35	102.5 Å²	102.5	18%	0.179	49%	0.493	C	S	.	.	H	α-helix	trans	-72.9	-37.4	176.4	-69.8	170.2	0	0	0	110.5	L143 L148 N152 L153 M159 G160	L143-I156 HydrophobicContact CD1-CD1 3.2Å; L148-I156 HydrophobicContact CD2-CD1 3.97Å; N152-I156 WeakPolarHBondContact O-CG1 3.32Å; N152-I156 PolarHBondContact O-N 3.44Å; L153-I156 CarbonylContact O-C 3.34Å; L153-I156 PolarHBondContact O-N 3.41Å; I156-M159 PolarHBondContact O-N 2.91Å; I156-G160 WeakPolarHBondContact O-CA 3Å; I156-G160 PolarHBondContact O-N 3.16Å
157	E	41.6	Very low	37.6	Very low	111 Å²	111	95.7 Å²	95.7	52%	0.519	46%	0.461	S	S	.	.	H	α-helix	trans	-65.8	-45.1	170.8	-72.9	178.6	161.4	0	0	111.3	L153 G160 Q161	L153-E157 WeakPolarHBondContact O-CB 3.43Å; L153-E157 WeakPolarHBondContact O-CG 3.42Å; L153-E157 PolarHBondContact O-N 3.47Å; E157-G160 PolarHBondContact O-N 2.94Å; E157-Q161 VanDerWaalsContact O-CB 3.26Å; E157-Q161 WeakPolarHBondContact O-CB 3.42Å; E157-Q161 VanDerWaalsContact O-CG 3.24Å; E157-Q161 WeakPolarHBondContact O-CG 3.31Å; E157-Q161 PolarHBondContact O-N 2.91Å
158	E	39.4	Very low	37.1	Very low	94 Å²	94	88.1 Å²	88.1	44%	0.439	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-40.3	174.7	-77.7	167.9	-174.7	0	0	110.9	R154 Y162	R154-E158 HydrophobicContact CG-CG 4.38Å; R154-E158 WeakPolarHBondContact CG-OE1 3.23Å; R154-E158 IonicContact NE-OE1 3.54Å; R154-E158 PolarHBondContact NE-OE1 2.84Å; R154-E158 VanDerWaalsContact NE-OE1 3.12Å; R154-E158 WeakPolarHBondContact O-CB 3.41Å; R154-E158 WeakPolarHBondContact O-CG 3.34Å; R154-E158 PolarHBondContact O-N 3.33Å; E158-Y162 VanDerWaalsContact O-CB 3.26Å; E158-Y162 WeakPolarHBondContact O-CB 3.4Å; E158-Y162 PolarHBondContact O-N 3.1Å
159	M	37.1	Very low	36.5	Very low	71 Å²	71	93 Å²	93	35%	0.35	47%	0.465	S	S	.	.	H	α-helix	trans	-70.7	-37.6	173.8	-78.9	178	60.9	0	0	112.4	C132 K155 I156 Y162 V163	C132-M159 HydrophobicContact CB-CE 4.29Å; K155-M159 WeakPolarHBondContact O-CB 3.28Å; K155-M159 WeakPolarHBondContact O-CG 3.28Å; K155-M159 PolarHBondContact O-N 3.22Å; I156-M159 PolarHBondContact O-N 2.91Å; M159-Y162 CarbonylContact O-C 3.58Å; M159-Y162 WeakPolarHBondContact O-CB 3.25Å; M159-Y162 PolarHBondContact O-N 2.95Å; M159-V163 WeakPolarHBondContact O-CG2 3.3Å; M159-V163 PolarHBondContact O-N 3Å
160	G	35.8	Very low	35.9	Very low	32 Å²	32	94 Å²	94	33%	0.33	47%	0.472	S	S	.	.	H	α-helix	trans	-66.3	-41.9	175.1	0	0	0	0	0	111.3	I156 E157 Y162 V163 Y164	I156-G160 WeakPolarHBondContact O-CA 3Å; I156-G160 PolarHBondContact O-N 3.16Å; E157-G160 PolarHBondContact O-N 2.94Å; G160-Y162 VanDerWaalsContact C-N 3.33Å; G160-V163 PolarHBondContact O-N 3.4Å; G160-Y164 VanDerWaalsContact O-CB 3.23Å; G160-Y164 WeakPolarHBondContact O-CB 3.5Å; G160-Y164 PolarHBondContact O-N 3.23Å
161	Q	35.9	Very low	35.1	Very low	129 Å²	129	93.5 Å²	93.5	60%	0.603	47%	0.465	S	S	*	.	H	α-helix	trans	-64.3	-36.6	169	-75.4	178.2	5.8	0	0	111.4	E157 Y164 M165	E157-Q161 VanDerWaalsContact O-CB 3.26Å; E157-Q161 WeakPolarHBondContact O-CB 3.42Å; E157-Q161 VanDerWaalsContact O-CG 3.24Å; E157-Q161 WeakPolarHBondContact O-CG 3.31Å; E157-Q161 PolarHBondContact O-N 2.91Å; Q161-Y164 PolarHBondContact O-N 2.81Å; Q161-M165 WeakPolarHBondContact O-CA 3.22Å; Q161-M165 WeakPolarHBondContact O-CB 3.47Å; Q161-M165 WeakPolarHBondContact O-CG 3.4Å; Q161-M165 PolarHBondContact O-N 2.7Å
162	Y	29.9	Very low	34.1	Very low	156 Å²	156	97.3 Å²	97.3	61%	0.612	48%	0.476	S	S	*	.	H	α-helix	trans	-68	-42.3	175.4	-171.5	-97.4	0	0	0	111.7	E158 M159 G160 M165 K166	E158-Y162 VanDerWaalsContact O-CB 3.26Å; E158-Y162 WeakPolarHBondContact O-CB 3.4Å; E158-Y162 PolarHBondContact O-N 3.1Å; M159-Y162 CarbonylContact O-C 3.58Å; M159-Y162 WeakPolarHBondContact O-CB 3.25Å; M159-Y162 PolarHBondContact O-N 2.95Å; G160-Y162 VanDerWaalsContact C-N 3.33Å; Y162-M165 PolarHBondContact O-N 3.38Å; Y162-K166 VanDerWaalsContact O-CB 3.32Å; Y162-K166 WeakPolarHBondContact O-CB 3.36Å; Y162-K166 PolarHBondContact O-N 2.75Å
163	V	33.4	Very low	33.6	Very low	65 Å²	65	98.6 Å²	98.6	39%	0.394	49%	0.488	S	S	.	.	H	α-helix	trans	-66.2	-41.5	174	172.6	0	0	0	0	110.5	M159 G160 K166 H167	M159-V163 WeakPolarHBondContact O-CG2 3.3Å; M159-V163 PolarHBondContact O-N 3Å; G160-V163 PolarHBondContact O-N 3.4Å; V163-K166 PolarHBondContact O-N 2.89Å; V163-H167 WeakPolarHBondContact O-CB 3.27Å; V163-H167 PolarHBondContact O-N 3.43Å
164	Y	32.9	Very low	33	Very low	179 Å²	179	106 Å²	106	70%	0.702	52%	0.518	S	S	*	.	H	α-helix	trans	-65.9	-41.3	174.7	-173.8	-96.5	0	0	0	112	G160 Q161 H167 A168	G160-Y164 VanDerWaalsContact O-CB 3.23Å; G160-Y164 WeakPolarHBondContact O-CB 3.5Å; G160-Y164 PolarHBondContact O-N 3.23Å; Q161-Y164 PolarHBondContact O-N 2.81Å; Y164-H167 CarbonylContact O-C 3.57Å; Y164-H167 WeakPolarHBondContact O-CB 3.26Å; Y164-H167 PolarHBondContact O-N 3.39Å; Y164-A168 VanDerWaalsContact O-CB 3.28Å; Y164-A168 WeakPolarHBondContact O-CB 3.33Å; Y164-A168 PolarHBondContact O-N 3.37Å
165	M	29.1	Very low	32.1	Very low	111 Å²	111	104.2 Å²	104.2	55%	0.547	53%	0.525	S	S	.	.	H	α-helix	trans	-64.4	-39.9	172.2	-89.4	-175.2	61	0	0	110.9	Q161 Y162 H167 A168 L169	Q161-M165 WeakPolarHBondContact O-CA 3.22Å; Q161-M165 WeakPolarHBondContact O-CB 3.47Å; Q161-M165 WeakPolarHBondContact O-CG 3.4Å; Q161-M165 PolarHBondContact O-N 2.7Å; Y162-M165 PolarHBondContact O-N 3.38Å; M165-H167 VanDerWaalsContact C-N 3.3Å; M165-H167 PolarHBondContact O-N 3.44Å; M165-A168 PolarHBondContact O-N 2.88Å; M165-L169 HydrophobicContact CE-CD1 4.48Å; M165-L169 VanDerWaalsContact O-CB 3.22Å; M165-L169 WeakPolarHBondContact O-CB 3.42Å; M165-L169 WeakPolarHBondContact O-CD1 3.39Å; M165-L169 WeakPolarHBondContact O-CG 3.27Å; M165-L169 PolarHBondContact O-N 2.66Å
166	K	30.7	Very low	31.2	Very low	136 Å²	136	102.6 Å²	102.6	59%	0.591	53%	0.534	S	S	*	.	H	α-helix	trans	-66.1	-37.2	175.4	-137.9	-170.1	-176.9	-164.2	0	111	Y162 V163 S170	Y162-K166 VanDerWaalsContact O-CB 3.32Å; Y162-K166 WeakPolarHBondContact O-CB 3.36Å; Y162-K166 PolarHBondContact O-N 2.75Å; V163-K166 PolarHBondContact O-N 2.89Å; K166-S170 WeakPolarHBondContact O-CB 3.24Å; K166-S170 PolarHBondContact O-N 2.81Å; K166-S170 PolarHBondContact O-OG 2.82Å
167	H	32.7	Very low	30.3	Very low	48 Å²	48	109.1 Å²	109.1	22%	0.222	56%	0.563	C	S	.	*	H	α-helix	trans	-64.6	-49.8	171.3	-114	-70.7	0	0	0	110.9	V163 Y164 M165 L169 S170 T171	V163-H167 WeakPolarHBondContact O-CB 3.27Å; V163-H167 PolarHBondContact O-N 3.43Å; Y164-H167 CarbonylContact O-C 3.57Å; Y164-H167 WeakPolarHBondContact O-CB 3.26Å; Y164-H167 PolarHBondContact O-N 3.39Å; M165-H167 VanDerWaalsContact C-N 3.3Å; M165-H167 PolarHBondContact O-N 3.44Å; H167-L169 PolarHBondContact O-N 2.92Å; H167-S170 WeakPolarHBondContact CA-OG 3.23Å; H167-S170 CarbonylContact O-C 3.55Å; H167-S170 WeakPolarHBondContact O-CA 3.4Å; H167-S170 WeakPolarHBondContact O-CB 3.26Å; H167-S170 PolarHBondContact O-N 3.25Å; H167-S170 PolarHBondContact O-OG 3.47Å; H167-T171 PolarHBondContact O-N 2.88Å; H167-T171 PolarHBondContact O-OG1 3.5Å
168	A	26.4	Very low	29.6	Very low	31 Å²	31	110.7 Å²	110.7	26%	0.256	58%	0.58	S	S	.	*	H	α-helix	trans	-60.8	-41.6	178.5	0	0	0	0	0	111.5	Y164 M165 S170 T171 E172	Y164-A168 VanDerWaalsContact O-CB 3.28Å; Y164-A168 WeakPolarHBondContact O-CB 3.33Å; Y164-A168 PolarHBondContact O-N 3.37Å; M165-A168 PolarHBondContact O-N 2.88Å; A168-S170 VanDerWaalsContact C-N 3.26Å; A168-S170 PolarHBondContact O-N 3.46Å; A168-T171 CarbonylContact O-C 3.58Å; A168-T171 PolarHBondContact O-N 3.45Å; A168-E172 VanDerWaalsContact O-CB 3.31Å; A168-E172 WeakPolarHBondContact O-CB 3.47Å; A168-E172 WeakPolarHBondContact O-CG 3.26Å; A168-E172 PolarHBondContact O-N 2.91Å
169	L	25.7	Very low	28.9	Very low	120 Å²	120	113.9 Å²	113.9	63%	0.628	60%	0.595	S	S	*	*	H	α-helix	trans	-69.5	-21.4	172.8	-69.5	167	0	0	0	112.8	M165 H167	M165-L169 HydrophobicContact CE-CD1 4.48Å; M165-L169 VanDerWaalsContact O-CB 3.22Å; M165-L169 WeakPolarHBondContact O-CB 3.42Å; M165-L169 WeakPolarHBondContact O-CD1 3.39Å; M165-L169 WeakPolarHBondContact O-CG 3.27Å; M165-L169 PolarHBondContact O-N 2.66Å; H167-L169 PolarHBondContact O-N 2.92Å
170	S	30.2	Very low	28.3	Very low	83 Å²	83	119.8 Å²	119.8	58%	0.58	62%	0.615	S	S	*	*	H	α-helix	trans	-88.9	-18.9	171.6	79.7	0	0	0	0	113.8	K166 H167 A168	K166-S170 WeakPolarHBondContact O-CB 3.24Å; K166-S170 PolarHBondContact O-N 2.81Å; K166-S170 PolarHBondContact O-OG 2.82Å; H167-S170 WeakPolarHBondContact CA-OG 3.23Å; H167-S170 CarbonylContact O-C 3.55Å; H167-S170 WeakPolarHBondContact O-CA 3.4Å; H167-S170 WeakPolarHBondContact O-CB 3.26Å; H167-S170 PolarHBondContact O-N 3.25Å; H167-S170 PolarHBondContact O-OG 3.47Å; A168-S170 VanDerWaalsContact C-N 3.26Å; A168-S170 PolarHBondContact O-N 3.46Å
171	T	26.6	Very low	27.8	Very low	94 Å²	94	125.2 Å²	125.2	58%	0.577	63%	0.632	S	S	*	*	H	α-helix	trans	-113.5	-14	-177.1	52.1	0	0	0	0	114.2	H167 A168 P173	H167-T171 PolarHBondContact O-N 2.88Å; H167-T171 PolarHBondContact O-OG1 3.5Å; A168-T171 CarbonylContact O-C 3.58Å; A168-T171 PolarHBondContact O-N 3.45Å; T171-P173 WeakPolarHBondContact O-CD 3.34Å
172	E	22.9	Very low	27.5	Very low	142 Å²	142	124 Å²	124	66%	0.664	64%	0.637	S	S	*	*	S	Bend	trans	-70.9	114.8	162.6	-81.1	-168.2	165	0	0	106.4	A168 F174	A168-E172 VanDerWaalsContact O-CB 3.31Å; A168-E172 WeakPolarHBondContact O-CB 3.47Å; A168-E172 WeakPolarHBondContact O-CG 3.26Å; A168-E172 PolarHBondContact O-N 2.91Å; E172-F174 PolarHBondContact O-N 3.25Å
173	P	28.7	Very low	27.4	Very low	101 Å²	101	124.7 Å²	124.7	66%	0.656	65%	0.646	S	S	*	*			trans	-63.3	138.2	-173	27.9	-32.8	0	0	0	108.1	T171 V175	T171-P173 WeakPolarHBondContact O-CD 3.34Å; P173-V175 HydrophobicContact CB-CG2 4.22Å; P173-V175 HydrophobicContact CG-CG2 4.4Å; P173-V175 PolarHBondContact O-N 3.3Å
174	F	25.3	Very low	26.9	Very low	208 Å²	208	130 Å²	130	91%	0.912	67%	0.666	S	S	*	*	S	Bend	trans	-52.2	65.9	168	-113	-95.2	0	0	0	112.1	E172	E172-F174 PolarHBondContact O-N 3.25Å
175	V	26.6	Very low	26.7	Very low	125 Å²	125	125.5 Å²	125.5	76%	0.758	67%	0.667	S	S	*	*			trans	-120.9	-4.2	172.4	-173	0	0	0	0	110.4	P173 E177	P173-V175 HydrophobicContact CB-CG2 4.22Å; P173-V175 HydrophobicContact CG-CG2 4.4Å; P173-V175 PolarHBondContact O-N 3.3Å; V175-E177 PolarHBondContact O-N 3.36Å
176	A	22.7	Very low	26.5	Very low	83 Å²	83	125.9 Å²	125.9	69%	0.686	68%	0.675	S	S	*	*	S	Bend	trans	-90.8	96.1	170.6	0	0	0	0	0	110.9
177	E	23.2	Very low	26.3	Very low	172 Å²	172	127 Å²	127	80%	0.804	68%	0.682	S	S	*	*			trans	61	78.4	141.1	-63.8	173.3	163.2	0	0	117.7	V175 E179	V175-E177 PolarHBondContact O-N 3.36Å; E177-E179 VanDerWaalsContact C-N 3.32Å
178	V	26	Very low	25.9	Very low	144 Å²	144	132.2 Å²	132.2	87%	0.873	71%	0.712	S	S	*	*			trans	-104.3	56.9	137.7	-170.3	0	0	0	0	107.4
179	E	25.3	Very low	25.9	Very low	161 Å²	161	133.9 Å²	133.9	75%	0.752	73%	0.732	S	S	*	*			trans	-110.5	137	158.3	-77.8	-171	160.9	0	0	106.9	E177	E177-E179 VanDerWaalsContact C-N 3.32Å
180	Y	25.2	Very low	25.9	Very low	196 Å²	196	136.8 Å²	136.8	77%	0.769	74%	0.742	S	S	*	*			trans	86.6	85.3	-176.3	-73.4	-91.8	0	0	0	116.3
181	Q	25.1	Very low	25.7	Very low	146 Å²	146	139.3 Å²	139.3	68%	0.682	76%	0.755	S	S	*	*				66.5	102.4	87.2	-68.7	179.6	1	0	0	111.7
182	S	29.9	Very low	25.7	Very low	102 Å²	102	139.5 Å²	139.5	71%	0.713	77%	0.765	S	S	*	*				45.2	99.8	83.4	73	0	0	0	0	113.2
183	E	25.9	Very low	25.8	Very low	171 Å²	171	137.9 Å²	137.9	80%	0.799	77%	0.77	S	S	*	*			trans	-172.9	125.9	144.5	-106.1	164.1	-171	0	0	110.7
184	E	24.7	Very low	25.6	Very low	176 Å²	176	141.4 Å²	141.4	82%	0.822	78%	0.777	S	S	*	*			trans	63.7	99.6	151.2	-56.9	-177.2	159.9	0	0	117.9
185	A	27	Very low	25.6	Very low	86 Å²	86	136.9 Å²	136.9	71%	0.711	77%	0.772	S	S	*	*				58.4	128.9	59.8	0	0	0	0	0	115.1
186	V	26.4	Very low	25.8	Very low	119 Å²	119	136.8 Å²	136.8	72%	0.721	77%	0.774	S	S	*	*			trans	86.4	138.5	149.8	-168.5	0	0	0	0	114.1
187	E	25.5	Very low	26.3	Very low	159 Å²	159	138.5 Å²	138.5	74%	0.743	78%	0.778	S	S	*	*			cis	-163.7	145.2	20.2	-134	146.2	-143.1	0	0	109.9
188	D	25.9	Very low	26.3	Very low	157 Å²	157	134.2 Å²	134.2	84%	0.84	77%	0.772	S	S	*	*				53.6	147.5	129.2	-66	-6.3	0	0	0	125.7
189	G	25.8	Very low	26.2	Very low	66 Å²	66	133.1 Å²	133.1	68%	0.68	77%	0.765	S	S	*	*			trans	140.8	79.6	158.6	0	0	0	0	0	113.6
190	E	24.6	Very low	26	Very low	182 Å²	182	133.8 Å²	133.8	85%	0.85	77%	0.766	S	S	*	*				64.5	123.3	105.9	-68.4	-169.6	152	0	0	117
191	T	26.3	Very low	25.9	Very low	136 Å²	136	134.1 Å²	134.1	83%	0.834	77%	0.767	S	S	*	*				164.3	129	104.2	39.7	0	0	0	0	115
192	A	26.1	Very low	26.2	Very low	97 Å²	97	134.9 Å²	134.9	80%	0.802	77%	0.771	S	S	*	*			trans	-4.7	142.2	156.9	0	0	0	0	0	123.4
193	S	25.7	Very low	26.1	Very low	108 Å²	108	136.8 Å²	136.8	76%	0.755	78%	0.778	S	S	*	*				172.6	132.4	98.9	73.5	0	0	0	0	116.2
194	E	24.3	Very low	26.2	Very low	175 Å²	175	135.2 Å²	135.2	82%	0.818	77%	0.774	S	S	*	*			trans	64.7	102	137.4	-62.5	-174.9	175.2	0	0	125.4
195	S	24.8	Very low	26.3	Very low	114 Å²	114	130 Å²	130	80%	0.797	77%	0.767	S	S	*	*			trans	58.8	154.6	140	57.4	0	0	0	0	122
196	P	32.5	Very low	26.4	Very low	122 Å²	122	131.4 Å²	131.4	79%	0.792	76%	0.763	S	S	*	*			cis	-132.5	-152.5	8.5	38.3	-14.8	0	0	0	114
197	P	33.1	Very low	26.8	Very low	120 Å²	120	130.3 Å²	130.3	78%	0.779	76%	0.756	S	S	*	*				-98.1	166.4	-86.2	39.4	-25.7	0	0	0	115.8
198	A	22.2	Very low	27.1	Very low	81 Å²	81	128.6 Å²	128.6	67%	0.669	75%	0.752	S	S	*	*			trans	-60.5	128.3	-171.4	0	0	0	0	0	116.7	F200	A198-F200 HydrophobicContact CB-CD2 4.49Å; A198-F200 HydrophobicContact CB-CE2 4.19Å
199	V	23.7	Very low	27.6	Very low	121 Å²	121	125.4 Å²	125.4	73%	0.733	74%	0.735	S	S	*	*			trans	-110.1	113.8	155.4	-178.2	0	0	0	0	106.5	Y201	V199-Y201 HydrophobicContact CG1-CD2 4.3Å; V199-Y201 HydrophobicContact CG1-CE2 4.09Å; V199-Y201 PolarHBondContact O-N 2.66Å; V199-Y201 VanDerWaalsContact O-N 3.12Å
200	F	21	Very low	27.7	Very low	176 Å²	176	126.2 Å²	126.2	77%	0.772	72%	0.724	S	S	*	*			trans	-71.4	100.4	-174.4	-74.1	-97.2	0	0	0	111.3	A198	A198-F200 HydrophobicContact CB-CD2 4.49Å; A198-F200 HydrophobicContact CB-CE2 4.19Å
201	Y	24.4	Very low	27.9	Very low	202 Å²	202	123.4 Å²	123.4	79%	0.792	71%	0.712	S	S	*	*			trans	-106.9	78.8	156.2	-77.5	-86.4	0	0	0	108	V199	V199-Y201 HydrophobicContact CG1-CD2 4.3Å; V199-Y201 HydrophobicContact CG1-CE2 4.09Å; V199-Y201 PolarHBondContact O-N 2.66Å; V199-Y201 VanDerWaalsContact O-N 3.12Å
202	E	30.2	Very low	28.5	Very low	163 Å²	163	126.1 Å²	126.1	76%	0.762	71%	0.707	S	S	*	*			trans	-82.6	138.5	165.2	-93.7	177	148.3	0	0	108.7
203	V	29.3	Very low	29.1	Very low	142 Å²	142	126.2 Å²	126.2	86%	0.861	70%	0.695	S	S	*	*			trans	89.9	46.7	175.5	-153.9	0	0	0	0	117.1
204	L	26.7	Very low	29.5	Very low	138 Å²	138	123.4 Å²	123.4	72%	0.723	68%	0.678	S	S	*	*			trans	-130.5	94.7	152.9	-75.7	169.4	0	0	0	108.5
205	G	26.5	Very low	30.2	Very low	65 Å²	65	121.2 Å²	121.2	67%	0.67	67%	0.667	S	S	*	*			trans	-68.8	142.6	-175.2	0	0	0	0	0	112.6
