A0A087YPG0_POEFO Loading...

Calcium binding protein 7

AlphaFold DB , UniProt , Accession A0A087YPG0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 213 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	40.1	Very low	42.8	Very low	230 Å²	230	160.9 Å²	160.9	100%	1.133	84%	0.835	S	S	*	*				0	135.9	0	-67	-56.5	-169.4	0	0	108.2
2	P	51.5	Low	42.8	Very low	117 Å²	117	164.9 Å²	164.9	76%	0.76	83%	0.834	S	S	*	*			cis	-67.9	-140.8	-16.8	-12.6	31.4	0	0	0	109.5
3	V	39.6	Very low	42.6	Very low	136 Å²	136	167.5 Å²	167.5	82%	0.824	84%	0.836	S	S	*	*			cis	-132.1	-158.9	-3	-146.5	0	0	0	0	108.9
4	R	35	Very low	42.2	Very low	243 Å²	243	160.4 Å²	160.4	92%	0.917	83%	0.827	S	S	*	*			trans	-142.4	163	-178.9	-60.4	175.2	93.2	147	0.7	112.6
5	A	46	Very low	42	Very low	93 Å²	93	160 Å²	160	77%	0.769	83%	0.825	S	S	*	*			trans	-68.1	164.8	-174.1	0	0	0	0	0	116
6	V	38.8	Very low	41.6	Very low	141 Å²	141	157.8 Å²	157.8	86%	0.855	83%	0.826	S	S	*	*			trans	-130.3	142.5	156.4	-177.6	0	0	0	0	108.2
7	T	47.8	Very low	41.4	Very low	119 Å²	119	155.1 Å²	155.1	73%	0.73	82%	0.818	S	S	*	*			trans	-104.7	-162.1	-179	52.2	0	0	0	0	111
8	T	40.1	Very low	41.3	Very low	125 Å²	125	153.9 Å²	153.9	77%	0.767	81%	0.811	S	S	*	*			trans	83	105.4	176.4	-33.6	0	0	0	0	112.4
9	R	40.4	Very low	41.2	Very low	219 Å²	219	151.5 Å²	151.5	83%	0.826	81%	0.805	S	S	*	*				80.5	102.7	53.3	-169.4	-171.6	-179.4	169.8	2.1	113.1
10	F	46.3	Very low	40.9	Very low	191 Å²	191	148.9 Å²	148.9	84%	0.838	79%	0.791	S	S	*	*			trans	46.6	102.9	158.3	-78.2	-103.8	0	0	0	118.8
11	M	45.4	Very low	41.1	Very low	156 Å²	156	146.4 Å²	146.4	77%	0.768	78%	0.782	S	S	*	*				-157.9	163.1	117.5	-59.2	-154.1	-172.1	0	0	106.3
12	Y	43	Very low	41.1	Very low	209 Å²	209	142.5 Å²	142.5	82%	0.82	76%	0.764	S	S	*	*			cis	-139.2	166.4	15.2	-95.4	-82.8	0	0	0	112.8
13	K	40.2	Very low	40.4	Very low	199 Å²	199	142.5 Å²	142.5	87%	0.865	76%	0.762	S	S	*	*			trans	-64.2	147.9	160.2	-69.5	173.2	170.7	178.9	0	111.6
14	G	37	Very low	40.2	Very low	68 Å²	68	143 Å²	143	70%	0.701	75%	0.75	S	S	*	*			trans	91.1	106.7	135	0	0	0	0	0	118
15	L	37.9	Very low	40.6	Very low	154 Å²	154	140.7 Å²	140.7	81%	0.806	74%	0.742	S	S	*	*			trans	-156.3	93.4	139.9	-112.5	160.6	0	0	0	108.4	T17	L15-T17 HydrophobicContact CD2-CG2 4.08Å; L15-T17 PolarHBondContact O-N 2.71Å
16	C	36.7	Very low	40.2	Very low	124 Å²	124	141.2 Å²	141.2	84%	0.838	74%	0.736	S	S	*	*			trans	-78.7	73.5	170.7	-63.2	0	0	0	0	109.2	I18	C16-I18 PolarHBondContact O-N 2.81Å; C16-I18 VanDerWaalsContact O-N 3.09Å
17	T	38	Very low	40.3	Very low	113 Å²	113	139.7 Å²	139.7	69%	0.693	73%	0.729	S	S	*	*			trans	-71.3	96.6	161.6	49.1	0	0	0	0	107.6	L15 P19	L15-T17 HydrophobicContact CD2-CG2 4.08Å; L15-T17 PolarHBondContact O-N 2.71Å; T17-P19 VanDerWaalsContact O-CD 3.26Å; T17-P19 WeakPolarHBondContact O-CD 3.06Å
18	I	39.7	Very low	40.1	Very low	133 Å²	133	136.4 Å²	136.4	68%	0.682	71%	0.708	S	S	*	*			trans	-59.7	119.2	172.5	-60.6	171.9	0	0	0	107.4	C16 V21	C16-I18 PolarHBondContact O-N 2.81Å; C16-I18 VanDerWaalsContact O-N 3.09Å; I18-V21 HydrophobicContact CG2-CG2 4Å
19	P	39.7	Very low	40.4	Very low	108 Å²	108	138 Å²	138	70%	0.701	71%	0.707	S	S	*	*			trans	-77.3	120.8	163.1	3.9	14.6	0	0	0	107.3	T17 V21	T17-P19 VanDerWaalsContact O-CD 3.26Å; T