206	N	30.4	Very low	31.1	Very low	116 Å²	116	119.2 Å²	119.2	62%	0.62	65%	0.654	S	S	*	*			trans	68	60.7	173.7	-68.6	-15	0	0	0	116.4	D208 N209 D210	N206-D208 PolarHBondContact O-N 2.93Å; N206-D208 VanDerWaalsContact O-N 3.16Å; N206-N209 HydrophobicContact CB-CB 4.21Å; N206-N209 PolarHBondContact O-N 2.92Å; N206-N209 VanDerWaalsContact O-N 3.12Å; N206-D210 PolarHBondContact O-N 3.24Å
207	T	32.9	Very low	31.4	Very low	96 Å²	96	119.1 Å²	119.1	59%	0.589	64%	0.641	S	S	*	*	H	α-helix	trans	-52.1	-30.3	169	44.5	0	0	0	0	114.5	D210 M211	T207-D210 PolarHBondContact O-N 3.11Å; T207-M211 WeakPolarHBondContact O-CB 3.48Å; T207-M211 WeakPolarHBondContact O-CG 3.45Å; T207-M211 PolarHBondContact O-N 3.29Å
208	D	33.8	Very low	31.5	Very low	124 Å²	124	118.7 Å²	118.7	66%	0.663	63%	0.632	S	S	*	*	H	α-helix	trans	-74.4	-35.8	178.7	-70.5	-17.9	0	0	0	112.6	N206 R212	N206-D208 PolarHBondContact O-N 2.93Å; N206-D208 VanDerWaalsContact O-N 3.16Å; D208-R212 PolarHBondContact O-N 3.38Å
209	N	35.7	Very low	32.5	Very low	89 Å²	89	120 Å²	120	48%	0.476	62%	0.624	S	S	.	*	H	α-helix	trans	-72	-37.9	170.8	-85.7	-10.4	0	0	0	110.6	N206 R212 N213	N206-N209 HydrophobicContact CB-CB 4.21Å; N206-N209 PolarHBondContact O-N 2.92Å; N206-N209 VanDerWaalsContact O-N 3.12Å; N209-R212 PolarHBondContact O-N 2.77Å; N209-N213 WeakPolarHBondContact O-CB 3.21Å; N209-N213 PolarHBondContact O-N 3.37Å; N209-N213 PolarHBondContact O-ND2 3.27Å; N209-N213 VanDerWaalsContact O-ND2 3.16Å
210	D	27.3	Very low	33.3	Very low	84 Å²	84	120.4 Å²	120.4	45%	0.449	62%	0.618	S	S	.	*	H	α-helix	trans	-68.2	-34.4	176.4	-74.9	-18.7	0	0	0	112.4	N206 T207 A214	N206-D210 PolarHBondContact O-N 3.24Å; T207-D210 PolarHBondContact O-N 3.11Å; D210-A214 WeakPolarHBondContact O-CB 3.27Å; D210-A214 PolarHBondContact O-N 3.38Å
211	M	29.3	Very low	33.9	Very low	122 Å²	122	115.2 Å²	115.2	60%	0.601	60%	0.598	S	S	*	*	H	α-helix	trans	-68.6	-46.1	172.1	-75.1	-121.2	-51.5	0	0	111.9	T207 N213 A214 Q215	T207-M211 WeakPolarHBondContact O-CB 3.48Å; T207-M211 WeakPolarHBondContact O-CG 3.45Å; T207-M211 PolarHBondContact O-N 3.29Å; M211-N213 VanDerWaalsContact C-N 3.33Å; M211-N213 PolarHBondContact O-N 3.12Å; M211-A214 PolarHBondContact O-N 3.26Å; M211-Q215 WeakPolarHBondContact O-CB 3.48Å; M211-Q215 PolarHBondContact O-N 3.32Å
212	R	39.6	Very low	34.6	Very low	193 Å²	193	111.4 Å²	111.4	73%	0.728	59%	0.585	S	S	*	*	H	α-helix	trans	-62.9	-39.6	174.3	-88.8	-176.4	178.9	171.9	1.3	112.1	D208 N209 Q215 S216	D208-R212 PolarHBondContact O-N 3.38Å; N209-R212 PolarHBondContact O-N 2.77Å; R212-Q215 PolarHBondContact O-N 3.26Å; R212-S216 VanDerWaalsContact O-CB 3.26Å; R212-S216 WeakPolarHBondContact O-CB 3.4Å; R212-S216 PolarHBondContact O-N 2.89Å
213	N	38.7	Very low	35.3	Very low	100 Å²	100	107.4 Å²	107.4	54%	0.535	57%	0.567	S	S	.	*	H	α-helix	trans	-66.9	-39.5	174.5	-71.5	-19.8	0	0	0	111.2	N209 M211 Q215 F217	N209-N213 WeakPolarHBondContact O-CB 3.21Å; N209-N213 PolarHBondContact O-N 3.37Å; N209-N213 PolarHBondContact O-ND2 3.27Å; N209-N213 VanDerWaalsContact O-ND2 3.16Å; M211-N213 VanDerWaalsContact C-N 3.33Å; M211-N213 PolarHBondContact O-N 3.12Å; N213-Q215 VanDerWaalsContact C-N 3.33Å; N213-F217 WeakPolarHBondContact O-CB 3.24Å; N213-F217 PolarHBondContact O-N 3.17Å
214	A	32.1	Very low	35.5	Very low	49 Å²	49	104.7 Å²	104.7	41%	0.405	55%	0.545	S	S	.	.	H	α-helix	trans	-66	-36.4	174.9	0	0	0	0	0	111.9	D210 M211 L218	D210-A214 WeakPolarHBondContact O-CB 3.27Å; D210-A214 PolarHBondContact O-N 3.38Å; M211-A214 PolarHBondContact O-N 3.26Å; A214-L218 WeakPolarHBondContact O-CB 3.48Å; A214-L218 VanDerWaalsContact O-CG 3.24Å; A214-L218 WeakPolarHBondContact O-CG 3.42Å; A214-L218 PolarHBondContact O-N 3.25Å
215	Q	39	Very low	35.9	Very low	128 Å²	128	101.7 Å²	101.7	60%	0.598	53%	0.532	S	S	*	.	H	α-helix	trans	-76.4	-38.5	178.9	-150.2	150.8	6	0	0	111.8	M211 R212 N213 L218 E219	M211-Q215 WeakPolarHBondContact O-CB 3.48Å; M211-Q215 PolarHBondContact O-N 3.32Å; R212-Q215 PolarHBondContact O-N 3.26Å; N213-Q215 VanDerWaalsContact C-N 3.33Å; Q215-L218 PolarHBondContact O-N 3.45Å; Q215-E219 PolarHBondContact O-N 2.9Å
216	S	44.4	Very low	36.3	Very low	73 Å²	73	103.6 Å²	103.6	51%	0.51	52%	0.519	S	S	.	.	H	α-helix	trans	-60.9	-44.5	167.8	-174.5	0	0	0	0	111.2	R212 E219 E220	R212-S216 VanDerWaalsContact O-CB 3.26Å; R212-S216 WeakPolarHBondContact O-CB 3.4Å; R212-S216 PolarHBondContact O-N 2.89Å; S216-E219 PolarHBondContact O-N 3.25Å; S216-E220 VanDerWaalsContact O-CB 3.27Å; S216-E220 WeakPolarHBondContact O-CB 3.32Å; S216-E220 PolarHBondContact O-N 3.36Å
217	F	39.1	Very low	36.6	Very low	119 Å²	119	102.3 Å²	102.3	52%	0.522	51%	0.512	S	S	.	.	H	α-helix	trans	-64.2	-39.2	175.5	177.4	-105	0	0	0	111.4	N213 E220 L221	N213-F217 WeakPolarHBondContact O-CB 3.24Å; N213-F217 PolarHBondContact O-N 3.17Å; F217-E220 PolarHBondContact O-N 3.02Å; F217-L221 HydrophobicContact CD1-CD1 4.3Å; F217-L221 HydrophobicContact CE1-CD1 3.5Å; F217-L221 HydrophobicContact CE2-CD1 4.15Å; F217-L221 HydrophobicContact CZ-CD1 3.42Å; F217-L221 VanDerWaalsContact CZ-CD1 3.42Å; F217-L221 WeakPolarHBondContact O-CB 3.26Å; F217-L221 PolarHBondContact O-N 2.79Å
218	L	35.8	Very low	36.4	Very low	112 Å²	112	104.6 Å²	104.6	59%	0.586	51%	0.509	S	S	*	.	H	α-helix	trans	-66.9	-40.8	175.6	-79.5	169.3	0	0	0	112.5	A214 Q215 L221 K222	A214-L218 WeakPolarHBondContact O-CB 3.48Å; A214-L218 VanDerWaalsContact O-CG 3.24Å; A214-L218 WeakPolarHBondContact O-CG 3.42Å; A214-L218 PolarHBondContact O-N 3.25Å; Q215-L218 PolarHBondContact O-N 3.45Å; L218-L221 PolarHBondContact O-N 3.12Å; L218-K222 WeakPolarHBondContact O-CB 3.24Å; L218-K222 PolarHBondContact O-N 3.19Å
219	E	43.4	Very low	36.2	Very low	107 Å²	107	103.8 Å²	103.8	50%	0.5	50%	0.502	S	S	.	.	H	α-helix	trans	-69.5	-37.9	174.1	-74.5	-62.2	145.6	0	0	111.5	Q215 S216 K222 E223	Q215-E219 PolarHBondContact O-N 2.9Å; S216-E219 PolarHBondContact O-N 3.25Å; E219-K222 PolarHBondContact O-N 3.33Å; E219-K222 IonicContact OE1-NZ 2.87Å; E219-K222 PolarHBondContact OE1-NZ 2.98Å; E219-K222 IonicContact OE2-NZ 3.62Å; E219-K222 PolarHBondContact OE2-NZ 2.67Å; E219-K222 VanDerWaalsContact OE2-NZ 3.11Å; E219-E223 VanDerWaalsContact O-CB 3.27Å; E219-E223 WeakPolarHBondContact O-CB 3.23Å; E219-E223 PolarHBondContact O-N 3.47Å
220	E	39.7	Very low	36.1	Very low	131 Å²	131	104.1 Å²	104.1	61%	0.612	50%	0.5	S	S	*	.	H	α-helix	trans	-63.8	-40.4	172.5	-169.2	175.6	-164.3	0	0	111.3	S216 F217 E223 E224	S216-E220 VanDerWaalsContact O-CB 3.27Å; S216-E220 WeakPolarHBondContact O-CB 3.32Å; S216-E220 PolarHBondContact O-N 3.36Å; F217-E220 PolarHBondContact O-N 3.02Å; E220-E223 PolarHBondContact O-N 3.43Å; E220-E224 WeakPolarHBondContact O-CB 3.44Å; E220-E224 PolarHBondContact O-N 2.86Å
221	L	33.8	Very low	36.1	Very low	67 Å²	67	106.2 Å²	106.2	35%	0.351	51%	0.505	S	S	.	.	H	α-helix	trans	-73.8	-31.6	177.7	-155	148.1	0	0	0	111.4	F217 L218 T225	F217-L221 HydrophobicContact CD1-CD1 4.3Å; F217-L221 HydrophobicContact CE1-CD1 3.5Å; F217-L221 HydrophobicContact CE2-CD1 4.15Å; F217-L221 HydrophobicContact CZ-CD1 3.42Å; F217-L221 VanDerWaalsContact CZ-CD1 3.42Å; F217-L221 WeakPolarHBondContact O-CB 3.26Å; F217-L221 PolarHBondContact O-N 2.79Å; L218-L221 PolarHBondContact O-N 3.12Å; L221-T225 WeakPolarHBondContact O-CA 3.29Å; L221-T225 WeakPolarHBondContact O-CB 3.4Å; L221-T225 PolarHBondContact O-N 3.44Å; L221-T225 PolarHBondContact O-OG1 3.33Å
222	K	38.6	Very low	35.9	Very low	121 Å²	121	105.6 Å²	105.6	53%	0.526	50%	0.504	S	S	.	.	H	α-helix	trans	-71.7	-39.3	172.7	-179.5	-178.1	164.6	-153	0	111.5	L218 E219 T225 R226	L218-K222 WeakPolarHBondContact O-CB 3.24Å; L218-K222 PolarHBondContact O-N 3.19Å; E219-K222 PolarHBondContact O-N 3.33Å; E219-K222 IonicContact OE1-NZ 2.87Å; E219-K222 PolarHBondContact OE1-NZ 2.98Å; E219-K222 IonicContact OE2-NZ 3.62Å; E219-K222 PolarHBondContact OE2-NZ 2.67Å; E219-K222 VanDerWaalsContact OE2-NZ 3.11Å; K222-T225 CarbonylContact O-C 3.54Å; K222-T225 PolarHBondContact O-N 2.81Å; K222-R226 VanDerWaalsContact O-CB 3.29Å; K222-R226 WeakPolarHBondContact O-CB 3.45Å; K222-R226 PolarHBondContact O-N 3.33Å
223	E	44.7	Very low	35.4	Very low	80 Å²	80	102.9 Å²	102.9	37%	0.374	49%	0.494	S	S	.	.	H	α-helix	trans	-70.5	-42.1	173.1	-178.2	57.9	-162.8	0	0	110.9	E219 E220 T225 R226 L227	E219-E223 VanDerWaalsContact O-CB 3.27Å; E219-E223 WeakPolarHBondContact O-CB 3.23Å; E219-E223 PolarHBondContact O-N 3.47Å; E220-E223 PolarHBondContact O-N 3.43Å; E223-T225 VanDerWaalsContact C-N 3.31Å; E223-T225 PolarHBondContact O-N 2.81Å; E223-R226 CarbonylContact O-C 3.41Å; E223-R226 WeakPolarHBondContact O-CB 3.2Å; E223-R226 PolarHBondContact O-N 2.85Å; E223-R226 IonicContact OE1-CZ 2.72Å; E223-R226 IonicContact OE1-NE 2.85Å; E223-R226 PolarHBondContact OE1-NE 2.79Å; E223-R226 IonicContact OE1-NH2 2.66Å; E223-R226 PolarHBondContact OE1-NH2 2.74Å; E223-R226 IonicContact OE2-CZ 3.76Å; E223-R226 IonicContact OE2-NE 3.33Å; E223-R226 PolarHBondContact OE2-NE 3.38Å; E223-R226 IonicContact OE2-NH2 3.82Å; E223-L227 HydrophobicContact CG-CD1 4.22Å; E223-L227 WeakPolarHBondContact O-CB 3.44Å; E223-L227 VanDerWaalsContact O-CG 3.26Å; E223-L227 WeakPolarHBondContact O-CG 3.47Å; E223-L227 PolarHBondContact O-N 3.22Å
224	E	34.6	Very low	35.3	Very low	85 Å²	85	101 Å²	101	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-62.5	-40.7	171.5	-169.5	-169.8	178.6	0	0	110.4	E220 L227 R228	E220-E224 WeakPolarHBondContact O-CB 3.44Å; E220-E224 PolarHBondContact O-N 2.86Å; E224-L227 PolarHBondContact O-N 3.46Å; E224-R228 HydrophobicContact CG-CG 4.34Å; E224-R228 WeakPolarHBondContact O-CA 2.98Å; E224-R228 WeakPolarHBondContact O-CB 3.21Å; E224-R228 WeakPolarHBondContact O-CG 3.46Å; E224-R228 PolarHBondContact O-N 2.8Å; E224-R228 IonicContact OE1-CZ 2.7Å; E224-R228 IonicContact OE1-NE 3.11Å; E224-R228 PolarHBondContact OE1-NE 3.36Å; E224-R228 IonicContact OE1-NH2 3.11Å; E224-R228 PolarHBondContact OE1-NH2 3.49Å
225	T	33.4	Very low	35.2	Very low	75 Å²	75	106.4 Å²	106.4	46%	0.46	50%	0.499	S	S	.	.	H	α-helix	trans	-67.9	-37.1	174.6	-58	0	0	0	0	110.8	L221 K222 E223 R228 H229	L221-T225 WeakPolarHBondContact O-CA 3.29Å; L221-T225 WeakPolarHBondContact O-CB 3.4Å; L221-T225 PolarHBondContact O-N 3.44Å; L221-T225 PolarHBondContact O-OG1 3.33Å; K222-T225 CarbonylContact O-C 3.54Å; K222-T225 PolarHBondContact O-N 2.81Å; E223-T225 VanDerWaalsContact C-N 3.31Å; E223-T225 PolarHBondContact O-N 2.81Å; T225-R228 PolarHBondContact O-N 3.08Å; T225-H229 WeakPolarHBondContact O-CA 3.11Å; T225-H229 WeakPolarHBondContact O-CB 3.15Å; T225-H229 PolarHBondContact O-N 2.77Å
226	R	36.3	Very low	35	Very low	104 Å²	104	102.4 Å²	102.4	39%	0.392	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-48.8	173.7	-171.8	-169.4	73.5	85	5.6	110.4	K222 E223 H229 E230	K222-R226 VanDerWaalsContact O-CB 3.29Å; K222-R226 WeakPolarHBondContact O-CB 3.45Å; K222-R226 PolarHBondContact O-N 3.33Å; E223-R226 CarbonylContact O-C 3.41Å; E223-R226 WeakPolarHBondContact O-CB 3.2Å; E223-R226 PolarHBondContact O-N 2.85Å; E223-R226 IonicContact OE1-CZ 2.72Å; E223-R226 IonicContact OE1-NE 2.85Å; E223-R226 PolarHBondContact OE1-NE 2.79Å; E223-R226 IonicContact OE1-NH2 2.66Å; E223-R226 PolarHBondContact OE1-NH2 2.74Å; E223-R226 IonicContact OE2-CZ 3.76Å; E223-R226 IonicContact OE2-NE 3.33Å; E223-R226 PolarHBondContact OE2-NE 3.38Å; E223-R226 IonicContact OE2-NH2 3.82Å; R226-H229 CarbonylContact O-C 3.59Å; R226-H229 PolarHBondContact O-N 2.89Å; R226-E230 IonicContact CZ-OE1 2.96Å; R226-E230 IonicContact CZ-OE2 3.58Å; R226-E230 IonicContact NH1-OE1 3.39Å; R226-E230 PolarHBondContact NH1-OE1 2.92Å; R226-E230 IonicContact NH1-OE2 3.79Å; R226-E230 PolarHBondContact NH1-OE2 3.43Å; R226-E230 IonicContact NH2-OE2 3.73Å; R226-E230 WeakPolarHBondContact O-CB 3.49Å; R226-E230 WeakPolarHBondContact O-CG 3.42Å; R226-E230 PolarHBondContact O-N 3.32Å
227	L	36.4	Very low	34.8	Very low	89 Å²	89	103.2 Å²	103.2	47%	0.466	48%	0.483	S	S	.	.	H	α-helix	trans	-64.2	-41.5	176.4	-70.4	171.9	0	0	0	111.5	E223 E224 H229 F231	E223-L227 HydrophobicContact CG-CD1 4.22Å; E223-L227 WeakPolarHBondContact O-CB 3.44Å; E223-L227 VanDerWaalsContact O-CG 3.26Å; E223-L227 WeakPolarHBondContact O-CG 3.47Å; E223-L227 PolarHBondContact O-N 3.22Å; E224-L227 PolarHBondContact O-N 3.46Å; L227-H229 VanDerWaalsContact C-N 3.35Å; L227-F231 WeakPolarHBondContact O-CA 3.36Å; L227-F231 WeakPolarHBondContact O-CB 3.07Å; L227-F231 PolarHBondContact O-N 3.26Å
228	R	27.7	Very low	34.8	Very low	144 Å²	144	100 Å²	100	54%	0.543	48%	0.478	S	S	.	.	H	α-helix	trans	-65.4	-38.1	172.5	-76.8	175.1	-179.1	-156.3	4.4	110.9	E224 T225 F231 L232	E224-R228 HydrophobicContact CG-CG 4.34Å; E224-R228 WeakPolarHBondContact O-CA 2.98Å; E224-R228 WeakPolarHBondContact O-CB 3.21Å; E224-R228 WeakPolarHBondContact O-CG 3.46Å; E224-R228 PolarHBondContact O-N 2.8Å; E224-R228 IonicContact OE1-CZ 2.7Å; E224-R228 IonicContact OE1-NE 3.11Å; E224-R228 PolarHBondContact OE1-NE 3.36Å; E224-R228 IonicContact OE1-NH2 3.11Å; E224-R228 PolarHBondContact OE1-NH2 3.49Å; T225-R228 PolarHBondContact O-N 3.08Å; R228-F231 PolarHBondContact O-N 2.82Å; R228-L232 WeakPolarHBondContact O-CA 3.42Å; R228-L232 WeakPolarHBondContact O-CB 3.43Å; R228-L232 WeakPolarHBondContact O-CD1 3.41Å; R228-L232 WeakPolarHBondContact O-CG 3.25Å; R228-L232 PolarHBondContact O-N 2.97Å
229	H	30.2	Very low	34.9	Very low	108 Å²	108	96.6 Å²	96.6	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-71.6	-45.3	178.2	-166.7	-108.2	0	0	0	110	T225 R226 L227 F231 L232 W233	T225-H229 WeakPolarHBondContact O-CA 3.11Å; T225-H229 WeakPolarHBondContact O-CB 3.15Å; T225-H229 PolarHBondContact O-N 2.77Å; R226-H229 CarbonylContact O-C 3.59Å; R226-H229 PolarHBondContact O-N 2.89Å; L227-H229 VanDerWaalsContact C-N 3.35Å; H229-F231 VanDerWaalsContact C-N 3.32Å; H229-F231 PolarHBondContact O-N 3.36Å; H229-L232 PolarHBondContact O-N 3.29Å; H229-W233 AromaticContact CE1-CE3 3.31Å; H229-W233 AromaticContact CE1-CZ3 3.42Å; H229-W233 VanDerWaalsContact CE1-CZ3 3.42Å; H229-W233 WeakPolarHBondContact CE1-CZ3 3.47Å; H229-W233 AromaticContact ND1-CE3 3.51Å; H229-W233 AromaticContact ND1-CZ3 3.88Å; H229-W233 WeakPolarHBondContact O-CA 3.49Å; H229-W233 WeakPolarHBondContact O-CB 3.26Å; H229-W233 PolarHBondContact O-N 2.81Å
230	E	33.3	Very low	34.9	Very low	95 Å²	95	97 Å²	97	44%	0.444	46%	0.462	S	S	.	.	H	α-helix	trans	-62.5	-35.6	170.8	-77	179.7	179.9	0	0	112.3	R226 S234	R226-E230 IonicContact CZ-OE1 2.96Å; R226-E230 IonicContact CZ-OE2 3.58Å; R226-E230 IonicContact NH1-OE1 3.39Å; R226-E230 PolarHBondContact NH1-OE1 2.92Å; R226-E230 IonicContact NH1-OE2 3.79Å; R226-E230 PolarHBondContact NH1-OE2 3.43Å; R226-E230 IonicContact NH2-OE2 3.73Å; R226-E230 WeakPolarHBondContact O-CB 3.49Å; R226-E230 WeakPolarHBondContact O-CG 3.42Å; R226-E230 PolarHBondContact O-N 3.32Å; E230-S234 WeakPolarHBondContact O-CA 3.07Å; E230-S234 WeakPolarHBondContact O-CB 3.31Å; E230-S234 PolarHBondContact O-N 2.83Å; E230-S234 PolarHBondContact O-OG 3.31Å
231	F	28.3	Very low	35	Very low	128 Å²	128	91.4 Å²	91.4	56%	0.561	44%	0.437	S	S	*	.	H	α-helix	trans	-75.4	-41.6	176.9	177.6	-97	0	0	0	112.8	L227 R228 H229 W233 S234 R235	L227-F231 WeakPolarHBondContact O-CA 3.36Å; L227-F231 WeakPolarHBondContact O-CB 3.07Å; L227-F231 PolarHBondContact O-N 3.26Å; R228-F231 PolarHBondContact O-N 2.82Å; H229-F231 VanDerWaalsContact C-N 3.32Å; H229-F231 PolarHBondContact O-N 3.36Å; F231-W233 VanDerWaalsContact C-N 3.34Å; F231-S234 WeakPolarHBondContact CA-OG 3.38Å; F231-S234 PolarHBondContact O-OG 3.12Å; F231-R235 VanDerWaalsContact O-CB 3.23Å; F231-R235 WeakPolarHBondContact O-CB 3.36Å; F231-R235 PolarHBondContact O-N 3.42Å
232	L	25.3	Very low	35.4	Very low	109 Å²	109	90.5 Å²	90.5	57%	0.571	43%	0.429	S	S	*	.	H	α-helix	trans	-70.4	-35.9	173.8	-73	170.6	0	0	0	110.4	R228 H229 A236	R228-L232 WeakPolarHBondContact O-CA 3.42Å; R228-L232 WeakPolarHBondContact O-CB 3.43Å; R228-L232 WeakPolarHBondContact O-CD1 3.41Å; R228-L232 WeakPolarHBondContact O-CG 3.25Å; R228-L232 PolarHBondContact O-N 2.97Å; H229-L232 PolarHBondContact O-N 3.29Å; L232-A236 WeakPolarHBondContact O-CB 3.36Å; L232-A236 PolarHBondContact O-N 3.39Å
233	W	27.6	Very low	35.8	Very low	136 Å²	136	88.8 Å²	88.8	52%	0.515	42%	0.423	S	S	.	.	H	α-helix	trans	-70.2	-43	174.7	-159	-29.2	0	0	0	110.1	H229 F231 R235 A236 E237	H229-W233 AromaticContact CE1-CE3 3.31Å; H229-W233 AromaticContact CE1-CZ3 3.42Å; H229-W233 VanDerWaalsContact CE1-CZ3 3.42Å; H229-W233 WeakPolarHBondContact CE1-CZ3 3.47Å; H229-W233 AromaticContact ND1-CE3 3.51Å; H229-W233 AromaticContact ND1-CZ3 3.88Å; H229-W233 WeakPolarHBondContact O-CA 3.49Å; H229-W233 WeakPolarHBondContact O-CB 3.26Å; H229-W233 PolarHBondContact O-N 2.81Å; F231-W233 VanDerWaalsContact C-N 3.34Å; W233-R235 PolarHBondContact O-N 2.7Å; W233-A236 PolarHBondContact O-N 3.11Å; W233-E237 PolarHBondContact NE1-OE1 3.33Å; W233-E237 WeakPolarHBondContact O-CB 3.41Å; W233-E237 WeakPolarHBondContact O-CG 3.42Å; W233-E237 PolarHBondContact O-N 2.95Å
234	S	37.7	Very low	35.8	Very low	61 Å²	61	85.2 Å²	85.2	43%	0.427	41%	0.407	S	S	.	.	H	α-helix	trans	-65.3	-37.4	173.7	75.1	0	0	0	0	111.9	E230 F231 A238	E230-S234 WeakPolarHBondContact O-CA 3.07Å; E230-S234 WeakPolarHBondContact O-CB 3.31Å; E230-S234 PolarHBondContact O-N 2.83Å; E230-S234 PolarHBondContact O-OG 3.31Å; F231-S234 WeakPolarHBondContact CA-OG 3.38Å; F231-S234 PolarHBondContact O-OG 3.12Å; S234-A238 WeakPolarHBondContact O-CB 3.26Å; S234-A238 PolarHBondContact O-N 3.49Å
235	R	30.1	Very low	36.3	Very low	163 Å²	163	82.2 Å²	82.2	62%	0.615	39%	0.394	S	S	*	.	H	α-helix	trans	-68.3	-44.2	173.3	-174.8	176.4	174.7	146.2	2.4	111.8	F231 W233 A238 V239	F231-R235 VanDerWaalsContact O-CB 3.23Å; F231-R235 WeakPolarHBondContact O-CB 3.36Å; F231-R235 PolarHBondContact O-N 3.42Å; W233-R235 PolarHBondContact O-N 2.7Å; R235-A238 PolarHBondContact O-N 2.86Å; R235-V239 WeakPolarHBondContact O-CB 3.35Å; R235-V239 WeakPolarHBondContact O-CG2 3.42Å; R235-V239 PolarHBondContact O-N 2.88Å
236	A	34.3	Very low	37	Very low	44 Å²	44	82.1 Å²	82.1	36%	0.364	39%	0.388	S	S	.	.	H	α-helix	trans	-67.6	-38.8	178	0	0	0	0	0	111.5	L232 W233 V239 K240	L232-A236 WeakPolarHBondContact O-CB 3.36Å; L232-A236 PolarHBondContact O-N 3.39Å; W233-A236 PolarHBondContact O-N 3.11Å; A236-V239 PolarHBondContact O-N 3.48Å; A236-K240 WeakPolarHBondContact O-CB 3.35Å; A236-K240 VanDerWaalsContact O-CG 3.25Å; A236-K240 WeakPolarHBondContact O-CG 3.44Å; A236-K240 PolarHBondContact O-N 3.04Å
237	E	39.5	Very low	37.6	Very low	90 Å²	90	77.4 Å²	77.4	42%	0.421	37%	0.37	S	S	.	.	H	α-helix	trans	-67.6	-41	171.9	-83	178.6	174.5	0	0	111.6	W233 V239 K240 C241	W233-E237 PolarHBondContact NE1-OE1 3.33Å; W233-E237 WeakPolarHBondContact O-CB 3.41Å; W233-E237 WeakPolarHBondContact O-CG 3.42Å; W233-E237 PolarHBondContact O-N 2.95Å; E237-V239 VanDerWaalsContact C-N 3.32Å; E237-V239 PolarHBondContact O-N 2.9Å; E237-K240 PolarHBondContact O-N 3.49Å; E237-C241 WeakPolarHBondContact O-CA 3.48Å; E237-C241 WeakPolarHBondContact O-CB 3Å; E237-C241 PolarHBondContact O-N 3.06Å
238	A	39.3	Very low	38.3	Very low	50 Å²	50	73.7 Å²	73.7	41%	0.413	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-38.7	173.8	0	0	0	0	0	111.6	S234 R235 C241 R242	S234-A238 WeakPolarHBondContact O-CB 3.26Å; S234-A238 PolarHBondContact O-N 3.49Å; R235-A238 PolarHBondContact O-N 2.86Å; A238-C241 PolarHBondContact O-N 3.31Å; A238-R242 WeakPolarHBondContact O-CB 3.34Å; A238-R242 PolarHBondContact O-N 2.83Å
239	V	38	Very low	39.4	Very low	42 Å²	42	67.7 Å²	67.7	26%	0.255	33%	0.334	S	S	.	.	H	α-helix	trans	-65.7	-49.5	174.1	168.6	0	0	0	0	111.1	R235 A236 E237 C241 R242 Q243	R235-V239 WeakPolarHBondContact O-CB 3.35Å; R235-V239 WeakPolarHBondContact O-CG2 3.42Å; R235-V239 PolarHBondContact O-N 2.88Å; A236-V239 PolarHBondContact O-N 3.48Å; E237-V239 VanDerWaalsContact C-N 3.32Å; E237-V239 PolarHBondContact O-N 2.9Å; V239-C241 PolarHBondContact O-N 3.28Å; V239-R242 WeakPolarHBondContact O-CB 3.47Å; V239-R242 PolarHBondContact O-N 2.72Å; V239-Q243 WeakPolarHBondContact O-CG 3.39Å; V239-Q243 PolarHBondContact O-N 2.81Å
240	K	44.3	Very low	40.3	Very low	114 Å²	114	65.9 Å²	65.9	50%	0.496	33%	0.326	S	S	.	.	H	α-helix	trans	-59.5	-39	174.5	-74.7	173.2	-179.2	179.9	0	111.5	L44 A236 E237 Q243 S244	L44-K240 HydrophobicContact CD2-CB 4.09Å; A236-K240 WeakPolarHBondContact O-CB 3.35Å; A236-K240 VanDerWaalsContact O-CG 3.25Å; A236-K240 WeakPolarHBondContact O-CG 3.44Å; A236-K240 PolarHBondContact O-N 3.04Å; E237-K240 PolarHBondContact O-N 3.49Å; K240-Q243 PolarHBondContact O-N 3.19Å; K240-S244 VanDerWaalsContact O-CB 3.31Å; K240-S244 WeakPolarHBondContact O-CB 3.42Å; K240-S244 PolarHBondContact O-N 3.2Å; K240-S244 PolarHBondContact O-OG 3.12Å
241	C	40.9	Very low	41.1	Very low	14 Å²	14	61.6 Å²	61.6	10%	0.095	31%	0.305	C	S	.	.	H	α-helix	trans	-65.7	-45	178	177.8	0	0	0	0	111.6	L44 L47 E237 A238 V239 S244 L245	L44-C241 HydrophobicContact CB-CB 4.15Å; L44-C241 HydrophobicContact CD1-CB 3.68Å; L44-C241 HydrophobicContact CD2-CB 4.42Å; L44-C241 HydrophobicContact CG-CB 4.3Å; L47-C241 WeakPolarHBondContact CD1-SG 3.43Å; E237-C241 WeakPolarHBondContact O-CA 3.48Å; E237-C241 WeakPolarHBondContact O-CB 3Å; E237-C241 PolarHBondContact O-N 3.06Å; A238-C241 PolarHBondContact O-N 3.31Å; V239-C241 PolarHBondContact O-N 3.28Å; C241-S244 PolarHBondContact O-N 2.74Å; C241-L245 VanDerWaalsContact O-CB 3.28Å; C241-L245 WeakPolarHBondContact O-CB 3.07Å; C241-L245 VanDerWaalsContact O-CG 3.28Å; C241-L245 WeakPolarHBondContact O-CG 3.3Å; C241-L245 PolarHBondContact O-N 3.28Å
242	R	43.6	Very low	41.9	Very low	49 Å²	49	55.6 Å²	55.6	19%	0.185	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-45.3	174.4	-177.2	-174.2	65.5	-154.4	-1.2	111.7	A238 V239 L245 H246	A238-R242 WeakPolarHBondContact O-CB 3.34Å; A238-R242 PolarHBondContact O-N 2.83Å; V239-R242 WeakPolarHBondContact O-CB 3.47Å; V239-R242 PolarHBondContact O-N 2.72Å; R242-L245 PolarHBondContact O-N 2.77Å; R242-H246 VanDerWaalsContact O-CB 3.22Å; R242-H246 WeakPolarHBondContact O-CB 3.37Å; R242-H246 PolarHBondContact O-N 3.5Å
243	Q	46.1	Very low	42.9	Very low	84 Å²	84	56.2 Å²	56.2	39%	0.393	27%	0.274	S	S	.	.	H	α-helix	trans	-62.6	-46	177	-69.9	172.7	-63.6	0	0	111	E92 V239 K240 L245 H246 L247	E92-Q243 PolarHBondContact OE1-OE1 2.9Å; E92-Q243 VanDerWaalsContact OE2-CB 3.29Å; E92-Q243 WeakPolarHBondContact OE2-CB 3.22Å; V239-Q243 WeakPolarHBondContact O-CG 3.39Å; V239-Q243 PolarHBondContact O-N 2.81Å; K240-Q243 PolarHBondContact O-N 3.19Å; Q243-L245 PolarHBondContact O-N 3.04Å; Q243-H246 PolarHBondContact O-N 3.24Å; Q243-L247 WeakPolarHBondContact O-CB 3.26Å; Q243-L247 VanDerWaalsContact O-CG 3.26Å; Q243-L247 WeakPolarHBondContact O-CG 3.28Å; Q243-L247 PolarHBondContact O-N 3.16Å
244	S	44.7	Very low	43.6	Very low	5 Å²	5	53.4 Å²	53.4	4%	0.035	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-41.4	178.2	-55.9	0	0	0	0	112.9	K240 C241 L247 L248	K240-S244 VanDerWaalsContact O-CB 3.31Å; K240-S244 WeakPolarHBondContact O-CB 3.42Å; K240-S244 PolarHBondContact O-N 3.2Å; K240-S244 PolarHBondContact O-OG 3.12Å; C241-S244 PolarHBondContact O-N 2.74Å; S244-L247 PolarHBondContact O-N 3.08Å; S244-L248 WeakPolarHBondContact O-CB 3.27Å; S244-L248 PolarHBondContact O-N 2.89Å
245	L	45.2	Very low	43.9	Very low	22 Å²	22	51.9 Å²	51.9	12%	0.115	26%	0.259	C	S	.	.	H	α-helix	trans	-69.4	-37.2	176.3	-76.4	176.6	0	0	0	112.2	L47 C241 R242 Q243 L248 G249	L47-L245 HydrophobicContact CB-CD2 4.39Å; L47-L245 HydrophobicContact CD1-CD1 4.32Å; C241-L245 VanDerWaalsContact O-CB 3.28Å; C241-L245 WeakPolarHBondContact O-CB 3.07Å; C241-L245 VanDerWaalsContact O-CG 3.28Å; C241-L245 WeakPolarHBondContact O-CG 3.3Å; C241-L245 PolarHBondContact O-N 3.28Å; R242-L245 PolarHBondContact O-N 2.77Å; Q243-L245 PolarHBondContact O-N 3.04Å; L245-L248 HydrophobicContact CD2-CD2 4.41Å; L245-L248 PolarHBondContact O-N 3.19Å; L245-G249 PolarHBondContact O-N 3.26Å
246	H	48.4	Very low	44.4	Very low	73 Å²	73	46.4 Å²	46.4	34%	0.338	24%	0.238	S	C	.	.	H	α-helix	trans	-62.6	-48.9	173	-179.1	76.2	0	0	0	110.8	R242 Q243 L248 G249 E250	R242-H246 VanDerWaalsContact O-CB 3.22Å; R242-H246 WeakPolarHBondContact O-CB 3.37Å; R242-H246 PolarHBondContact O-N 3.5Å; Q243-H246 PolarHBondContact O-N 3.24Å; H246-L248 VanDerWaalsContact C-N 3.3Å; H246-L248 PolarHBondContact O-N 3.36Å; H246-G249 PolarHBondContact O-N 3.13Å; H246-G249 VanDerWaalsContact O-N 3.12Å; H246-E250 IonicContact CD2-OE2 2.9Å; H246-E250 IonicContact NE2-OE1 3.08Å; H246-E250 IonicContact NE2-OE2 2.63Å; H246-E250 WeakPolarHBondContact O-CG 3.21Å; H246-E250 PolarHBondContact O-N 2.76Å
247	L	49.2	Very low	44.5	Very low	5 Å²	5	46.1 Å²	46.1	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-43	175	-73.1	171.2	0	0	0	111.8	F81 R85 E92 Q243 S244 E250 F251	F81-L247 HydrophobicContact CE1-CB 4.38Å; F81-L247 HydrophobicContact CE1-CD2 4.05Å; F81-L247 HydrophobicContact CZ-CB 4.44Å; F81-L247 HydrophobicContact CZ-CD2 3.96Å; F81-L247 VanDerWaalsContact CZ-O 3.27Å; F81-L247 WeakPolarHBondContact CZ-O 3.32Å; R85-L247 VanDerWaalsContact NH1-CD2 3.3Å; E92-L247 HydrophobicContact CB-CD1 3.62Å; E92-L247 VanDerWaalsContact OE2-CD1 3.23Å; E92-L247 WeakPolarHBondContact OE2-CD1 3.09Å; Q243-L247 WeakPolarHBondContact O-CB 3.26Å; Q243-L247 VanDerWaalsContact O-CG 3.26Å; Q243-L247 WeakPolarHBondContact O-CG 3.28Å; Q243-L247 PolarHBondContact O-N 3.16Å; S244-L247 PolarHBondContact O-N 3.08Å; L247-E250 PolarHBondContact O-N 3.33Å; L247-F251 VanDerWaalsContact O-CB 3.32Å; L247-F251 WeakPolarHBondContact O-CB 3.22Å; L247-F251 PolarHBondContact O-N 3.35Å
248	L	50	Low	44.3	Very low	12 Å²	12	45 Å²	45	6%	0.063	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-45.8	174.3	179	59	0	0	0	111.6	L48 I55 L96 S244 L245 H246 F251 M252	L48-L248 HydrophobicContact CD2-CD2 4.35Å; I55-L248 HydrophobicContact CD1-CD1 3.79Å; L96-L248 HydrophobicContact CD1-CB 4.13Å; L96-L248 HydrophobicContact CD1-CD1 4.05Å; L96-L248 HydrophobicContact CD1-CD2 4.32Å; L96-L248 HydrophobicContact CD1-CG 4.39Å; L96-L248 HydrophobicContact CD2-CB 3.8Å; L96-L248 HydrophobicContact CD2-CD1 4Å; L96-L248 HydrophobicContact CD2-CG 4.48Å; L96-L248 HydrophobicContact CG-CD1 4.4Å; S244-L248 WeakPolarHBondContact O-CB 3.27Å; S244-L248 PolarHBondContact O-N 2.89Å; L245-L248 HydrophobicContact CD2-CD2 4.41Å; L245-L248 PolarHBondContact O-N 3.19Å; H246-L248 VanDerWaalsContact C-N 3.3Å; H246-L248 PolarHBondContact O-N 3.36Å; L248-F251 PolarHBondContact O-N 2.76Å; L248-M252 HydrophobicContact CD1-CG 3.94Å; L248-M252 HydrophobicContact CG-CG 4.41Å; L248-M252 VanDerWaalsContact O-CB 3.26Å; L248-M252 WeakPolarHBondContact O-CB 3.34Å; L248-M252 WeakPolarHBondContact O-CG 3.4Å; L248-M252 PolarHBondContact O-N 3.13Å
249	G	50.6	Low	44	Very low	17 Å²	17	49.3 Å²	49.3	18%	0.175	25%	0.25	C	S	.	.	H	α-helix	trans	-62.6	-41.6	177.6	0	0	0	0	0	113	L245 H246 M252 R253	L245-G249 PolarHBondContact O-N 3.26Å; H246-G249 PolarHBondContact O-N 3.13Å; H246-G249 VanDerWaalsContact O-N 3.12Å; G249-M252 PolarHBondContact O-N 2.88Å; G249-R253 PolarHBondContact O-N 3Å
250	E	49.3	Very low	43.7	Very low	71 Å²	71	50.1 Å²	50.1	33%	0.332	26%	0.255	S	S	.	.	H	α-helix	trans	-66.1	-42.5	174.5	-70.4	-164.2	118.9	0	0	112.1	F81 R85 H246 L247 M252 R253	F81-E250 HydrophobicContact CE2-CB 3.77Å; F81-E250 HydrophobicContact CZ-CB 3.95Å; R85-E250 IonicContact CZ-OE2 3.69Å; R85-E250 IonicContact NH1-OE2 4Å; R85-E250 IonicContact NH2-OE2 2.76Å; R85-E250 PolarHBondContact NH2-OE2 2.85Å; H246-E250 IonicContact CD2-OE2 2.9Å; H246-E250 IonicContact NE2-OE1 3.08Å; H246-E250 IonicContact NE2-OE2 2.63Å; H246-E250 WeakPolarHBondContact O-CG 3.21Å; H246-E250 PolarHBondContact O-N 2.76Å; L247-E250 PolarHBondContact O-N 3.33Å; E250-M252 VanDerWaalsContact C-N 3.3Å; E250-M252 PolarHBondContact O-N 3.4Å; E250-R253 WeakPolarHBondContact O-CB 3.27Å; E250-R253 PolarHBondContact O-N 3.41Å
251	F	50.3	Low	43.3	Very low	5 Å²	5	49.2 Å²	49.2	2%	0.022	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-39	173.9	172.6	-108	0	0	0	111.7	K77 F78 F81 F101 L247 L248 P254 F255	K77-F251 HydrophobicContact CB-CE2 4.21Å; F78-F251 HydrophobicContact CB-CD2 4.32Å; F78-F251 HydrophobicContact CB-CE2 3.64Å; F78-F251 HydrophobicContact CB-CZ 3.75Å; F78-F251 AromaticContact CD2-CD1 3.77Å; F78-F251 HydrophobicContact CD2-CD1 3.77Å; F78-F251 AromaticContact CD2-CD2 3.68Å; F78-F251 HydrophobicContact CD2-CD2 3.68Å; F78-F251 AromaticContact CD2-CE1 3.79Å; F78-F251 HydrophobicContact CD2-CE1 3.79Å; F78-F251 AromaticContact CD2-CE2 3.72Å; F78-F251 HydrophobicContact CD2-CE2 3.72Å; F78-F251 AromaticContact CD2-CG 3.71Å; F78-F251 HydrophobicContact CD2-CG 3.71Å; F78-F251 AromaticContact CD2-CZ 3.75Å; F78-F251 HydrophobicContact CD2-CZ 3.75Å; F78-F251 HydrophobicContact CE2-CD1 4.24Å; F78-F251 HydrophobicContact CE2-CD2 4.43Å; F78-F251 HydrophobicContact CE2-CG 4.14Å; F78-F251 HydrophobicContact CG-CD2 4.42Å; F78-F251 HydrophobicContact CG-CE2 4.17Å; F78-F251 HydrophobicContact CG-CZ 4.27Å; F78-F251 VanDerWaalsContact N-CE2 3.32Å; F81-F251 HydrophobicContact CB-CD2 4.03Å; F81-F251 HydrophobicContact CD1-CB 4.21Å; F81-F251 HydrophobicContact CD1-CD2 4.42Å; F81-F251 HydrophobicContact CD2-CB 4.31Å; F81-F251 HydrophobicContact CE1-CB 4.11Å; F81-F251 HydrophobicContact CE2-CB 4.21Å; F81-F251 HydrophobicContact CG-CB 4.29Å; F81-F251 HydrophobicContact CG-CD2 4.1Å; F81-F251 HydrophobicContact CZ-CB 4.1Å; F101-F251 AromaticContact CZ-CE1 3.84Å; F101-F251 HydrophobicContact CZ-CE1 3.84Å; F101-F251 AromaticContact CZ-CZ 3.99Å; F101-F251 HydrophobicContact CZ-CZ 3.99Å; L247-F251 VanDerWaalsContact O-CB 3.32Å; L247-F251 WeakPolarHBondContact O-CB 3.22Å; L247-F251 PolarHBondContact O-N 3.35Å; L248-F251 PolarHBondContact O-N 2.76Å; F251-P254 WeakPolarHBondContact O-CD 3.27Å; F251-F255 HydrophobicContact CD2-CE2 4.45Å; F251-F255 HydrophobicContact CE1-CE2 4.06Å; F251-F255 AromaticContact CE2-CE2 3.86Å; F251-F255 HydrophobicContact CE2-CE2 3.86Å; F251-F255 HydrophobicContact CE2-CZ 4.31Å; F251-F255 AromaticContact CZ-CE2 3.68Å; F251-F255 HydrophobicContact CZ-CE2 3.68Å; F251-F255 HydrophobicContact CZ-CZ 4.02Å; F251-F255 VanDerWaalsContact O-CD2 3.3Å; F251-F255 WeakPolarHBondContact O-CD2 3.34Å; F251-F255 VanDerWaalsContact O-CE2 3.28Å; F251-F255 WeakPolarHBondContact O-CE2 3.47Å
252	M	45.9	Very low	42.9	Very low	1 Å²	1	55.7 Å²	55.7	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-78.1	-19.2	-179	-74.1	-54.8	-64.9	0	0	114.2	I55 L248 G249 E250 P254 F255 W256	I55-M252 HydrophobicContact CB-CE 4.48Å; I55-M252 HydrophobicContact CB-SD 4.48Å; I55-M252 HydrophobicContact CD1-CE 4.25Å; I55-M252 HydrophobicContact CD1-CG 4.04Å; I55-M252 HydrophobicContact CD1-SD 3.35Å; I55-M252 WeakPolarHBondContact CD1-SD 3.12Å; I55-M252 HydrophobicContact CG1-CE 3.61Å; I55-M252 HydrophobicContact CG1-CG 4.32Å; I55-M252 HydrophobicContact CG1-SD 3.42Å; I55-M252 WeakPolarHBondContact CG1-SD 3.12Å; I55-M252 HydrophobicContact CG2-CE 4.41Å; I55-M252 HydrophobicContact CG2-SD 4.24Å; L248-M252 HydrophobicContact CD1-CG 3.94Å; L248-M252 HydrophobicContact CG-CG 4.41Å; L248-M252 VanDerWaalsContact O-CB 3.26Å; L248-M252 WeakPolarHBondContact O-CB 3.34Å; L248-M252 WeakPolarHBondContact O-CG 3.4Å; L248-M252 PolarHBondContact O-N 3.13Å; G249-M252 PolarHBondContact O-N 2.88Å; E250-M252 VanDerWaalsContact C-N 3.3Å; E250-M252 PolarHBondContact O-N 3.4Å; M252-P254 VanDerWaalsContact C-CD 3.5Å; M252-F255 HydrophobicContact CE-CB 4.08Å; M252-F255 WeakPolarHBondContact O-CA 3.45Å; M252-F255 WeakPolarHBondContact O-CB 3.38Å; M252-F255 PolarHBondContact O-N 3.29Å; M252-F255 HydrophobicContact SD-CD2 4.18Å; M252-W256 HydrophobicContact CB-CD2 3.87Å; M252-W256 HydrophobicContact CB-CE3 4.08Å; M252-W256 HydrophobicContact CB-CH2 3.87Å; M252-W256 HydrophobicContact CB-CZ2 3.65Å; M252-W256 HydrophobicContact CB-CZ3 4.09Å; M252-W256 HydrophobicContact CE-CZ2 4.41Å; M252-W256 HydrophobicContact CG-CH2 4.46Å; M252-W256 HydrophobicContact CG-CZ2 4.02Å; M252-W256 PolarHBondContact O-N 2.78Å
253	R	46.6	Very low	42.3	Very low	122 Å²	122	57 Å²	57	46%	0.46	33%	0.325	S	S	.	.	H	α-helix	trans	-51.7	-46.7	-177.2	-172.2	179	-178.5	162.9	0.5	113.8	G249 E250 F255 W256 F257 S305	G249-R253 PolarHBondContact O-N 3Å; E250-R253 WeakPolarHBondContact O-CB 3.27Å; E250-R253 PolarHBondContact O-N 3.41Å; R253-F255 PolarHBondContact O-N 2.97Å; R253-W256 PolarHBondContact O-N 3.26Å; R253-F257 HydrophobicContact CG-CD2 3.99Å; R253-F257 WeakPolarHBondContact O-CD2 3.31Å; R253-F257 PolarHBondContact O-N 2.89Å; R253-S305 PolarHBondContact NH1-OG 3.23Å
254	P	42.5	Very low	41.6	Very low	77 Å²	77	57.9 Å²	57.9	50%	0.5	34%	0.336	S	S	.	.	H	α-helix	trans	-66.4	-16.9	178.1	-18.7	33.8	0	0	0	114	F251 M252 F257 P258	F251-P254 WeakPolarHBondContact O-CD 3.27Å; M252-P254 VanDerWaalsContact C-CD 3.5Å; P254-F257 CarbonylContact O-C 3.57Å; P254-P258 VanDerWaalsContact O-CA 3.27Å; P254-P258 WeakPolarHBondContact O-CA 3.43Å
255	F	43.5	Very low	40.8	Very low	29 Å²	29	64.4 Å²	64.4	13%	0.127	36%	0.364	C	S	.	.	H	α-helix	trans	-95.6	-37.1	-178.7	-59.3	-82	0	0	0	112.4	H59 L74 K77 F251 M252 R253	H59-F255 AromaticContact CE1-CD1 3.41Å; H59-F255 VanDerWaalsContact CE1-CD1 3.41Å; H59-F255 WeakPolarHBondContact CE1-CD1 3.41Å; H59-F255 AromaticContact CE1-CG 3.83Å; H59-F255 WeakPolarHBondContact NE2-CB 3.33Å; H59-F255 AromaticContact NE2-CD1 3.76Å; H59-F255 AromaticContact NE2-CG 3.79Å; L74-F255 HydrophobicContact CD2-CD1 3.92Å; L74-F255 HydrophobicContact CD2-CE1 3.15Å; L74-F255 HydrophobicContact CD2-CE2 4.17Å; L74-F255 HydrophobicContact CD2-CZ 3.29Å; K77-F255 HydrophobicContact CB-CZ 4.1Å; K77-F255 HydrophobicContact CD-CE1 3.6Å; K77-F255 HydrophobicContact CD-CE2 4.47Å; K77-F255 HydrophobicContact CD-CZ 3.35Å; K77-F255 HydrophobicContact CG-CZ 4.37Å; F251-F255 HydrophobicContact CD2-CE2 4.45Å; F251-F255 HydrophobicContact CE1-CE2 4.06Å; F251-F255 AromaticContact CE2-CE2 3.86Å; F251-F255 HydrophobicContact CE2-CE2 3.86Å; F251-F255 HydrophobicContact CE2-CZ 4.31Å; F251-F255 AromaticContact CZ-CE2 3.68Å; F251-F255 HydrophobicContact CZ-CE2 3.68Å; F251-F255 HydrophobicContact CZ-CZ 4.02Å; F251-F255 VanDerWaalsContact O-CD2 3.3Å; F251-F255 WeakPolarHBondContact O-CD2 3.34Å; F251-F255 VanDerWaalsContact O-CE2 3.28Å; F251-F255 WeakPolarHBondContact O-CE2 3.47Å; M252-F255 HydrophobicContact CE-CB 4.08Å; M252-F255 WeakPolarHBondContact O-CA 3.45Å; M252-F255 WeakPolarHBondContact O-CB 3.38Å; M252-F255 PolarHBondContact O-N 3.29Å; M252-F255 HydrophobicContact SD-CD2 4.18Å; R253-F255 PolarHBondContact O-N 2.97Å
256	W	40.1	Very low	40.2	Very low	49 Å²	49	64.6 Å²	64.6	19%	0.186	37%	0.367	C	S	.	.	H	α-helix	trans	-72.4	-33.3	171.5	-65.6	-19.3	0	0	0	111.9	M252 R253 P258 Y268 L313	M252-W256 HydrophobicContact CB-CD2 3.87Å; M252-W256 HydrophobicContact CB-CE3 4.08Å; M252-W256 HydrophobicContact CB-CH2 3.87Å; M252-W256 HydrophobicContact CB-CZ2 3.65Å; M252-W256 HydrophobicContact CB-CZ3 4.09Å; M252-W256 HydrophobicContact CE-CZ2 4.41Å; M252-W256 HydrophobicContact CG-CH2 4.46Å; M252-W256 HydrophobicContact CG-CZ2 4.02Å; M252-W256 PolarHBondContact O-N 2.78Å; R253-W256 PolarHBondContact O-N 3.26Å; W256-P258 WeakPolarHBondContact O-CD 3.26Å; W256-Y268 WeakPolarHBondContact O-CD2 3.25Å; W256-L313 HydrophobicContact CH2-CB 4.18Å; W256-L313 HydrophobicContact CH2-CD1 3.75Å; W256-L313 HydrophobicContact CH2-CD2 4.3Å; W256-L313 HydrophobicContact CH2-CG 4.29Å; W256-L313 HydrophobicContact CZ2-CD1 3.85Å; W256-L313 HydrophobicContact CZ3-CB 4.45Å
257	F	37.5	Very low	39.5	Very low	38 Å²	38	68.7 Å²	68.7	17%	0.167	38%	0.384	C	S	.	.	S	Bend	trans	-124.2	74.1	175.8	-45.9	-79.5	0	0	0	108.6	R253 P254 V259 Y268 L312	R253-F257 HydrophobicContact CG-CD2 3.99Å; R253-F257 WeakPolarHBondContact O-CD2 3.31Å; R253-F257 PolarHBondContact O-N 2.89Å; P254-F257 CarbonylContact O-C 3.57Å; F257-V259 PolarHBondContact O-N 2.93Å; F257-Y268 AromaticContact CD1-CD2 3.98Å; F257-Y268 HydrophobicContact CD1-CD2 3.98Å; F257-Y268 HydrophobicContact CD1-CG 4.14Å; F257-Y268 AromaticContact CE1-CD2 3.9Å; F257-Y268 HydrophobicContact CE1-CD2 3.9Å; F257-Y268 AromaticContact CE1-CG 3.87Å; F257-Y268 HydrophobicContact CE1-CG 3.87Å; F257-L312 HydrophobicContact CE1-CD1 3.56Å; F257-L312 HydrophobicContact CZ-CD1 3.31Å
258	P	34.4	Very low	38.6	Very low	66 Å²	66	72.1 Å²	72.1	43%	0.429	40%	0.397	S	S	.	.			trans	-56.6	118.8	170.8	23.8	-30.2	0	0	0	107.2	P254 W256 V260	P254-P258 VanDerWaalsContact O-CA 3.27Å; P254-P258 WeakPolarHBondContact O-CA 3.43Å; W256-P258 WeakPolarHBondContact O-CD 3.26Å; P258-V260 VanDerWaalsContact C-N 3.28Å; P258-V260 WeakPolarHBondContact O-CG2 3.44Å; P258-V260 PolarHBondContact O-N 2.88Å
259	V	32.9	Very low	37.5	Very low	140 Å²	140	72.4 Å²	72.4	85%	0.848	40%	0.401	S	S	*	.			trans	-64.1	100.2	168.6	-178.8	0	0	0	0	104.8	F257 S261	F257-V259 PolarHBondContact O-N 2.93Å; V259-S261 PolarHBondContact O-N 3.49Å
260	V	31.6	Very low	36.5	Very low	60 Å²	60	75 Å²	75	36%	0.364	41%	0.411	S	S	.	.			trans	-77.2	96.3	-179.7	-164.9	0	0	0	0	106.9	P258 D262 V264	P258-V260 VanDerWaalsContact C-N 3.28Å; P258-V260 WeakPolarHBondContact O-CG2 3.44Å; P258-V260 PolarHBondContact O-N 2.88Å; V260-D262 PolarHBondContact O-N 3.05Å; V260-V264 WeakPolarHBondContact CB-O 3.36Å; V260-V264 HydrophobicContact CG1-CB 3.93Å; V260-V264 WeakPolarHBondContact CG1-O 3.33Å; V260-V264 VanDerWaalsContact CG2-O 3.24Å; V260-V264 WeakPolarHBondContact CG2-O 3.49Å
261	S	35.7	Very low	35.4	Very low	94 Å²	94	76 Å²	76	66%	0.657	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	127.4	155.9	46.8	0	0	0	0	107.1	V259	V259-S261 PolarHBondContact O-N 3.49Å
262	D	33.9	Very low	34.5	Very low	150 Å²	150	83 Å²	83	80%	0.802	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.5	28.9	177.2	-50.2	-22.8	0	0	0	117.7	V260 V264	V260-D262 PolarHBondContact O-N 3.05Å; D262-V264 PolarHBondContact O-N 2.94Å
263	G	30.9	Very low	33.7	Very low	76 Å²	76	88.6 Å²	88.6	78%	0.784	49%	0.491	S	S	*	.	S	Bend	trans	71.6	0.9	158.2	0	0	0	0	0	115.9	K265	G263-K265 PolarHBondContact O-N 3.46Å
264	V	29.9	Very low	32.7	Very low	104 Å²	104	89.3 Å²	89.3	63%	0.63	50%	0.503	S	S	*	.			trans	-80.1	107	167.7	-178.8	0	0	0	0	107	V260 D262 S266	V260-V264 WeakPolarHBondContact CB-O 3.36Å; V260-V264 HydrophobicContact CG1-CB 3.93Å; V260-V264 WeakPolarHBondContact CG1-O 3.33Å; V260-V264 VanDerWaalsContact CG2-O 3.24Å; V260-V264 WeakPolarHBondContact CG2-O 3.49Å; D262-V264 PolarHBondContact O-N 2.94Å; V264-S266 PolarHBondContact O-N 3.21Å
265	K	29	Very low	32.2	Very low	142 Å²	142	90.1 Å²	90.1	62%	0.617	50%	0.502	S	S	*	.			trans	-50.4	131.5	179.3	-67.4	-171.3	175.9	-163.4	0	109.5	G263 A269	G263-K265 PolarHBondContact O-N 3.46Å; K265-A269 HydrophobicContact CD-CB 4.07Å
266	S	31.5	Very low	31.2	Very low	26 Å²	26	96.8 Å²	96.8	18%	0.182	53%	0.531	C	S	.	.			trans	-53.6	155.4	167.8	68.6	0	0	0	0	108.6	V264 Y268	V264-S266 PolarHBondContact O-N 3.21Å; S266-Y268 CarbonylContact O-C 3.57Å; S266-Y268 PolarHBondContact O-N 3.46Å; S266-Y268 PolarHBondContact OG-O 2.93Å
267	K	34	Very low	30.6	Very low	159 Å²	159	97.1 Å²	97.1	69%	0.691	54%	0.54	S	S	*	.	S	Bend	trans	-52.9	-13.8	174.7	-85.7	-177.1	174.2	178.5	0	113.7
268	Y	30	Very low	29.9	Very low	76 Å²	76	98.6 Å²	98.6	30%	0.298	56%	0.555	S	S	.	*	S	Bend	trans	-120.9	86	175.8	-55.8	-76.2	0	0	0	109.2	W256 F257 S266 L270 L312	W256-Y268 WeakPolarHBondContact O-CD2 3.25Å; F257-Y268 AromaticContact CD1-CD2 3.98Å; F257-Y268 HydrophobicContact CD1-CD2 3.98Å; F257-Y268 HydrophobicContact CD1-CG 4.14Å; F257-Y268 AromaticContact CE1-CD2 3.9Å; F257-Y268 HydrophobicContact CE1-CD2 3.9Å; F257-Y268 AromaticContact CE1-CG 3.87Å; F257-Y268 HydrophobicContact CE1-CG 3.87Å; S266-Y268 CarbonylContact O-C 3.57Å; S266-Y268 PolarHBondContact O-N 3.46Å; S266-Y268 PolarHBondContact OG-O 2.93Å; Y268-L270 PolarHBondContact O-N 3.43Å; Y268-L270 VanDerWaalsContact O-N 3.17Å; Y268-L312 HydrophobicContact CD1-CD2 4.34Å; Y268-L312 HydrophobicContact CE1-CD2 4.15Å
269	A	27.9	Very low	29.5	Very low	18 Å²	18	98.8 Å²	98.8	15%	0.149	56%	0.555	C	S	.	*			trans	-72	108.7	171.5	0	0	0	0	0	109.1	K265 L280	K265-A269 HydrophobicContact CD-CB 4.07Å; A269-L280 HydrophobicContact CB-CD1 4.45Å
270	L	29.3	Very low	29.1	Very low	71 Å²	71	96.9 Å²	96.9	37%	0.372	54%	0.539	S	S	.	.			trans	-89.9	104.3	162.6	-82	156	0	0	0	106.9	Y268 M275 L308	Y268-L270 PolarHBondContact O-N 3.43Å; Y268-L270 VanDerWaalsContact O-N 3.17Å; L270-M275 HydrophobicContact CD2-CE 4.2Å; L270-M275 HydrophobicContact CD2-SD 3.74Å; L270-L308 HydrophobicContact CD1-CD2 3.83Å; L270-L308 HydrophobicContact CD2-CD2 3.54Å; L270-L308 HydrophobicContact CG-CD2 4.18Å
271	D	27	Very low	28.7	Very low	93 Å²	93	102.1 Å²	102.1	50%	0.497	56%	0.56	S	S	.	*			trans	-82	114.5	165.5	-85.9	-23.2	0	0	0	107.9	T273 D274 M275	D271-T273 PolarHBondContact O-N 2.96Å; D271-D274 PolarHBondContact O-N 3.43Å; D271-M275 PolarHBondContact O-N 2.75Å; D271-M275 VanDerWaalsContact O-N 3.12Å
272	D	31.2	Very low	28.3	Very low	151 Å²	151	101.8 Å²	101.8	81%	0.807	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-18.5	-175	-76	-29.5	0	0	0	114.1
273	T	28.8	Very low	27.8	Very low	120 Å²	120	102.9 Å²	102.9	74%	0.736	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-26.7	-171.6	49	0	0	0	0	114.7	D271	D271-T273 PolarHBondContact O-N 2.96Å
274	D	26	Very low	27.5	Very low	136 Å²	136	107.5 Å²	107.5	73%	0.727	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.7	5.7	-176.9	-81.5	-41.4	0	0	0	114.8	D271 K276	D271-D274 PolarHBondContact O-N 3.43Å; D274-K276 PolarHBondContact O-N 3.27Å
275	M	30.2	Very low	27.3	Very low	95 Å²	95	112 Å²	112	47%	0.468	57%	0.57	S	S	.	*			trans	42.3	33.5	164.9	-68.6	-75.6	-86.1	0	0	115.9	L270 D271 C277	L270-M275 HydrophobicContact CD2-CE 4.2Å; L270-M275 HydrophobicContact CD2-SD 3.74Å; D271-M275 PolarHBondContact O-N 2.75Å; D271-M275 VanDerWaalsContact O-N 3.12Å; M275-C277 PolarHBondContact O-N 3.37Å
276	K	24.2	Very low	27.4	Very low	168 Å²	168	110.1 Å²	110.1	73%	0.73	58%	0.575	S	S	*	*			trans	-77.8	108.5	163.2	-70.6	-177.7	-178	173.6	0	107.3	D274 S278	D274-K276 PolarHBondContact O-N 3.27Å; K276-S278 VanDerWaalsContact C-N 3.28Å; K276-S278 PolarHBondContact O-N 3.18Å
277	C	27.2	Very low	27.2	Very low	57 Å²	57	114.5 Å²	114.5	39%	0.385	61%	0.605	S	S	.	*			trans	-68.9	93.2	165.5	-167.1	0	0	0	0	107.7	M275 V279	M275-C277 PolarHBondContact O-N 3.37Å; C277-V279 PolarHBondContact O-N 3.44Å
278	S	23	Very low	26.7	Very low	68 Å²	68	112.5 Å²	112.5	48%	0.476	61%	0.612	S	S	.	*			trans	-77.4	104.1	167	-46.9	0	0	0	0	105.5	K276 L280	K276-S278 VanDerWaalsContact C-N 3.28Å; K276-S278 PolarHBondContact O-N 3.18Å; S278-L280 VanDerWaalsContact C-N 3.3Å; S278-L280 PolarHBondContact O-N 2.98Å
279	V	25.9	Very low	26.3	Very low	70 Å²	70	116.4 Å²	116.4	42%	0.424	64%	0.637	S	S	.	*			trans	-58.3	105.2	160.7	178.5	0	0	0	0	105	C277 E281 P282	C277-V279 PolarHBondContact O-N 3.44Å; V279-E281 PolarHBondContact O-N 3.29Å; V279-P282 HydrophobicContact CG1-CG 4.5Å
280	L	24.3	Very low	26	Very low	100 Å²	100	124.4 Å²	124.4	52%	0.524	67%	0.669	S	S	.	*			trans	-69.1	84.7	172.6	-73	173.7	0	0	0	106.6	A269 S278	A269-L280 HydrophobicContact CB-CD1 4.45Å; S278-L280 VanDerWaalsContact C-N 3.3Å; S278-L280 PolarHBondContact O-N 2.98Å
281	E	23.4	Very low	25.6	Very low	170 Å²	170	127.2 Å²	127.2	79%	0.794	69%	0.689	S	S	*	*			trans	52.3	119.3	178.3	-64.7	-172.3	162.2	0	0	116.4	V279 L283	V279-E281 PolarHBondContact O-N 3.29Å; E281-L283 PolarHBondContact O-N 3.25Å
282	P	26	Very low	25.3	Very low	88 Å²	88	131.8 Å²	131.8	57%	0.571	71%	0.705	S	S	*	*			trans	-60.4	133.6	158.8	-5.6	20.1	0	0	0	107.4	V279 K284	V279-P282 HydrophobicContact CG1-CG 4.5Å; P282-K284 PolarHBondContact O-N 2.98Å
283	L	24.1	Very low	24.8	Very low	173 Å²	173	131 Å²	131	91%	0.906	70%	0.699	S	S	*	*			trans	-54.5	87.8	164.1	-76.1	163.6	0	0	0	108.9	E281	E281-L283 PolarHBondContact O-N 3.25Å
284	K	24.4	Very low	24.4	Very low	172 Å²	172	133.2 Å²	133.2	75%	0.748	70%	0.703	S	S	*	*			trans	-123.5	114.5	160.2	-92.5	-170.2	175.7	179.7	0	108.3	P282	P282-K284 PolarHBondContact O-N 2.98Å
285	K	27	Very low	24	Very low	199 Å²	199	135.5 Å²	135.5	87%	0.865	71%	0.71	S	S	*	*			trans	-31.2	142.1	165.7	-68.6	172.8	172.2	177.6	0	112.7
286	S	30.4	Very low	23.6	Very low	102 Å²	102	133.7 Å²	133.7	71%	0.713	72%	0.716	S	S	*	*	S	Bend	trans	40.2	101.9	156	60.1	0	0	0	0	117.1
287	S	27.1	Very low	23.4	Very low	119 Å²	119	132 Å²	132	83%	0.832	72%	0.721	S	S	*	*	S	Bend	trans	37.5	88	147.7	63.7	0	0	0	0	117.3
288	S	23.9	Very low	23.3	Very low	117 Å²	117	137 Å²	137	82%	0.818	74%	0.743	S	S	*	*			trans	-177.7	128.4	136.4	51.2	0	0	0	0	110.9
289	D	20.9	Very low	23.1	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	76%	0.759	S	S	*	*			trans	-47.6	135.2	-178.8	-61	-61.7	0	0	0	115.3
290	K	22.6	Very low	23	Very low	186 Å²	186	147.1 Å²	147.1	81%	0.809	78%	0.78	S	S	*	*			trans	-173.5	101.8	141.3	-99.7	161.7	-164	-171.3	0	110.4
291	T	20.7	Very low	22.9	Very low	131 Å²	131	146.5 Å²	146.5	80%	0.804	79%	0.789	S	S	*	*			trans	-80.3	131.8	168	33.2	0	0	0	0	110.1
292	F	20.8	Very low	22.9	Very low	188 Å²	188	141.2 Å²	141.2	83%	0.825	77%	0.77	S	S	*	*			trans	-102.4	116.8	167.7	-66.4	-88	0	0	0	108.3
293	I	19.1	Very low	23.3	Very low	134 Å²	134	143.6 Å²	143.6	69%	0.687	78%	0.778	S	S	*	*			trans	-103.5	111.5	177.7	-55	173.8	0	0	0	107.3	Q295	I293-Q295 HydrophobicContact CG2-CG 4.12Å; I293-Q295 PolarHBondContact O-N 3.36Å
294	M	21.7	Very low	23.7	Very low	167 Å²	167	142.6 Å²	142.6	82%	0.823	76%	0.763	S	S	*	*			trans	-77.6	107.1	165.8	-112.4	-172.5	-64.2	0	0	108.4
295	Q	17.3	Very low	24	Very low	185 Å²	185	137 Å²	137	86%	0.864	75%	0.745	S	S	*	*			trans	-101	114.7	171	-94	179.5	-9.8	0	0	109.3	I293	I293-Q295 HydrophobicContact CG2-CG 4.12Å; I293-Q295 PolarHBondContact O-N 3.36Å
296	G	21.3	Very low	24.3	Very low	57 Å²	57	129.2 Å²	129.2	59%	0.588	72%	0.716	S	S	*	*			trans	-172.7	126.8	167.1	0	0	0	0	0	110.1	I298	G296-I298 PolarHBondContact O-N 2.84Å
297	P	20.5	Very low	24.6	Very low	131 Å²	131	128.3 Å²	128.3	85%	0.851	70%	0.699	S	S	*	*			trans	-76.6	115.9	177	29.7	-29.5	0	0	0	109
298	I	24.2	Very low	25.2	Very low	163 Å²	163	124.9 Å²	124.9	84%	0.836	67%	0.671	S	S	*	*			trans	-105.1	91.4	172.8	-56	178.9	0	0	0	107.8	G296	G296-I298 PolarHBondContact O-N 2.84Å
299	E	19.4	Very low	25.9	Very low	177 Å²	177	120.1 Å²	120.1	83%	0.827	64%	0.641	S	S	*	*			trans	-78.9	120.7	161.6	-70.5	-177.9	161.5	0	0	108.6
300	M	24	Very low	26.9	Very low	173 Å²	173	113.9 Å²	113.9	85%	0.852	61%	0.606	S	S	*	*			trans	-178.6	146.2	137.4	-95.1	-162.8	-172.8	0	0	110.6
301	A	21.3	Very low	27.8	Very low	87 Å²	87	106.8 Å²	106.8	72%	0.719	58%	0.582	S	S	*	*			trans	-96.3	105.9	-169.8	0	0	0	0	0	111.3
302	C	24.9	Very low	28.7	Very low	59 Å²	59	101.8 Å²	101.8	40%	0.399	55%	0.55	S	S	.	*	S	Bend	trans	-163	145.2	153.9	-95.8	0	0	0	0	108.5	R304	C302-R304 PolarHBondContact O-N 3.23Å
303	D	33.9	Very low	29.8	Very low	139 Å²	139	94.7 Å²	94.7	74%	0.743	52%	0.52	S	S	*	.			trans	-27.6	97.7	-160.1	-120.4	-29.4	0	0	0	116.9	S305 S306	D303-S305 VanDerWaalsContact C-N 3.35Å; D303-S305 PolarHBondContact O-N 3.33Å; D303-S306 PolarHBondContact O-OG 2.87Å
304	R	31.6	Very low	30.9	Very low	152 Å²	152	88.3 Å²	88.3	57%	0.574	49%	0.488	S	S	*	.	H	α-helix	trans	-72.6	-16.3	-159.8	-69.4	178.3	173.6	175.2	-2.2	115.7	C302	C302-R304 PolarHBondContact O-N 3.23Å
305	S	30.6	Very low	32	Very low	54 Å²	54	81.3 Å²	81.3	38%	0.378	45%	0.454	S	S	.	.	H	α-helix	trans	-85.9	-31.5	-168.7	68.5	0	0	0	0	114.7	R253 D303 G309	R253-S305 PolarHBondContact NH1-OG 3.23Å; D303-S305 VanDerWaalsContact C-N 3.35Å; D303-S305 PolarHBondContact O-N 3.33Å; S305-G309 PolarHBondContact O-N 3.39Å
306	S	34.5	Very low	33	Very low	36 Å²	36	74.5 Å²	74.5	25%	0.252	43%	0.429	S	S	.	.	H	α-helix	trans	-69.5	-43.9	176	44.2	0	0	0	0	111	D303 L308 G309 F310	D303-S306 PolarHBondContact O-OG 2.87Å; S306-L308 VanDerWaalsContact C-N 3.29Å; S306-L308 PolarHBondContact O-N 3.46Å; S306-G309 PolarHBondContact O-N 2.84Å; S306-G309 VanDerWaalsContact O-N 3.12Å; S306-F310 VanDerWaalsContact O-CD2 3.27Å; S306-F310 WeakPolarHBondContact O-CD2 3.47Å; S306-F310 PolarHBondContact O-N 3.47Å
307	K	36.6	Very low	33.8	Very low	82 Å²	82	72.4 Å²	72.4	36%	0.357	40%	0.404	S	S	.	.	H	α-helix	trans	-55.8	-41.5	178.7	-70	-175.2	178.3	-175.7	0	113.3	A311 L338	K307-A311 PolarHBondContact O-N 3.01Å; K307-A311 VanDerWaalsContact O-N 3.11Å; K307-L338 HydrophobicContact CB-CD1 4.09Å; K307-L338 HydrophobicContact CB-CD2 4.36Å; K307-L338 HydrophobicContact CG-CB 4.42Å; K307-L338 HydrophobicContact CG-CD1 4.01Å; K307-L338 HydrophobicContact CG-CD2 3.81Å; K307-L338 HydrophobicContact CG-CG 4.32Å
308	L	38.5	Very low	34.5	Very low	48 Å²	48	66.2 Å²	66.2	25%	0.251	36%	0.364	S	S	.	.	H	α-helix	trans	-68.6	-40.9	177.9	-175.1	69.6	0	0	0	112.6	L270 S306 F310 A311 L312	L270-L308 HydrophobicContact CD1-CD2 3.83Å; L270-L308 HydrophobicContact CD2-CD2 3.54Å; L270-L308 HydrophobicContact CG-CD2 4.18Å; S306-L308 VanDerWaalsContact C-N 3.29Å; S306-L308 PolarHBondContact O-N 3.46Å; L308-F310 VanDerWaalsContact C-N 3.31Å; L308-F310 PolarHBondContact O-N 3.4Å; L308-A311 PolarHBondContact O-N 3.12Å; L308-L312 HydrophobicContact CD1-CD1 4.21Å; L308-L312 HydrophobicContact CD1-CG 4.43Å; L308-L312 HydrophobicContact CD2-CD1 4.36Å; L308-L312 HydrophobicContact CG-CD1 3.84Å; L308-L312 HydrophobicContact CG-CG 4.44Å; L308-L312 WeakPolarHBondContact O-CB 3.32Å; L308-L312 WeakPolarHBondContact O-CG 2.94Å; L308-L312 PolarHBondContact O-N 3.02Å
309	G	39.8	Very low	35.2	Very low	17 Å²	17	62.7 Å²	62.7	18%	0.175	34%	0.343	C	S	.	.	H	α-helix	trans	-58.5	-41.2	179	0	0	0	0	0	112.9	S305 S306 L313	S305-G309 PolarHBondContact O-N 3.39Å; S306-G309 PolarHBondContact O-N 2.84Å; S306-G309 VanDerWaalsContact O-N 3.12Å; G309-L313 PolarHBondContact O-N 2.82Å
310	F	40.8	Very low	36	Very low	26 Å²	26	56.5 Å²	56.5	11%	0.114	32%	0.319	C	S	.	.	H	α-helix	trans	-77.4	-34.6	176.3	-71.5	-82.8	0	0	0	113.3	S306 L308 L312 L313 A314 L334 L338	S306-F310 VanDerWaalsContact O-CD2 3.27Å; S306-F310 WeakPolarHBondContact O-CD2 3.47Å; S306-F310 PolarHBondContact O-N 3.47Å; L308-F310 VanDerWaalsContact C-N 3.31Å; L308-F310 PolarHBondContact O-N 3.4Å; F310-L312 PolarHBondContact O-N 3.23Å; F310-L313 HydrophobicContact CD1-CD2 4.35Å; F310-L313 PolarHBondContact O-N 3.47Å; F310-A314 WeakPolarHBondContact O-CB 3.36Å; F310-A314 PolarHBondContact O-N 3.35Å; F310-L334 HydrophobicContact CB-CB 4.39Å; F310-L334 HydrophobicContact CD1-CD2 3.93Å; F310-L338 HydrophobicContact CB-CD1 3.78Å; F310-L338 HydrophobicContact CB-CG 4.31Å; F310-L338 HydrophobicContact CD2-CD1 4.18Å; F310-L338 HydrophobicContact CD2-CD2 3.61Å; F310-L338 HydrophobicContact CD2-CG 3.88Å; F310-L338 HydrophobicContact CE2-CD2 4.03Å; F310-L338 HydrophobicContact CG-CD1 4.27Å; F310-L338 HydrophobicContact CG-CD2 4.47Å; F310-L338 HydrophobicContact CG-CG 4.27Å
311	A	42.5	Very low	36.4	Very low	37 Å²	37	53.6 Å²	53.6	31%	0.306	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-36.6	171.3	0	0	0	0	0	111.3	K307 L308 A314 D315	K307-A311 PolarHBondContact O-N 3.01Å; K307-A311 VanDerWaalsContact O-N 3.11Å; L308-A311 PolarHBondContact O-N 3.12Å; A311-A314 WeakPolarHBondContact O-CB 3.36Å; A311-A314 PolarHBondContact O-N 3.33Å; A311-D315 WeakPolarHBondContact O-CB 3.5Å; A311-D315 PolarHBondContact O-N 3.44Å
312	L	40.6	Very low	37	Very low	25 Å²	25	52.7 Å²	52.7	13%	0.131	30%	0.303	C	S	.	.	H	α-helix	trans	-74.5	-34.5	175	-71.5	169.3	0	0	0	112.7	F257 Y268 L308 F310 D315 A316	F257-L312 HydrophobicContact CE1-CD1 3.56Å; F257-L312 HydrophobicContact CZ-CD1 3.31Å; Y268-L312 HydrophobicContact CD1-CD2 4.34Å; Y268-L312 HydrophobicContact CE1-CD2 4.15Å; L308-L312 HydrophobicContact CD1-CD1 4.21Å; L308-L312 HydrophobicContact CD1-CG 4.43Å; L308-L312 HydrophobicContact CD2-CD1 4.36Å; L308-L312 HydrophobicContact CG-CD1 3.84Å; L308-L312 HydrophobicContact CG-CG 4.44Å; L308-L312 WeakPolarHBondContact O-CB 3.32Å; L308-L312 WeakPolarHBondContact O-CG 2.94Å; L308-L312 PolarHBondContact O-N 3.02Å; F310-L312 PolarHBondContact O-N 3.23Å; L312-D315 PolarHBondContact O-N 3.47Å; L312-A316 VanDerWaalsContact O-CB 3.26Å; L312-A316 WeakPolarHBondContact O-CB 3.43Å; L312-A316 PolarHBondContact O-N 3Å
313	L	42.1	Very low	37.5	Very low	39 Å²	39	52.2 Å²	52.2	20%	0.204	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-44.8	168.5	179.9	61.5	0	0	0	111	W256 G309 F310 D315 A316 I317	W256-L313 HydrophobicContact CH2-CB 4.18Å; W256-L313 HydrophobicContact CH2-CD1 3.75Å; W256-L313 HydrophobicContact CH2-CD2 4.3Å; W256-L313 HydrophobicContact CH2-CG 4.29Å; W256-L313 HydrophobicContact CZ2-CD1 3.85Å; W256-L313 HydrophobicContact CZ3-CB 4.45Å; G309-L313 PolarHBondContact O-N 2.82Å; F310-L313 HydrophobicContact CD1-CD2 4.35Å; F310-L313 PolarHBondContact O-N 3.47Å; L313-D315 VanDerWaalsContact C-N 3.32Å; L313-D315 PolarHBondContact O-N 3.27Å; L313-A316 PolarHBondContact O-N 2.92Å; L313-I317 HydrophobicContact CD1-CD1 4.19Å; L313-I317 HydrophobicContact CD1-CG1 4.38Å; L313-I317 HydrophobicContact CG-CD1 3.98Å; L313-I317 VanDerWaalsContact O-CG1 3.23Å; L313-I317 WeakPolarHBondContact O-CG1 3.45Å; L313-I317 PolarHBondContact O-N 3.5Å
314	A	43.5	Very low	37.8	Very low	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-55.6	-49.6	174.7	0	0	0	0	0	110.7	F310 A311 I317 A318 A326 V330 R331 L334	F310-A314 WeakPolarHBondContact O-CB 3.36Å; F310-A314 PolarHBondContact O-N 3.35Å; A311-A314 WeakPolarHBondContact O-CB 3.36Å; A311-A314 PolarHBondContact O-N 3.33Å; A314-I317 PolarHBondContact O-N 2.88Å; A314-A318 PolarHBondContact O-N 2.94Å; A314-A326 HydrophobicContact CB-CB 3.95Å; A314-A326 VanDerWaalsContact O-CB 3.23Å; A314-A326 WeakPolarHBondContact O-CB 3.41Å; A314-V330 HydrophobicContact CB-CG1 4.49Å; A314-R331 HydrophobicContact CB-CG 4.02Å; A314-L334 HydrophobicContact CB-CD1 3.32Å
315	D	43.9	Very low	38.1	Very low	21 Å²	21	48.1 Å²	48.1	11%	0.112	29%	0.288	C	S	.	.	H	α-helix	trans	-68.2	-33	-179.1	-162.8	61.6	0	0	0	112.7	A311 L312 L313 A318 K319	A311-D315 WeakPolarHBondContact O-CB 3.5Å; A311-D315 PolarHBondContact O-N 3.44Å; L312-D315 PolarHBondContact O-N 3.47Å; L313-D315 VanDerWaalsContact C-N 3.32Å; L313-D315 PolarHBondContact O-N 3.27Å; D315-A318 VanDerWaalsContact O-CB 3.31Å; D315-A318 WeakPolarHBondContact O-CB 3.49Å; D315-A318 PolarHBondContact O-N 2.89Å; D315-K319 WeakPolarHBondContact O-CB 3.44Å; D315-K319 WeakPolarHBondContact O-CG 3.31Å; D315-K319 PolarHBondContact O-N 2.79Å; D315-K319 VanDerWaalsContact OD2-CE 3.27Å; D315-K319 WeakPolarHBondContact OD2-CE 3.36Å; D315-K319 IonicContact OD2-NZ 3.3Å; D315-K319 PolarHBondContact OD2-NZ 2.81Å
316	A	39.2	Very low	38.6	Very low	42 Å²	42	45.8 Å²	45.8	35%	0.347	27%	0.271	S	S	.	.	H	α-helix	trans	-67.5	-42.2	173.1	0	0	0	0	0	111.8	L312 L313 A318 K319 S320	L312-A316 VanDerWaalsContact O-CB 3.26Å; L312-A316 WeakPolarHBondContact O-CB 3.43Å; L312-A316 PolarHBondContact O-N 3Å; L313-A316 PolarHBondContact O-N 2.92Å; A316-A318 VanDerWaalsContact C-N 3.33Å; A316-K319 PolarHBondContact O-N 2.82Å; A316-S320 PolarHBondContact O-N 3.27Å
317	I	38	Very low	38.8	Very low	13 Å²	13	45.8 Å²	45.8	7%	0.067	27%	0.271	C	S	.	.	H	α-helix	trans	-61.2	-44	172.9	-67.3	164.8	0	0	0	109.8	W39 Y50 L313 A314 K319 S320 H321	W39-I317 HydrophobicContact CH2-CD1 4.36Å; W39-I317 HydrophobicContact CZ2-CG2 4.15Å; Y50-I317 HydrophobicContact CE1-CG1 4.06Å; L313-I317 HydrophobicContact CD1-CD1 4.19Å; L313-I317 HydrophobicContact CD1-CG1 4.38Å; L313-I317 HydrophobicContact CG-CD1 3.98Å; L313-I317 VanDerWaalsContact O-CG1 3.23Å; L313-I317 WeakPolarHBondContact O-CG1 3.45Å; L313-I317 PolarHBondContact O-N 3.5Å; A314-I317 PolarHBondContact O-N 2.88Å; I317-K319 PolarHBondContact O-N 2.95Å; I317-S320 PolarHBondContact O-N 3.18Å; I317-S320 PolarHBondContact O-OG 3.38Å; I317-H321 PolarHBondContact O-CD2 3.43Å; I317-H321 VanDerWaalsContact O-CD2 3.24Å; I317-H321 PolarHBondContact O-N 3.15Å
318	A	35.5	Very low	38.9	Very low	1 Å²	1	47.3 Å²	47.3	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-54.8	-52.2	175.5	0	0	0	0	0	113.2	A314 D315 A316 S320 H321 G322 T323 E325 A326	A314-A318 PolarHBondContact O-N 2.94Å; D315-A318 VanDerWaalsContact O-CB 3.31Å; D315-A318 WeakPolarHBondContact O-CB 3.49Å; D315-A318 PolarHBondContact O-N 2.89Å; A316-A318 VanDerWaalsContact C-N 3.33Å; A318-S320 VanDerWaalsContact C-N 3.3Å; A318-S320 PolarHBondContact O-N 2.64Å; A318-H321 CarbonylContact O-C 3.6Å; A318-H321 PolarHBondContact O-N 3.33Å; A318-H321 VanDerWaalsContact O-N 3.15Å; A318-G322 PolarHBondContact O-N 2.93Å; A318-T323 CarbonylContact C-O 3.58Å; A318-T323 VanDerWaalsContact C-O 3.31Å; A318-T323 WeakPolarHBondContact CA-OG1 3.26Å; A318-T323 PolarHBondContact O-N 3.37Å; A318-T323 VanDerWaalsContact O-O 3.11Å; A318-T323 PolarHBondContact O-OG1 2.77Å; A318-E325 WeakPolarHBondContact CB-O 3.12Å; A318-A326 HydrophobicContact CB-CB 3.86Å
319	K	38.9	Very low	38.7	Very low	88 Å²	88	47 Å²	47	38%	0.383	29%	0.285	S	S	.	.	H	α-helix	trans	-66	-33.1	-177.2	-75	168.5	176.4	160.2	0	111.9	D315 A316 I317 H321 G322	D315-K319 WeakPolarHBondContact O-CB 3.44Å; D315-K319 WeakPolarHBondContact O-CG 3.31Å; D315-K319 PolarHBondContact O-N 2.79Å; D315-K319 VanDerWaalsContact OD2-CE 3.27Å; D315-K319 WeakPolarHBondContact OD2-CE 3.36Å; D315-K319 IonicContact OD2-NZ 3.3Å; D315-K319 PolarHBondContact OD2-NZ 2.81Å; A316-K319 PolarHBondContact O-N 2.82Å; I317-K319 PolarHBondContact O-N 2.95Å; K319-H321 VanDerWaalsContact C-N 3.31Å; K319-G322 PolarHBondContact O-N 3.43Å
320	S	34.8	Very low	38.5	Very low	47 Å²	47	46.8 Å²	46.8	33%	0.329	28%	0.28	S	S	.	.	H	α-helix	trans	-68.3	-32	175.8	71.3	0	0	0	0	112.2	Y50 A316 I317 A318 G322	Y50-S320 PolarHBondContact OH-OG 3.42Å; A316-S320 PolarHBondContact O-N 3.27Å; I317-S320 PolarHBondContact O-N 3.18Å; I317-S320 PolarHBondContact O-OG 3.38Å; A318-S320 VanDerWaalsContact C-N 3.3Å; A318-S320 PolarHBondContact O-N 2.64Å; S320-G322 VanDerWaalsContact C-N 3.26Å; S320-G322 PolarHBondContact O-N 3.17Å
321	H	33.1	Very low	38.5	Very low	113 Å²	113	48.2 Å²	48.2	52%	0.523	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	6.8	172.8	-74.4	-79.7	0	0	0	114	I317 A318 K319 T323	I317-H321 PolarHBondContact O-CD2 3.43Å; I317-H321 VanDerWaalsContact O-CD2 3.24Å; I317-H321 PolarHBondContact O-N 3.15Å; A318-H321 CarbonylContact O-C 3.6Å; A318-H321 PolarHBondContact O-N 3.33Å; A318-H321 VanDerWaalsContact O-N 3.15Å; K319-H321 VanDerWaalsContact C-N 3.31Å; H321-T323 PolarHBondContact O-N 3.18Å
322	G	34.6	Very low	38.3	Very low	68 Å²	68	51 Å²	51	70%	0.701	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	9	179.9	0	0	0	0	0	114.2	A318 K319 S320	A318-G322 PolarHBondContact O-N 2.93Å; K319-G322 PolarHBondContact O-N 3.43Å; S320-G322 VanDerWaalsContact C-N 3.26Å; S320-G322 PolarHBondContact O-N 3.17Å
323	T	35.7	Very low	38.2	Very low	49 Å²	49	52.6 Å²	52.6	30%	0.301	30%	0.302	S	S	.	.			trans	-87.2	144.3	172.5	67.8	0	0	0	0	110	A318 H321 E325	A318-T323 CarbonylContact C-O 3.58Å; A318-T323 VanDerWaalsContact C-O 3.31Å; A318-T323 WeakPolarHBondContact CA-OG1 3.26Å; A318-T323 PolarHBondContact O-N 3.37Å; A318-T323 VanDerWaalsContact O-O 3.11Å; A318-T323 PolarHBondContact O-OG1 2.77Å; H321-T323 PolarHBondContact O-N 3.18Å; T323-E325 VanDerWaalsContact C-N 3.26Å; T323-E325 WeakPolarHBondContact CB-O 3.31Å; T323-E325 PolarHBondContact O-N 2.96Å; T323-E325 PolarHBondContact OG1-O 2.8Å
324	V	38.2	Very low	38.1	Very low	104 Å²	104	51.5 Å²	51.5	63%	0.63	30%	0.296	S	S	*	.	S	Bend	trans	-70.9	-28.5	-178.4	-179.9	0	0	0	0	111.2
325	E	38.6	Very low	37.9	Very low	101 Å²	101	55.3 Å²	55.3	47%	0.472	32%	0.316	S	S	.	.	S	Bend	trans	-138.9	152.8	177.6	-63.9	-165.8	109.8	0	0	109.5	A318 T323 R331	A318-E325 WeakPolarHBondContact CB-O 3.12Å; T323-E325 VanDerWaalsContact C-N 3.26Å; T323-E325 WeakPolarHBondContact CB-O 3.31Å; T323-E325 PolarHBondContact O-N 2.96Å; T323-E325 PolarHBondContact OG1-O 2.8Å; E325-R331 IonicContact OE1-CZ 3.58Å; E325-R331 IonicContact OE1-NH1 3.69Å; E325-R331 PolarHBondContact OE1-NH1 3.05Å; E325-R331 IonicContact OE1-NH2 2.64Å; E325-R331 PolarHBondContact OE1-NH2 3.42Å; E325-R331 IonicContact OE2-NH1 3.12Å
326	A	41.3	Very low	37.5	Very low	4 Å²	4	57.8 Å²	57.8	3%	0.033	33%	0.326	C	S	.	.			trans	-62.3	141.6	175.1	0	0	0	0	0	107.3	A314 A318 D328 V330 R331	A314-A326 HydrophobicContact CB-CB 3.95Å; A314-A326 VanDerWaalsContact O-CB 3.23Å; A314-A326 WeakPolarHBondContact O-CB 3.41Å; A318-A326 HydrophobicContact CB-CB 3.86Å; A326-D328 PolarHBondContact O-N 3.13Å; A326-V330 HydrophobicContact CB-CB 4.4Å; A326-V330 HydrophobicContact CB-CG1 4.47Å; A326-R331 HydrophobicContact CB-CG 4.03Å
327	P	39.1	Very low	37.4	Very low	37 Å²	37	57.9 Å²	57.9	24%	0.24	32%	0.32	C	S	.	.			trans	-48	135.5	167.4	-23.5	32.4	0	0	0	109	S329 V330 R331	P327-S329 PolarHBondContact O-N 2.78Å; P327-V330 HydrophobicContact CB-CG2 4.28Å; P327-V330 HydrophobicContact CG-CG2 4.23Å; P327-V330 PolarHBondContact O-N 3.02Å; P327-R331 PolarHBondContact O-N 3.28Å; P327-R331 VanDerWaalsContact O-N 3.09Å
328	D	38.4	Very low	37.3	Very low	113 Å²	113	57.4 Å²	57.4	60%	0.604	32%	0.318	S	S	*	.	H	α-helix	trans	-54	-28.8	-179.1	-74.2	-30.5	0	0	0	111.3	A326 R331 L332	A326-D328 PolarHBondContact O-N 3.13Å; D328-R331 PolarHBondContact O-N 2.89Å; D328-L332 HydrophobicContact CB-CD1 4.47Å; D328-L332 WeakPolarHBondContact O-CA 3.34Å; D328-L332 WeakPolarHBondContact O-CB 3.45Å; D328-L332 WeakPolarHBondContact O-CD1 3.49Å; D328-L332 WeakPolarHBondContact O-CG 3.36Å; D328-L332 PolarHBondContact O-N 2.91Å
329	S	33.3	Very low	37.2	Very low	43 Å²	43	63.5 Å²	63.5	30%	0.301	35%	0.347	S	S	.	.	H	α-helix	trans	-60.8	-41.2	171.5	54.4	0	0	0	0	114	P327 L333	P327-S329 PolarHBondContact O-N 2.78Å; S329-L333 WeakPolarHBondContact O-CB 3.39Å; S329-L333 PolarHBondContact O-N 3.26Å
330	V	36	Very low	36.8	Very low	11 Å²	11	61.6 Å²	61.6	7%	0.067	34%	0.339	C	S	.	.	H	α-helix	trans	-73.1	-42.3	177.3	176.1	0	0	0	0	110.3	A314 A326 P327 L333 L334	A314-V330 HydrophobicContact CB-CG1 4.49Å; A326-V330 HydrophobicContact CB-CB 4.4Å; A326-V330 HydrophobicContact CB-CG1 4.47Å; P327-V330 HydrophobicContact CB-CG2 4.28Å; P327-V330 HydrophobicContact CG-CG2 4.23Å; P327-V330 PolarHBondContact O-N 3.02Å; V330-L333 PolarHBondContact O-N 3.18Å; V330-L334 HydrophobicContact CG1-CD1 3.81Å; V330-L334 WeakPolarHBondContact O-CB 3.43Å; V330-L334 WeakPolarHBondContact O-CD1 3.49Å; V330-L334 WeakPolarHBondContact O-CG 3.27Å; V330-L334 PolarHBondContact O-N 3.3Å
331	R	41.1	Very low	36.5	Very low	56 Å²	56	61.9 Å²	61.9	21%	0.211	34%	0.341	C	S	.	.	H	α-helix	trans	-60.3	-46.5	173.5	-104.5	170.6	169	175.2	0.8	111.2	A314 E325 A326 P327 D328 L334 L335	A314-R331 HydrophobicContact CB-CG 4.02Å; E325-R331 IonicContact OE1-CZ 3.58Å; E325-R331 IonicContact OE1-NH1 3.69Å; E325-R331 PolarHBondContact OE1-NH1 3.05Å; E325-R331 IonicContact OE1-NH2 2.64Å; E325-R331 PolarHBondContact OE1-NH2 3.42Å; E325-R331 IonicContact OE2-NH1 3.12Å; A326-R331 HydrophobicContact CB-CG 4.03Å; P327-R331 PolarHBondContact O-N 3.28Å; P327-R331 VanDerWaalsContact O-N 3.09Å; D328-R331 PolarHBondContact O-N 2.89Å; R331-L334 PolarHBondContact O-N 2.83Å; R331-L335 VanDerWaalsContact O-CB 3.24Å; R331-L335 WeakPolarHBondContact O-CB 3.24Å; R331-L335 WeakPolarHBondContact O-CG 3.14Å; R331-L335 PolarHBondContact O-N 3.13Å
332	L	38.3	Very low	36.1	Very low	95 Å²	95	58.5 Å²	58.5	50%	0.497	33%	0.328	S	S	.	.	H	α-helix	trans	-69.7	-39	178.1	-74.3	167.4	0	0	0	111.8	D328 L334 L335 F336	D328-L332 HydrophobicContact CB-CD1 4.47Å; D328-L332 WeakPolarHBondContact O-CA 3.34Å; D328-L332 WeakPolarHBondContact O-CB 3.45Å; D328-L332 WeakPolarHBondContact O-CD1 3.49Å; D328-L332 WeakPolarHBondContact O-CG 3.36Å; D328-L332 PolarHBondContact O-N 2.91Å; L332-L334 VanDerWaalsContact C-N 3.34Å; L332-L334 PolarHBondContact O-N 3.48Å; L332-L335 CarbonylContact O-C 3.31Å; L332-L335 PolarHBondContact O-N 3.26Å; L332-F336 WeakPolarHBondContact O-CA 3.02Å; L332-F336 WeakPolarHBondContact O-CB 3.34Å; L332-F336 PolarHBondContact O-N 3.28Å
333	L	38.4	Very low	35.7	Very low	60 Å²	60	58.3 Å²	58.3	31%	0.314	31%	0.313	S	S	.	.	H	α-helix	trans	-61.3	-45.8	173.6	-178.5	67	0	0	0	110.1	S329 V330 F336 L337	S329-L333 WeakPolarHBondContact O-CB 3.39Å; S329-L333 PolarHBondContact O-N 3.26Å; V330-L333 PolarHBondContact O-N 3.18Å; L333-F336 PolarHBondContact O-N 2.8Å; L333-L337 HydrophobicContact CD1-CD1 4.42Å; L333-L337 HydrophobicContact CD1-CG 4.44Å; L333-L337 HydrophobicContact CG-CD1 4.03Å; L333-L337 HydrophobicContact CG-CG 4.46Å; L333-L337 VanDerWaalsContact O-CB 3.27Å; L333-L337 WeakPolarHBondContact O-CB 3.39Å; L333-L337 WeakPolarHBondContact O-CD1 3.22Å; L333-L337 WeakPolarHBondContact O-CG 3.43Å; L333-L337 PolarHBondContact O-N 3.37Å
334	L	40.2	Very low	35.1	Very low	15 Å²	15	59.9 Å²	59.9	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-67.8	-39.6	178.1	-69.2	166.5	0	0	0	112	F310 A314 V330 R331 L332 L338	F310-L334 HydrophobicContact CB-CB 4.39Å; F310-L334 HydrophobicContact CD1-CD2 3.93Å; A314-L334 HydrophobicContact CB-CD1 3.32Å; V330-L334 HydrophobicContact CG1-CD1 3.81Å; V330-L334 WeakPolarHBondContact O-CB 3.43Å; V330-L334 WeakPolarHBondContact O-CD1 3.49Å; V330-L334 WeakPolarHBondContact O-CG 3.27Å; V330-L334 PolarHBondContact O-N 3.3Å; R331-L334 PolarHBondContact O-N 2.83Å; L332-L334 VanDerWaalsContact C-N 3.34Å; L332-L334 PolarHBondContact O-N 3.48Å; L334-L338 WeakPolarHBondContact O-CB 3.32Å; L334-L338 WeakPolarHBondContact O-CD1 3.15Å; L334-L338 VanDerWaalsContact O-CG 3.28Å; L334-L338 WeakPolarHBondContact O-CG 3.49Å; L334-L338 PolarHBondContact O-N 2.64Å
335	L	39.8	Very low	34.4	Very low	80 Å²	80	58.1 Å²	58.1	42%	0.419	32%	0.323	S	S	.	.	H	α-helix	trans	-68.7	-34	173.1	-74.3	169.6	0	0	0	112.8	R331 L332 L338 E339	R331-L335 VanDerWaalsContact O-CB 3.24Å; R331-L335 WeakPolarHBondContact O-CB 3.24Å; R331-L335 WeakPolarHBondContact O-CG 3.14Å; R331-L335 PolarHBondContact O-N 3.13Å; L332-L335 CarbonylContact O-C 3.31Å; L332-L335 PolarHBondContact O-N 3.26Å; L335-L338 HydrophobicContact CD2-CD1 4.17Å; L335-L338 CarbonylContact O-C 3.58Å; L335-L338 VanDerWaalsContact O-CB 3.27Å; L335-L338 WeakPolarHBondContact O-CB 3.42Å; L335-L338 PolarHBondContact O-N 3.43Å; L335-E339 WeakPolarHBondContact O-CB 3.08Å; L335-E339 PolarHBondContact O-N 3.19Å
336	F	36.3	Very low	33.6	Very low	74 Å²	74	60.4 Å²	60.4	33%	0.325	33%	0.333	S	S	.	.	H	α-helix	trans	-71.7	-45.3	175.8	176.5	-99.4	0	0	0	110.4	L332 L333 L338 E339 Q340	L332-F336 WeakPolarHBondContact O-CA 3.02Å; L332-F336 WeakPolarHBondContact O-CB 3.34Å; L332-F336 PolarHBondContact O-N 3.28Å; L333-F336 PolarHBondContact O-N 2.8Å; F336-L338 PolarHBondContact O-N 3.32Å; F336-E339 PolarHBondContact O-N 2.67Å; F336-Q340 HydrophobicContact CD1-CG 4.36Å; F336-Q340 HydrophobicContact CD2-CG 4.44Å; F336-Q340 HydrophobicContact CE1-CG 4.06Å; F336-Q340 HydrophobicContact CE2-CG 4.15Å; F336-Q340 HydrophobicContact CZ-CG 3.94Å; F336-Q340 WeakPolarHBondContact O-CB 3.38Å; F336-Q340 VanDerWaalsContact O-CG 3.23Å; F336-Q340 WeakPolarHBondContact O-CG 3.43Å; F336-Q340 PolarHBondContact O-N 2.92Å
337	L	35.1	Very low	32.7	Very low	43 Å²	43	67.1 Å²	67.1	23%	0.225	36%	0.364	C	S	.	.	H	α-helix	trans	-57.4	-32.3	171.2	-71.7	169.5	0	0	0	111.5	L333 S341	L333-L337 HydrophobicContact CD1-CD1 4.42Å; L333-L337 HydrophobicContact CD1-CG 4.44Å; L333-L337 HydrophobicContact CG-CD1 4.03Å; L333-L337 HydrophobicContact CG-CG 4.46Å; L333-L337 VanDerWaalsContact O-CB 3.27Å; L333-L337 WeakPolarHBondContact O-CB 3.39Å; L333-L337 WeakPolarHBondContact O-CD1 3.22Å; L333-L337 WeakPolarHBondContact O-CG 3.43Å; L333-L337 PolarHBondContact O-N 3.37Å; L337-S341 PolarHBondContact O-N 3.35Å
338	L	36.5	Very low	32	Very low	4 Å²	4	71.2 Å²	71.2	2%	0.021	38%	0.38	C	S	.	.	H	α-helix	trans	-75.3	-45.7	172.2	-84.2	162.7	0	0	0	113.9	K307 F310 L334 L335 F336 Q340 S341 V342	K307-L338 HydrophobicContact CB-CD1 4.09Å; K307-L338 HydrophobicContact CB-CD2 4.36Å; K307-L338 HydrophobicContact CG-CB 4.42Å; K307-L338 HydrophobicContact CG-CD1 4.01Å; K307-L338 HydrophobicContact CG-CD2 3.81Å; K307-L338 HydrophobicContact CG-CG 4.32Å; F310-L338 HydrophobicContact CB-CD1 3.78Å; F310-L338 HydrophobicContact CB-CG 4.31Å; F310-L338 HydrophobicContact CD2-CD1 4.18Å; F310-L338 HydrophobicContact CD2-CD2 3.61Å; F310-L338 HydrophobicContact CD2-CG 3.88Å; F310-L338 HydrophobicContact CE2-CD2 4.03Å; F310-L338 HydrophobicContact CG-CD1 4.27Å; F310-L338 HydrophobicContact CG-CD2 4.47Å; F310-L338 HydrophobicContact CG-CG 4.27Å; L334-L338 WeakPolarHBondContact O-CB 3.32Å; L334-L338 WeakPolarHBondContact O-CD1 3.15Å; L334-L338 VanDerWaalsContact O-CG 3.28Å; L334-L338 WeakPolarHBondContact O-CG 3.49Å; L334-L338 PolarHBondContact O-N 2.64Å; L335-L338 HydrophobicContact CD2-CD1 4.17Å; L335-L338 CarbonylContact O-C 3.58Å; L335-L338 VanDerWaalsContact O-CB 3.27Å; L335-L338 WeakPolarHBondContact O-CB 3.42Å; L335-L338 PolarHBondContact O-N 3.43Å; F336-L338 PolarHBondContact O-N 3.32Å; L338-Q340 VanDerWaalsContact C-N 3.27Å; L338-Q340 PolarHBondContact O-N 3.21Å; L338-S341 WeakPolarHBondContact O-CA 3.15Å; L338-S341 WeakPolarHBondContact O-CB 3.49Å; L338-S341 PolarHBondContact O-N 3.22Å; L338-S341 PolarHBondContact O-OG 3.14Å; L338-V342 PolarHBondContact O-N 3.06Å
339	E	34.4	Very low	31.3	Very low	129 Å²	129	73.3 Å²	73.3	60%	0.603	40%	0.396	S	S	*	.	H	α-helix	trans	-64.8	-37.5	-179.6	-161.7	168.7	-159.3	0	0	110.5	L335 F336 S341 V342 V343	L335-E339 WeakPolarHBondContact O-CB 3.08Å; L335-E339 PolarHBondContact O-N 3.19Å; F336-E339 PolarHBondContact O-N 2.67Å; E339-S341 PolarHBondContact O-N 3.18Å; E339-V342 WeakPolarHBondContact O-CB 3.36Å; E339-V342 PolarHBondContact O-N 3.3Å; E339-V342 VanDerWaalsContact O-N 3.09Å; E339-V343 PolarHBondContact O-N 2.99Å
340	Q	29.4	Very low	30.8	Very low	47 Å²	47	73.2 Å²	73.2	22%	0.22	40%	0.402	C	S	.	.	H	α-helix	trans	-67	-20.2	171.6	-67	-66.8	-33.9	0	0	113.6	F336 L338 E395	F336-Q340 HydrophobicContact CD1-CG 4.36Å; F336-Q340 HydrophobicContact CD2-CG 4.44Å; F336-Q340 HydrophobicContact CE1-CG 4.06Å; F336-Q340 HydrophobicContact CE2-CG 4.15Å; F336-Q340 HydrophobicContact CZ-CG 3.94Å; F336-Q340 WeakPolarHBondContact O-CB 3.38Å; F336-Q340 VanDerWaalsContact O-CG 3.23Å; F336-Q340 WeakPolarHBondContact O-CG 3.43Å; F336-Q340 PolarHBondContact O-N 2.92Å; L338-Q340 VanDerWaalsContact C-N 3.27Å; L338-Q340 PolarHBondContact O-N 3.21Å; Q340-E395 PolarHBondContact NE2-OE1 2.72Å
341	S	28.3	Very low	30.2	Very low	54 Å²	54	78.2 Å²	78.2	38%	0.378	44%	0.438	S	S	.	.	H	α-helix	trans	-76.8	-24.9	171.9	72.6	0	0	0	0	113	L337 L338 E339 G345	L337-S341 PolarHBondContact O-N 3.35Å; L338-S341 WeakPolarHBondContact O-CA 3.15Å; L338-S341 WeakPolarHBondContact O-CB 3.49Å; L338-S341 PolarHBondContact O-N 3.22Å; L338-S341 PolarHBondContact O-OG 3.14Å; E339-S341 PolarHBondContact O-N 3.18Å; S341-G345 PolarHBondContact O-N 3.19Å
342	V	26.4	Very low	29.2	Very low	41 Å²	41	80.7 Å²	80.7	25%	0.248	46%	0.464	C	S	.	.	H	α-helix	trans	-73.3	-40	174.5	-178.4	0	0	0	0	110.8	L338 E339 L344 G345 E346	L338-V342 PolarHBondContact O-N 3.06Å; E339-V342 WeakPolarHBondContact O-CB 3.36Å; E339-V342 PolarHBondContact O-N 3.3Å; E339-V342 VanDerWaalsContact O-N 3.09Å; V342-L344 VanDerWaalsContact C-N 3.31Å; V342-L344 PolarHBondContact O-N 2.92Å; V342-G345 PolarHBondContact O-N 3.35Å; V342-E346 PolarHBondContact O-N 2.9Å; V342-E346 VanDerWaalsContact O-N 3.08Å
343	V	24.7	Very low	28.5	Very low	65 Å²	65	81.4 Å²	81.4	39%	0.394	47%	0.474	S	S	.	.	H	α-helix	trans	-66.2	-30.8	-178.3	-178.6	0	0	0	0	112.7	E339 Q347	E339-V343 PolarHBondContact O-N 2.99Å; V343-Q347 PolarHBondContact O-N 2.94Å
344	L	24	Very low	27.8	Very low	81 Å²	81	84.2 Å²	84.2	42%	0.424	50%	0.496	S	S	.	.	H	α-helix	trans	-83.8	-18.8	173	-76.9	166.5	0	0	0	113.5	V342	V342-L344 VanDerWaalsContact C-N 3.31Å; V342-L344 PolarHBondContact O-N 2.92Å
345	G	23.2	Very low	26.9	Very low	68 Å²	68	89.2 Å²	89.2	70%	0.701	53%	0.527	S	S	*	.	H	α-helix	trans	-75.4	-30.2	171.4	0	0	0	0	0	113.1	S341 V342 Q347	S341-G345 PolarHBondContact O-N 3.19Å; V342-G345 PolarHBondContact O-N 3.35Å; G345-Q347 VanDerWaalsContact C-N 3.35Å
346	E	22.3	Very low	25.9	Very low	149 Å²	149	97 Å²	97	70%	0.696	55%	0.551	S	S	*	*	S	Bend	trans	-87.9	-1.6	172.3	-69.8	-165.6	160.5	0	0	113.6	V342 E348	V342-E346 PolarHBondContact O-N 2.9Å; V342-E346 VanDerWaalsContact O-N 3.08Å; E346-E348 PolarHBondContact O-N 3.34Å
347	Q	22.5	Very low	25.3	Very low	144 Å²	144	103.7 Å²	103.7	67%	0.673	58%	0.575	S	S	*	*	S	Bend	trans	-71.8	90.2	168.5	-136.4	-179.1	16.9	0	0	108.4	V343 G345 V349	V343-Q347 PolarHBondContact O-N 2.94Å; G345-Q347 VanDerWaalsContact C-N 3.35Å; Q347-V349 PolarHBondContact O-N 3.09Å
348	E	23.8	Very low	24.6	Very low	124 Å²	124	105.8 Å²	105.8	58%	0.579	61%	0.607	S	S	*	*			trans	-8.8	118.5	174.3	-63.5	-172.4	123	0	0	113.9	E346 G350 K384	E346-E348 PolarHBondContact O-N 3.34Å; E348-G350 PolarHBondContact O-N 3.33Å; E348-K384 WeakPolarHBondContact OE1-CD 3.33Å; E348-K384 WeakPolarHBondContact OE1-CE 3.5Å; E348-K384 IonicContact OE1-NZ 2.68Å; E348-K384 PolarHBondContact OE1-NZ 2.9Å
349	V	23.3	Very low	23.9	Very low	156 Å²	156	108.8 Å²	108.8	95%	0.945	64%	0.639	S	S	*	*			trans	-58.6	72.3	146.6	-174.9	0	0	0	0	106.9	Q347 S351	Q347-V349 PolarHBondContact O-N 3.09Å; V349-S351 VanDerWaalsContact C-N 3.29Å; V349-S351 PolarHBondContact O-N 3.13Å
350	G	22.8	Very low	23.4	Very low	42 Å²	42	108.3 Å²	108.3	43%	0.433	65%	0.649	S	S	.	*			trans	-69.1	91.9	168.4	0	0	0	0	0	106.8	E348 S352	E348-G350 PolarHBondContact O-N 3.33Å; G350-S352 PolarHBondContact O-N 3.21Å
351	S	23.6	Very low	23.2	Very low	115 Å²	115	112 Å²	112	80%	0.804	68%	0.678	S	S	*	*			trans	39.3	61.9	141.4	44.9	0	0	0	0	115.8	V349	V349-S351 VanDerWaalsContact C-N 3.29Å; V349-S351 PolarHBondContact O-N 3.13Å
352	S	21.1	Very low	22.9	Very low	108 Å²	108	120.9 Å²	120.9	76%	0.755	70%	0.703	S	S	*	*			trans	-94.6	115	155.2	-61.9	0	0	0	0	108.2	G350	G350-S352 PolarHBondContact O-N 3.21Å
353	P	22.2	Very low	22.8	Very low	110 Å²	110	124.1 Å²	124.1	71%	0.714	73%	0.725	S	S	*	*			trans	-64.3	146.4	-177.5	25.4	-31.7	0	0	0	110.7	V355	P353-V355 PolarHBondContact O-N 3.46Å; P353-V355 VanDerWaalsContact O-N 3.15Å
354	P	23.1	Very low	22.6	Very low	120 Å²	120	127.9 Å²	127.9	78%	0.779	74%	0.743	S	S	*	*			trans	-62.8	119.2	-174	23.6	-32.5	0	0	0	111.1	R356	P354-R356 PolarHBondContact O-N 3.13Å; P354-R356 VanDerWaalsContact O-N 3.09Å
355	V	22	Very low	22.6	Very low	119 Å²	119	129.8 Å²	129.8	72%	0.721	76%	0.758	S	S	*	*			trans	-66.3	105.6	170.2	179.3	0	0	0	0	107.9	P353 Y357	P353-V355 PolarHBondContact O-N 3.46Å; P353-V355 VanDerWaalsContact O-N 3.15Å; V355-Y357 HydrophobicContact CG1-CD2 3.96Å; V355-Y357 HydrophobicContact CG1-CE2 3.82Å; V355-Y357 PolarHBondContact O-N 3.34Å; V355-Y357 VanDerWaalsContact O-N 3.16Å
356	R	19.4	Very low	22.4	Very low	245 Å²	245	130.6 Å²	130.6	93%	0.925	75%	0.749	S	S	*	*			trans	-68.5	102.5	173.3	-73.8	-177.5	176.2	-178.2	-1.1	109.7	P354	P354-R356 PolarHBondContact O-N 3.13Å; P354-R356 VanDerWaalsContact O-N 3.09Å
357	Y	22.9	Very low	22.5	Very low	214 Å²	214	134 Å²	134	84%	0.839	76%	0.757	S	S	*	*			trans	-86.1	122.5	156.4	-88.4	-87.3	0	0	0	109.3	V355 G359	V355-Y357 HydrophobicContact CG1-CD2 3.96Å; V355-Y357 HydrophobicContact CG1-CE2 3.82Å; V355-Y357 PolarHBondContact O-N 3.34Å; V355-Y357 VanDerWaalsContact O-N 3.16Å; Y357-G359 PolarHBondContact O-N 3.17Å
358	G	20.5	Very low	22.4	Very low	86 Å²	86	136.9 Å²	136.9	89%	0.887	76%	0.763	S	S	*	*			trans	-65	119.8	-178.2	0	0	0	0	0	112.2
359	G	22.3	Very low	22.5	Very low	67 Å²	67	138.2 Å²	138.2	69%	0.691	77%	0.774	S	S	*	*			trans	-166.3	131.2	169.5	0	0	0	0	0	107.9	Y357	Y357-G359 PolarHBondContact O-N 3.17Å
360	S	22.8	Very low	22.6	Very low	119 Å²	119	133.6 Å²	133.6	83%	0.832	76%	0.758	S	S	*	*			trans	-45.4	149.2	-174.4	-26.5	0	0	0	0	114.2	R362	S360-R362 PolarHBondContact O-N 3.19Å
361	P	26.2	Very low	22.7	Very low	125 Å²	125	138.9 Å²	138.9	81%	0.812	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-73.6	126.7	-165.6	30.3	-32.9	0	0	0	111.8
362	R	21.7	Very low	22.7	Very low	240 Å²	240	144.9 Å²	144.9	91%	0.906	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-85.5	139.6	151.4	-80.1	-174.5	172	-176.1	-1.5	108.2	S360	S360-R362 PolarHBondContact O-N 3.19Å
363	P	24	Very low	22.7	Very low	109 Å²	109	143.3 Å²	143.3	71%	0.708	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-75.1	140.6	-167.4	31.3	-33.3	0	0	0	111.4
364	D	21.2	Very low	22.7	Very low	144 Å²	144	142 Å²	142	77%	0.77	79%	0.788	S	S	*	*			trans	37	88.7	151.5	-58.1	-30.1	0	0	0	117.4
365	V	22.6	Very low	22.6	Very low	122 Å²	122	147.7 Å²	147.7	74%	0.739	79%	0.794	S	S	*	*			trans	-102.4	77.3	146.4	-173.8	0	0	0	0	107.2	Y367	V365-Y367 HydrophobicContact CG1-CD2 4.33Å; V365-Y367 HydrophobicContact CG1-CE2 4.08Å; V365-Y367 PolarHBondContact O-N 3.24Å
366	T	21	Very low	22.6	Very low	84 Å²	84	153.5 Å²	153.5	52%	0.515	80%	0.803	S	S	.	*			trans	-67.3	111.1	162.6	1.6	0	0	0	0	107.5	Y368	T366-Y368 WeakPolarHBondContact O-CD2 3.37Å; T366-Y368 PolarHBondContact O-N 2.99Å; T366-Y368 VanDerWaalsContact O-N 3.13Å
367	Y	23.4	Very low	22.7	Very low	221 Å²	221	146 Å²	146	87%	0.867	79%	0.794	S	S	*	*			trans	-67.7	107.8	166.6	-81	-95.4	0	0	0	108.1	V365 D369	V365-Y367 HydrophobicContact CG1-CD2 4.33Å; V365-Y367 HydrophobicContact CG1-CE2 4.08Å; V365-Y367 PolarHBondContact O-N 3.24Å; Y367-D369 PolarHBondContact O-N 3.28Å
368	Y	20.1	Very low	22.6	Very low	204 Å²	204	143.6 Å²	143.6	80%	0.8	79%	0.794	S	S	*	*			trans	-83.9	103.1	170.6	-79.4	-89.4	0	0	0	108.6	T366 G370	T366-Y368 WeakPolarHBondContact O-CD2 3.37Å; T366-Y368 PolarHBondContact O-N 2.99Å; T366-Y368 VanDerWaalsContact O-N 3.13Å; Y368-G370 PolarHBondContact O-N 2.76Å
369	D	26.7	Very low	22.7	Very low	153 Å²	153	144.9 Å²	144.9	82%	0.818	78%	0.784	S	S	*	*			trans	-70.3	113.3	160.1	-165.3	-3.7	0	0	0	107.5	Y367 N371	Y367-D369 PolarHBondContact O-N 3.28Å; D369-N371 PolarHBondContact O-N 3.46Å
370	G	25.8	Very low	22.7	Very low	58 Å²	58	147.8 Å²	147.8	60%	0.598	78%	0.784	S	S	*	*	S	Bend	trans	-70.3	95.8	-172.3	0	0	0	0	0	110.3	Y368	Y368-G370 PolarHBondContact O-N 2.76Å
371	N	24.3	Very low	22.8	Very low	153 Å²	153	151 Å²	151	82%	0.818	79%	0.786	S	S	*	*	S	Bend	trans	98.6	79.4	170.3	-52.4	-46.7	0	0	0	116.2	D369	D369-N371 PolarHBondContact O-N 3.46Å
372	R	22.6	Very low	22.7	Very low	242 Å²	242	149.1 Å²	149.1	91%	0.913	78%	0.775	S	S	*	*				178.5	148.7	121.3	-97.1	165.8	-166.2	-157.4	5.9	111.5	G374	R372-G374 PolarHBondContact O-N 2.78Å
373	G	22	Very low	22.8	Very low	75 Å²	75	145 Å²	145	77%	0.773	77%	0.771	S	S	*	*			trans	-50.5	133.1	168.8	0	0	0	0	0	111.7	R375	G373-R375 PolarHBondContact O-N 3.11Å
374	G	22.2	Very low	22.8	Very low	82 Å²	82	146.6 Å²	146.6	85%	0.845	77%	0.767	S	S	*	*			trans	-54.4	118.5	-178.9	0	0	0	0	0	112.3	R372	R372-G374 PolarHBondContact O-N 2.78Å
375	R	20.8	Very low	22.8	Very low	239 Å²	239	150.6 Å²	150.6	90%	0.902	77%	0.771	S	S	*	*			trans	-120.7	123.7	143.3	-75.1	-172.3	-177.3	-178	1.7	106.9	G373 A377	G373-R375 PolarHBondContact O-N 3.11Å; R375-A377 PolarHBondContact O-N 3.16Å
376	R	21.2	Very low	22.8	Very low	241 Å²	241	153.7 Å²	153.7	91%	0.909	78%	0.776	S	S	*	*			trans	-49.8	119	168.2	-89.3	177.4	173.3	169.9	-2.6	108.6	I378	R376-I378 PolarHBondContact O-N 3.32Å
377	A	22.6	Very low	23	Very low	89 Å²	89	156 Å²	156	74%	0.736	79%	0.789	S	S	*	*			trans	-73.5	110.8	160.9	0	0	0	0	0	107.4	R375 V379	R375-A377 PolarHBondContact O-N 3.16Å; A377-V379 PolarHBondContact O-N 3.01Å
378	I	19.9	Very low	23	Very low	163 Å²	163	147.9 Å²	147.9	84%	0.836	77%	0.773	S	S	*	*			trans	-76	108.7	160.4	-61.4	170.7	0	0	0	104	R376 D380	R376-I378 PolarHBondContact O-N 3.32Å; I378-D380 PolarHBondContact O-N 3.45Å
379	V	23.9	Very low	23.1	Very low	112 Å²	112	142.9 Å²	142.9	68%	0.679	76%	0.76	S	S	*	*			trans	-81.9	114.2	177.3	179.8	0	0	0	0	107.3	A377	A377-V379 PolarHBondContact O-N 3.01Å
380	D	21.7	Very low	23	Very low	128 Å²	128	138.8 Å²	138.8	68%	0.684	75%	0.747	S	S	*	*			trans	-71.4	132.5	175.2	-160	-33.2	0	0	0	109.8	I378 S382	I378-D380 PolarHBondContact O-N 3.45Å; D380-S382 VanDerWaalsContact C-N 3.28Å; D380-S382 PolarHBondContact O-N 3.3Å; D380-S382 PolarHBondContact OD1-OG 3.02Å
381	E	25.8	Very low	23	Very low	188 Å²	188	139.6 Å²	139.6	88%	0.879	74%	0.741	S	S	*	*	S	Bend	trans	-81.5	9	-170	-89	-175.2	156	0	0	114.4
382	S	22.7	Very low	23.1	Very low	84 Å²	84	139.1 Å²	139.1	59%	0.587	73%	0.727	S	S	*	*	S	Bend	trans	-87.5	-28.8	-165.7	34.2	0	0	0	0	116.2	D380	D380-S382 VanDerWaalsContact C-N 3.28Å; D380-S382 PolarHBondContact O-N 3.3Å; D380-S382 PolarHBondContact OD1-OG 3.02Å
383	D	23.7	Very low	23.1	Very low	154 Å²	154	131.3 Å²	131.3	82%	0.824	71%	0.707	S	S	*	*	S	Bend	trans	-103.4	4.2	-166.9	-90.9	-22.5	0	0	0	117	R385	D383-R385 PolarHBondContact O-N 3.13Å
384	K	24.1	Very low	23.3	Very low	142 Å²	142	131 Å²	131	62%	0.617	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-2.7	-172.6	-77.3	-174	164.2	-155.3	0	116.9	E348	E348-K384 WeakPolarHBondContact OE1-CD 3.33Å; E348-K384 WeakPolarHBondContact OE1-CE 3.5Å; E348-K384 IonicContact OE1-NZ 2.68Å; E348-K384 PolarHBondContact OE1-NZ 2.9Å
385	R	22.5	Very low	23.6	Very low	228 Å²	228	129.9 Å²	129.9	86%	0.86	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-6.9	-168.5	-74.4	-168.2	-175.6	-171.8	3.3	117.1	D383	D383-R385 PolarHBondContact O-N 3.13Å
386	F	23	Very low	23.8	Very low	188 Å²	188	126.5 Å²	126.5	83%	0.825	66%	0.658	S	S	*	*	S	Bend	trans	-120.5	-3.7	-160.5	-86	-82.6	0	0	0	119.6
387	T	23.4	Very low	24	Very low	131 Å²	131	118.4 Å²	118.4	80%	0.804	64%	0.638	S	S	*	*	S	Bend	trans	-91.7	-15.2	-178.7	47.3	0	0	0	0	115.3	L389	T387-L389 PolarHBondContact O-N 3.03Å
388	G	23.4	Very low	24.2	Very low	51 Å²	51	119 Å²	119	53%	0.526	63%	0.629	S	S	.	*	S	Bend	trans	-81.4	-3.9	-172.7	0	0	0	0	0	117.2
389	L	24.1	Very low	24.4	Very low	100 Å²	100	116 Å²	116	52%	0.524	61%	0.614	S	S	.	*	S	Bend	trans	-98.9	-26.9	-175.1	-129.9	96.3	0	0	0	114	T387 T391 R392	T387-L389 PolarHBondContact O-N 3.03Å; L389-T391 VanDerWaalsContact C-N 3.28Å; L389-T391 PolarHBondContact O-N 3.34Å; L389-R392 WeakPolarHBondContact O-CB 2.94Å; L389-R392 PolarHBondContact O-N 2.87Å; L389-R392 VanDerWaalsContact O-N 3.1Å
390	A	23.8	Very low	24.4	Very low	67 Å²	67	112.7 Å²	112.7	55%	0.554	60%	0.598	S	S	*	*	H	α-helix	trans	-66.9	-27.6	-175.4	0	0	0	0	0	113.2	R392	A390-R392 VanDerWaalsContact C-N 3.35Å
391	T	26.1	Very low	24.5	Very low	75 Å²	75	108.8 Å²	108.8	46%	0.46	58%	0.581	S	S	.	*	H	α-helix	trans	-72	-26.2	173.7	16.5	0	0	0	0	112.9	L389 T393 E395	L389-T391 VanDerWaalsContact C-N 3.28Å; L389-T391 PolarHBondContact O-N 3.34Å; T391-T393 PolarHBondContact O-N 3.4Å; T391-E395 WeakPolarHBondContact O-CG 3.19Å
392	R	24.9	Very low	24.4	Very low	143 Å²	143	105 Å²	105	54%	0.54	57%	0.565	S	S	.	*	H	α-helix	trans	-70	-28.7	-174.3	-69.1	-176.4	177.9	-178.7	-0.9	113.8	L389 A390 E395 Y396	L389-R392 WeakPolarHBondContact O-CB 2.94Å; L389-R392 PolarHBondContact O-N 2.87Å; L389-R392 VanDerWaalsContact O-N 3.1Å; A390-R392 VanDerWaalsContact C-N 3.35Å; R392-E395 WeakPolarHBondContact O-CB 3.43Å; R392-Y396 WeakPolarHBondContact O-CD2 3.5Å; R392-Y396 WeakPolarHBondContact O-CE2 3.44Å
393	T	24.4	Very low	24.4	Very low	78 Å²	78	112.2 Å²	112.2	48%	0.479	58%	0.579	S	S	.	*	H	α-helix	trans	-81.3	-32.3	-177.4	1.8	0	0	0	0	113.1	T391 E395 Y396	T391-T393 PolarHBondContact O-N 3.4Å; T393-E395 VanDerWaalsContact C-N 3.26Å; T393-E395 PolarHBondContact O-N 3.19Å; T393-Y396 PolarHBondContact O-N 2.99Å
394	A	25.4	Very low	24.4	Very low	69 Å²	69	108.2 Å²	108.2	57%	0.57	56%	0.563	S	S	*	*	H	α-helix	trans	-64.1	-33.5	172.5	0	0	0	0	0	111.8	Y396 S397	A394-Y396 VanDerWaalsContact C-N 3.29Å; A394-Y396 PolarHBondContact O-N 2.96Å; A394-S397 PolarHBondContact O-N 3.16Å
395	E	27.7	Very low	24.2	Very low	58 Å²	58	106.2 Å²	106.2	27%	0.271	57%	0.567	S	S	.	*	H	α-helix	trans	-60.4	-33.2	176	-68.4	172.6	160.9	0	0	113.1	Q340 T391 R392 T393	Q340-E395 PolarHBondContact NE2-OE1 2.72Å; T391-E395 WeakPolarHBondContact O-CG 3.19Å; R392-E395 WeakPolarHBondContact O-CB 3.43Å; T393-E395 VanDerWaalsContact C-N 3.26Å; T393-E395 PolarHBondContact O-N 3.19Å
396	Y	26	Very low	24.1	Very low	168 Å²	168	101.1 Å²	101.1	66%	0.659	57%	0.566	S	S	*	*	H	α-helix	trans	-79	-32.8	-179.4	-69.5	-75.6	0	0	0	113.4	R392 T393 A394 A400	R392-Y396 WeakPolarHBondContact O-CD2 3.5Å; R392-Y396 WeakPolarHBondContact O-CE2 3.44Å; T393-Y396 PolarHBondContact O-N 2.99Å; A394-Y396 VanDerWaalsContact C-N 3.29Å; A394-Y396 PolarHBondContact O-N 2.96Å; Y396-A400 WeakPolarHBondContact O-CB 3.49Å; Y396-A400 PolarHBondContact O-N 2.94Å
397	S	25.3	Very low	24	Very low	71 Å²	71	95.9 Å²	95.9	50%	0.497	55%	0.55	S	S	.	.	H	α-helix	trans	-71.1	-33.9	-176.7	-62.9	0	0	0	0	112.3	A394 S401	A394-S397 PolarHBondContact O-N 3.16Å; S397-S401 VanDerWaalsContact O-CB 3.23Å; S397-S401 WeakPolarHBondContact O-CB 3.16Å; S397-S401 PolarHBondContact O-N 3.46Å
398	L	26.1	Very low	23.8	Very low	101 Å²	101	95.7 Å²	95.7	53%	0.529	55%	0.548	S	S	.	.	H	α-helix	trans	-76	-43.1	-179.4	-139.9	97.1	0	0	0	112.2	S401 M402	L398-S401 WeakPolarHBondContact O-CB 3.45Å; L398-S401 PolarHBondContact O-N 3.35Å; L398-M402 WeakPolarHBondContact O-CG 3.39Å; L398-M402 PolarHBondContact O-N 3.49Å
399	L	25	Very low	23.8	Very low	100 Å²	100	99.5 Å²	99.5	52%	0.524	56%	0.555	S	S	.	*	H	α-helix	trans	-70.2	-33.3	180	-79.7	165.8	0	0	0	112.7	R403	L399-R403 PolarHBondContact O-N 2.99Å
400	A	23.3	Very low	23.6	Very low	43 Å²	43	99.9 Å²	99.9	36%	0.355	57%	0.567	S	S	.	*	H	α-helix	trans	-70.8	-36.5	173.2	0	0	0	0	0	112.3	Y396 R403 S404	Y396-A400 WeakPolarHBondContact O-CB 3.49Å; Y396-A400 PolarHBondContact O-N 2.94Å; A400-R403 PolarHBondContact O-N 2.88Å; A400-S404 PolarHBondContact O-N 3.18Å; A400-S404 PolarHBondContact O-OG 2.64Å
401	S	23.3	Very low	23.4	Very low	46 Å²	46	100.1 Å²	100.1	32%	0.322	58%	0.576	S	S	.	*	H	α-helix	trans	-62.1	-41.4	172.3	164.3	0	0	0	0	112.1	S397 L398 R403 S404 V407	S397-S401 VanDerWaalsContact O-CB 3.23Å; S397-S401 WeakPolarHBondContact O-CB 3.16Å; S397-S401 PolarHBondContact O-N 3.46Å; L398-S401 WeakPolarHBondContact O-CB 3.45Å; L398-S401 PolarHBondContact O-N 3.35Å; S401-R403 VanDerWaalsContact C-N 3.27Å; S401-R403 PolarHBondContact O-N 3.41Å; S401-S404 CarbonylContact O-C 3.57Å; S401-S404 PolarHBondContact O-N 3.37Å; S401-V407 WeakPolarHBondContact OG-CG2 3.37Å
402	M	23.4	Very low	23.2	Very low	108 Å²	108	101.9 Å²	101.9	53%	0.532	59%	0.586	S	S	.	*	H	α-helix	trans	-66.8	-26.1	177.2	-71.1	-173.5	72.3	0	0	113.7	E40 L398	E40-M402 VanDerWaalsContact OE1-CE 3.27Å; E40-M402 WeakPolarHBondContact OE1-CE 3.27Å; L398-M402 WeakPolarHBondContact O-CG 3.39Å; L398-M402 PolarHBondContact O-N 3.49Å
403	R	24	Very low	22.9	Very low	235 Å²	235	105.3 Å²	105.3	89%	0.887	60%	0.599	S	S	*	*	H	α-helix	trans	-85.7	-17	177.8	-75.6	-173.1	174.5	-170.5	-1.9	114.2	L399 A400 S401	L399-R403 PolarHBondContact O-N 2.99Å; A400-R403 PolarHBondContact O-N 2.88Å; S401-R403 VanDerWaalsContact C-N 3.27Å; S401-R403 PolarHBondContact O-N 3.41Å
404	S	22.3	Very low	22.8	Very low	71 Å²	71	109.1 Å²	109.1	50%	0.497	62%	0.615	S	S	.	*	S	Bend	trans	-136.5	107	-175.1	58.5	0	0	0	0	111.5	A400 S401	A400-S404 PolarHBondContact O-N 3.18Å; A400-S404 PolarHBondContact O-OG 2.64Å; S401-S404 CarbonylContact O-C 3.57Å; S401-S404 PolarHBondContact O-N 3.37Å
405	S	20.7	Very low	22.5	Very low	99 Å²	99	113.7 Å²	113.7	69%	0.692	62%	0.622	S	S	*	*	S	Bend	trans	68.2	126.8	164.7	50.4	0	0	0	0	118.4	V407	S405-V407 WeakPolarHBondContact O-CG2 3.44Å; S405-V407 PolarHBondContact O-N 2.77Å
406	S	21.5	Very low	22.2	Very low	122 Å²	122	116 Å²	116	85%	0.853	64%	0.642	S	S	*	*			trans	-12.7	94.2	155.4	56.2	0	0	0	0	115.3
407	V	20.8	Very low	22	Very low	78 Å²	78	115.9 Å²	115.9	47%	0.473	65%	0.652	S	S	.	*			trans	-97.5	110	173.4	-171.2	0	0	0	0	110.3	S401 S405 L409	S401-V407 WeakPolarHBondContact OG-CG2 3.37Å; S405-V407 WeakPolarHBondContact O-CG2 3.44Å; S405-V407 PolarHBondContact O-N 2.77Å; V407-L409 HydrophobicContact CG1-CD2 3.83Å; V407-L409 HydrophobicContact CG1-CG 3.82Å; V407-L409 PolarHBondContact O-N 2.88Å
408	V	19.3	Very low	21.8	Very low	127 Å²	127	120.6 Å²	120.6	77%	0.77	67%	0.666	S	S	*	*			trans	-68.1	110.2	162.8	176.3	0	0	0	0	108.1
409	L	22.9	Very low	21.6	Very low	130 Å²	130	124.1 Å²	124.1	68%	0.681	68%	0.68	S	S	*	*			trans	-104.9	79.6	178.5	-74.4	169.4	0	0	0	111.7	V407 V412	V407-L409 HydrophobicContact CG1-CD2 3.83Å; V407-L409 HydrophobicContact CG1-CG 3.82Å; V407-L409 PolarHBondContact O-N 2.88Å; L409-V412 HydrophobicContact CD2-CG2 3.82Å
410	S	19.2	Very low	21.7	Very low	108 Å²	108	123.3 Å²	123.3	76%	0.755	69%	0.688	S	S	*	*			trans	-101.7	111.3	153.6	62.4	0	0	0	0	108.8
411	G	20.3	Very low	21.7	Very low	72 Å²	72	127 Å²	127	74%	0.742	70%	0.7	S	S	*	*			trans	107	39.9	158.7	0	0	0	0	0	119	R413	G411-R413 PolarHBondContact O-N 2.97Å; G411-R413 VanDerWaalsContact O-N 3.08Å
412	V	21	Very low	22	Very low	113 Å²	113	126.9 Å²	126.9	69%	0.685	70%	0.699	S	S	*	*			trans	-72.5	102.4	167.1	-176.6	0	0	0	0	109.7	L409 I414	L409-V412 HydrophobicContact CD2-CG2 3.82Å; V412-I414 HydrophobicContact CG1-CG1 4.43Å
413	R	19.2	Very low	22.2	Very low	214 Å²	214	123.7 Å²	123.7	81%	0.808	69%	0.686	S	S	*	*			trans	-93.5	120.1	159	-76.5	-173.7	-176.9	-179.3	2.1	108.1	G411 F415	G411-R413 PolarHBondContact O-N 2.97Å; G411-R413 VanDerWaalsContact O-N 3.08Å; R413-F415 HydrophobicContact CB-CE2 4.17Å; R413-F415 WeakPolarHBondContact O-CD2 3.21Å; R413-F415 PolarHBondContact O-N 3.48Å
414	I	21.5	Very low	22.5	Very low	158 Å²	158	116.9 Å²	116.9	81%	0.81	67%	0.674	S	S	*	*			trans	-74.4	111.4	177.4	-57.9	170.5	0	0	0	107.7	V412	V412-I414 HydrophobicContact CG1-CG1 4.43Å
415	F	19.4	Very low	22.8	Very low	165 Å²	165	117.8 Å²	117.8	72%	0.724	68%	0.68	S	S	*	*			trans	-94.2	133.4	169.2	-72.2	-86.3	0	0	0	109.3	R413 L417	R413-F415 HydrophobicContact CB-CE2 4.17Å; R413-F415 WeakPolarHBondContact O-CD2 3.21Å; R413-F415 PolarHBondContact O-N 3.48Å; F415-L417 PolarHBondContact O-N 2.89Å
416	P	21.2	Very low	23.2	Very low	107 Å²	107	114.3 Å²	114.3	70%	0.695	65%	0.654	S	S	*	*			trans	-69.2	115.8	172.6	26.8	-30.5	0	0	0	109.4	H418	P416-H418 PolarHBondContact O-N 2.81Å
417	L	22.9	Very low	23.8	Very low	165 Å²	165	113 Å²	113	86%	0.864	65%	0.651	S	S	*	*			trans	-67.3	96.1	169.9	-105.3	136.9	0	0	0	108.6	F415	F415-L417 PolarHBondContact O-N 2.89Å
418	H	20.9	Very low	24.6	Very low	171 Å²	171	111.2 Å²	111.2	79%	0.792	64%	0.641	S	S	*	*			trans	-68.7	126.3	165.6	-108.2	-87.4	0	0	0	108.3	P416	P416-H418 PolarHBondContact O-N 2.81Å
419	E	22.4	Very low	25.5	Very low	174 Å²	174	111.7 Å²	111.7	81%	0.813	64%	0.639	S	S	*	*	S	Bend	trans	70.6	85.6	176.7	-62.7	-177.9	167	0	0	116.1	I421	E419-I421 PolarHBondContact O-N 2.66Å
420	A	26	Very low	26.4	Very low	84 Å²	84	113 Å²	113	69%	0.694	64%	0.641	S	S	*	*			trans	-68.7	106.2	169.8	0	0	0	0	0	111.1	S422	A420-S422 PolarHBondContact O-N 3.08Å
421	I	23.2	Very low	27.2	Very low	121 Å²	121	112.9 Å²	112.9	62%	0.621	63%	0.629	S	S	*	*			trans	-72.5	123	166.7	-60.2	173.9	0	0	0	107.9	E419 V423	E419-I421 PolarHBondContact O-N 2.66Å; I421-V423 PolarHBondContact O-N 3.39Å
422	S	30.1	Very low	28	Very low	42 Å²	42	113.8 Å²	113.8	29%	0.294	61%	0.61	S	S	.	*			trans	-72.5	120.8	179	-174.6	0	0	0	0	111.1	A420 S424 S425	A420-S422 PolarHBondContact O-N 3.08Å; S422-S424 PolarHBondContact O-N 3.27Å; S422-S424 PolarHBondContact OG-N 3.29Å; S422-S424 PolarHBondContact OG-OG 3.27Å; S422-S425 PolarHBondContact O-N 3.37Å; S422-S425 PolarHBondContact O-OG 3.05Å
423	V	27.8	Very low	28.8	Very low	42 Å²	42	111.1 Å²	111.1	26%	0.255	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-58.7	-22	172.1	-175.6	0	0	0	0	111.8	I421 S425 I426 R432 F435	I421-V423 PolarHBondContact O-N 3.39Å; V423-S425 VanDerWaalsContact C-N 3.28Å; V423-S425 PolarHBondContact O-N 3Å; V423-I426 PolarHBondContact O-N 3.16Å; V423-R432 HydrophobicContact CG1-CB 4.24Å; V423-R432 HydrophobicContact CG1-CG 3.89Å; V423-R432 PolarHBondContact O-NE 3.46Å; V423-F435 HydrophobicContact CG2-CD1 4.08Å; V423-F435 HydrophobicContact CG2-CE1 3.94Å
424	S	29.4	Very low	29.7	Very low	92 Å²	92	107.6 Å²	107.6	64%	0.643	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-72	-17.2	175.4	76.7	0	0	0	0	114	S422 I426	S422-S424 PolarHBondContact O-N 3.27Å; S422-S424 PolarHBondContact OG-N 3.29Å; S422-S424 PolarHBondContact OG-OG 3.27Å; S424-I426 VanDerWaalsContact C-N 3.29Å
425	S	28.9	Very low	30.4	Very low	89 Å²	89	102.9 Å²	102.9	62%	0.622	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-84.2	-5.3	174.3	62.4	0	0	0	0	113.2	S422 V423	S422-S425 PolarHBondContact O-N 3.37Å; S422-S425 PolarHBondContact O-OG 3.05Å; V423-S425 VanDerWaalsContact C-N 3.28Å; V423-S425 PolarHBondContact O-N 3Å
426	I	29.1	Very low	31.2	Very low	26 Å²	26	99 Å²	99	13%	0.133	55%	0.547	C	S	.	.			trans	-85.8	123	176.3	-58.5	176.8	0	0	0	108.2	V423 S424 E431 R432 F435	V423-I426 PolarHBondContact O-N 3.16Å; S424-I426 VanDerWaalsContact C-N 3.29Å; I426-E431 HydrophobicContact CG2-CB 3.26Å; I426-E431 HydrophobicContact CG2-CG 4.36Å; I426-E431 WeakPolarHBondContact CG2-OE2 3.45Å; I426-R432 HydrophobicContact CB-CG 3.92Å; I426-R432 HydrophobicContact CG2-CG 3.89Å; I426-R432 PolarHBondContact O-NE 3.13Å; I426-R432 PolarHBondContact O-NH2 2.99Å; I426-F435 HydrophobicContact CD1-CB 4.01Å; I426-F435 HydrophobicContact CD1-CD1 4.35Å; I426-F435 HydrophobicContact CD1-CD2 4.05Å; I426-F435 HydrophobicContact CD1-CG 3.87Å
427	A	33.6	Very low	31.8	Very low	96 Å²	96	102.2 Å²	102.2	79%	0.793	55%	0.545	S	S	*	.			trans	-77.1	-33.2	-161	0	0	0	0	0	113.3
428	S	38	Very low	32.2	Very low	39 Å²	39	97 Å²	97	27%	0.273	52%	0.523	S	S	.	.	S	Bend	trans	-111.9	150.7	-177	81.9	0	0	0	0	113.2	E430 E431 R432	S428-E430 PolarHBondContact O-N 2.92Å; S428-E431 PolarHBondContact O-N 3.45Å; S428-E431 WeakPolarHBondContact OG-CB 3.32Å; S428-E431 VanDerWaalsContact OG-CG 3.3Å; S428-E431 WeakPolarHBondContact OG-CG 3.45Å; S428-E431 PolarHBondContact OG-N 2.99Å; S428-E431 VanDerWaalsContact OG-N 3.13Å; S428-R432 WeakPolarHBondContact O-CG 3.27Å; S428-R432 PolarHBondContact O-N 2.8Å; S428-R432 VanDerWaalsContact O-N 3.13Å
429	L	39	Very low	32.5	Very low	137 Å²	137	93.7 Å²	93.7	72%	0.717	51%	0.511	S	S	*	.	H	α-helix	trans	-62.2	-35.3	176.1	-170.2	76.3	0	0	0	111.4	R432 T433	L429-R432 PolarHBondContact O-N 3.4Å; L429-T433 WeakPolarHBondContact O-CB 3.45Å; L429-T433 PolarHBondContact O-N 3.35Å; L429-T433 PolarHBondContact O-OG1 3.34Å
430	E	40.9	Very low	32.9	Very low	157 Å²	157	90.6 Å²	90.6	73%	0.734	50%	0.499	S	S	*	.	H	α-helix	trans	-64.5	-47.8	177.9	-71.7	163.9	163.6	0	0	110.9	S428 R432 T433 E434	S428-E430 PolarHBondContact O-N 2.92Å; E430-R432 VanDerWaalsContact C-N 3.34Å; E430-R432 PolarHBondContact O-N 3.42Å; E430-T433 PolarHBondContact O-N 2.84Å; E430-E434 PolarHBondContact O-N 3.1Å
431	E	36.8	Very low	32.8	Very low	106 Å²	106	91.4 Å²	91.4	50%	0.495	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-37.4	176.2	-73.9	175.4	166.5	0	0	112.2	I426 S428 T433 E434 F435	I426-E431 HydrophobicContact CG2-CB 3.26Å; I426-E431 HydrophobicContact CG2-CG 4.36Å; I426-E431 WeakPolarHBondContact CG2-OE2 3.45Å; S428-E431 PolarHBondContact O-N 3.45Å; S428-E431 WeakPolarHBondContact OG-CB 3.32Å; S428-E431 VanDerWaalsContact OG-CG 3.3Å; S428-E431 WeakPolarHBondContact OG-CG 3.45Å; S428-E431 PolarHBondContact OG-N 2.99Å; S428-E431 VanDerWaalsContact OG-N 3.13Å; E431-T433 VanDerWaalsContact C-N 3.33Å; E431-T433 PolarHBondContact O-N 3.01Å; E431-E434 PolarHBondContact O-N 3.44Å; E431-F435 VanDerWaalsContact O-CB 3.3Å; E431-F435 WeakPolarHBondContact O-CB 3.08Å; E431-F435 PolarHBondContact O-N 3.18Å
432	R	37.8	Very low	32.8	Very low	92 Å²	92	88.9 Å²	88.9	35%	0.347	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-39.6	175	-70.2	176.2	-171.2	172.2	5.2	112.1	V423 I426 S428 L429 E430 L436	V423-R432 HydrophobicContact CG1-CB 4.24Å; V423-R432 HydrophobicContact CG1-CG 3.89Å; V423-R432 PolarHBondContact O-NE 3.46Å; I426-R432 HydrophobicContact CB-CG 3.92Å; I426-R432 HydrophobicContact CG2-CG 3.89Å; I426-R432 PolarHBondContact O-NE 3.13Å; I426-R432 PolarHBondContact O-NH2 2.99Å; S428-R432 WeakPolarHBondContact O-CG 3.27Å; S428-R432 PolarHBondContact O-N 2.8Å; S428-R432 VanDerWaalsContact O-N 3.13Å; L429-R432 PolarHBondContact O-N 3.4Å; E430-R432 VanDerWaalsContact C-N 3.34Å; E430-R432 PolarHBondContact O-N 3.42Å; R432-L436 VanDerWaalsContact O-CG 3.32Å; R432-L436 WeakPolarHBondContact O-CG 3.43Å; R432-L436 PolarHBondContact O-N 3.37Å; R432-L436 VanDerWaalsContact O-N 3.12Å
433	T	36.4	Very low	32.6	Very low	57 Å²	57	90.4 Å²	90.4	35%	0.35	51%	0.509	S	S	.	.	H	α-helix	trans	-70.6	-38.5	-179.7	-50.5	0	0	0	0	110.8	L429 E430 E431 R437	L429-T433 WeakPolarHBondContact O-CB 3.45Å; L429-T433 PolarHBondContact O-N 3.35Å; L429-T433 PolarHBondContact O-OG1 3.34Å; E430-T433 PolarHBondContact O-N 2.84Å; E431-T433 VanDerWaalsContact C-N 3.33Å; E431-T433 PolarHBondContact O-N 3.01Å; T433-R437 WeakPolarHBondContact O-CG 3.5Å; T433-R437 PolarHBondContact O-N 2.85Å; T433-R437 VanDerWaalsContact O-N 3.11Å
434	E	39.4	Very low	32.5	Very low	139 Å²	139	97.9 Å²	97.9	65%	0.65	54%	0.537	S	S	*	.	H	α-helix	trans	-70.3	-40.1	175.5	-167.8	160.3	-163.4	0	0	112.4	E430 E431 L436 R437 S438	E430-E434 PolarHBondContact O-N 3.1Å; E431-E434 PolarHBondContact O-N 3.44Å; E434-L436 PolarHBondContact O-N 3.5Å; E434-R437 PolarHBondContact O-N 3.13Å; E434-S438 WeakPolarHBondContact O-CB 3.32Å; E434-S438 PolarHBondContact O-N 2.99Å
435	F	35	Very low	32.1	Very low	60 Å²	60	100.4 Å²	100.4	26%	0.263	54%	0.539	S	S	.	.	H	α-helix	trans	-57.8	-47.2	173.1	-177.8	-93.8	0	0	0	111.9	V423 I426 E431 R437 S438 D439	V423-F435 HydrophobicContact CG2-CD1 4.08Å; V423-F435 HydrophobicContact CG2-CE1 3.94Å; I426-F435 HydrophobicContact CD1-CB 4.01Å; I426-F435 HydrophobicContact CD1-CD1 4.35Å; I426-F435 HydrophobicContact CD1-CD2 4.05Å; I426-F435 HydrophobicContact CD1-CG 3.87Å; E431-F435 VanDerWaalsContact O-CB 3.3Å; E431-F435 WeakPolarHBondContact O-CB 3.08Å; E431-F435 PolarHBondContact O-N 3.18Å; F435-R437 VanDerWaalsContact C-N 3.32Å; F435-R437 PolarHBondContact O-N 3.31Å; F435-S438 PolarHBondContact O-N 3.29Å; F435-D439 PolarHBondContact O-N 3.06Å; F435-D439 VanDerWaalsContact O-N 3.16Å
436	L	36	Very low	31.8	Very low	84 Å²	84	104.6 Å²	104.6	44%	0.44	55%	0.549	S	S	.	.	H	α-helix	trans	-62.6	-38.5	176.4	-70.9	170.2	0	0	0	112	R432 E434 L440	R432-L436 VanDerWaalsContact O-CG 3.32Å; R432-L436 WeakPolarHBondContact O-CG 3.43Å; R432-L436 PolarHBondContact O-N 3.37Å; R432-L436 VanDerWaalsContact O-N 3.12Å; E434-L436 PolarHBondContact O-N 3.5Å; L436-L440 VanDerWaalsContact O-CB 3.29Å; L436-L440 WeakPolarHBondContact O-CB 3.14Å; L436-L440 VanDerWaalsContact O-CD1 3.24Å; L436-L440 WeakPolarHBondContact O-CD1 3.28Å; L436-L440 WeakPolarHBondContact O-CG 3.33Å; L436-L440 PolarHBondContact O-N 3.19Å; L436-L440 VanDerWaalsContact O-N 3.15Å
437	R	33.9	Very low	31.7	Very low	173 Å²	173	110 Å²	110	65%	0.653	57%	0.569	S	S	*	*	H	α-helix	trans	-68.2	-39.6	176.3	-75.8	176.9	-177.2	168.7	2.7	112.7	T433 E434 F435 L440 C441	T433-R437 WeakPolarHBondContact O-CG 3.5Å; T433-R437 PolarHBondContact O-N 2.85Å; T433-R437 VanDerWaalsContact O-N 3.11Å; E434-R437 PolarHBondContact O-N 3.13Å; F435-R437 VanDerWaalsContact C-N 3.32Å; F435-R437 PolarHBondContact O-N 3.31Å; R437-L440 PolarHBondContact O-N 3.42Å; R437-C441 WeakPolarHBondContact O-CB 3.43Å; R437-C441 PolarHBondContact O-N 3.09Å; R437-C441 VanDerWaalsContact O-N 3.15Å; R437-C441 PolarHBondContact O-SG 3.14Å
438	S	32.5	Very low	31.1	Very low	57 Å²	57	112.2 Å²	112.2	40%	0.399	57%	0.567	S	S	.	*	H	α-helix	trans	-58.9	-53.3	177.4	166.1	0	0	0	0	111.3	E434 F435 L440 C441 L442	E434-S438 WeakPolarHBondContact O-CB 3.32Å; E434-S438 PolarHBondContact O-N 2.99Å; F435-S438 PolarHBondContact O-N 3.29Å; S438-L440 PolarHBondContact O-N 3.39Å; S438-C441 PolarHBondContact O-N 3Å; S438-L442 WeakPolarHBondContact O-CG 3.49Å; S438-L442 PolarHBondContact O-N 3.01Å
439	D	27.3	Very low	30.6	Very low	101 Å²	101	119.5 Å²	119.5	54%	0.54	59%	0.59	S	S	.	*	H	α-helix	trans	-67.9	-34.6	-179.2	-85.5	-2.1	0	0	0	112.5	F435 C441	F435-D439 PolarHBondContact O-N 3.06Å; F435-D439 VanDerWaalsContact O-N 3.16Å; D439-C441 VanDerWaalsContact C-N 3.26Å; D439-C441 PolarHBondContact O-N 2.66Å
440	L	29.2	Very low	29.9	Very low	108 Å²	108	118.8 Å²	118.8	57%	0.565	59%	0.594	S	S	*	*	H	α-helix	trans	-66.9	-23.5	175.2	-80	163.9	0	0	0	113.4	L436 R437 S438	L436-L440 VanDerWaalsContact O-CB 3.29Å; L436-L440 WeakPolarHBondContact O-CB 3.14Å; L436-L440 VanDerWaalsContact O-CD1 3.24Å; L436-L440 WeakPolarHBondContact O-CD1 3.28Å; L436-L440 WeakPolarHBondContact O-CG 3.33Å; L436-L440 PolarHBondContact O-N 3.19Å; L436-L440 VanDerWaalsContact O-N 3.15Å; R437-L440 PolarHBondContact O-N 3.42Å; S438-L440 PolarHBondContact O-N 3.39Å
441	C	24.1	Very low	29	Very low	102 Å²	102	122.1 Å²	122.1	69%	0.689	60%	0.6	S	S	*	*	H	α-helix	trans	-99.9	-6.3	-175.4	-74.8	0	0	0	0	114.9	R437 S438 D439 G443	R437-C441 WeakPolarHBondContact O-CB 3.43Å; R437-C441 PolarHBondContact O-N 3.09Å; R437-C441 VanDerWaalsContact O-N 3.15Å; R437-C441 PolarHBondContact O-SG 3.14Å; S438-C441 PolarHBondContact O-N 3Å; D439-C441 VanDerWaalsContact C-N 3.26Å; D439-C441 PolarHBondContact O-N 2.66Å; C441-G443 PolarHBondContact O-N 3.26Å
442	L	24.8	Very low	28.7	Very low	68 Å²	68	121.8 Å²	121.8	36%	0.356	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.8	51.9	-179.6	-72.1	168	0	0	0	113	S438 Q445 Y447	S438-L442 WeakPolarHBondContact O-CG 3.49Å; S438-L442 PolarHBondContact O-N 3.01Å; L442-Q445 HydrophobicContact CD2-CB 3.99Å; L442-Y447 HydrophobicContact CD1-CE2 3.7Å; L442-Y447 HydrophobicContact CD2-CE2 3.62Å; L442-Y447 HydrophobicContact CG-CE2 4.24Å
443	G	25.3	Very low	28	Very low	74 Å²	74	126.8 Å²	126.8	76%	0.763	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-2.5	161.2	0	0	0	0	0	113.9	C441	C441-G443 PolarHBondContact O-N 3.26Å
444	K	25.3	Very low	27.9	Very low	198 Å²	198	131.5 Å²	131.5	86%	0.861	70%	0.696	S	S	*	*	S	Bend	trans	-141.4	5	-172.2	-83.3	-168.2	178.2	176.4	0	118.7
445	Q	21.4	Very low	27.3	Very low	145 Å²	145	131.2 Å²	131.2	68%	0.678	70%	0.699	S	S	*	*			trans	-109.7	110.3	172.8	-72.2	-167.2	-4.6	0	0	111.6	L442 Y447	L442-Q445 HydrophobicContact CD2-CB 3.99Å; Q445-Y447 PolarHBondContact O-N 3.38Å
446	Q	22.4	Very low	26.9	Very low	178 Å²	178	134.9 Å²	134.9	83%	0.832	72%	0.722	S	S	*	*			trans	-56.4	101.5	161.1	-141.1	174.3	-7.4	0	0	106.5	D448	Q446-D448 VanDerWaalsContact C-N 3.25Å; Q446-D448 PolarHBondContact O-N 3.29Å
447	Y	26.3	Very low	26.4	Very low	139 Å²	139	137.7 Å²	137.7	55%	0.545	74%	0.737	S	S	.	*			trans	-71	90.9	169.5	-85.8	-87.2	0	0	0	107.8	L442 Q445 Y449	L442-Y447 HydrophobicContact CD1-CE2 3.7Å; L442-Y447 HydrophobicContact CD2-CE2 3.62Å; L442-Y447 HydrophobicContact CG-CE2 4.24Å; Q445-Y447 PolarHBondContact O-N 3.38Å; Y447-Y449 PolarHBondContact O-N 3.44Å
448	D	21.3	Very low	26	Very low	143 Å²	143	135.6 Å²	135.6	77%	0.765	74%	0.742	S	S	*	*			trans	-64.8	93.7	152.5	-86.7	-27.8	0	0	0	106.6	Q446 P450	Q446-D448 VanDerWaalsContact C-N 3.25Å; Q446-D448 PolarHBondContact O-N 3.29Å; D448-P450 WeakPolarHBondContact O-CD 3.42Å
449	Y	27.1	Very low	25.6	Very low	191 Å²	191	140.6 Å²	140.6	75%	0.749	76%	0.764	S	S	*	*			trans	-64.8	117	167.2	-81.2	-91	0	0	0	108.3	Y447 R451	Y447-Y449 PolarHBondContact O-N 3.44Å; Y449-R451 PolarHBondContact O-N 2.71Å
450	P	23.9	Very low	25.5	Very low	123 Å²	123	143.2 Å²	143.2	80%	0.799	78%	0.779	S	S	*	*			trans	-64.9	110.7	156.6	27.2	-28.6	0	0	0	107	D448 S452	D448-P450 WeakPolarHBondContact O-CD 3.42Å; P450-S452 PolarHBondContact O-N 3.46Å
451	R	23.3	Very low	25.2	Very low	227 Å²	227	145.7 Å²	145.7	86%	0.857	79%	0.794	S	S	*	*			trans	-53.7	135	165.3	-81.4	178.5	169.4	172.4	-3	109.3	Y449	Y449-R451 PolarHBondContact O-N 2.71Å
452	S	29.3	Very low	25.3	Very low	98 Å²	98	149.1 Å²	149.1	69%	0.685	80%	0.802	S	S	*	*			trans	56.7	125.3	147.3	59.7	0	0	0	0	118.7	P450	P450-S452 PolarHBondContact O-N 3.46Å
453	E	24.7	Very low	25.3	Very low	197 Å²	197	155.8 Å²	155.8	92%	0.921	84%	0.839	S	S	*	*				178.9	125	111.4	-95.1	174.9	-168	0	0	109.1
454	G	33.8	Very low	25.3	Very low	157 Å²	157	163.3 Å²	163.3	100%	1.619	85%	0.846	S	S	*	*			trans	146.4	0	174.1	0	0	0	0	0	113.7

Retrieved 454 of 454 residues in 324.8 ms (Link to these results)

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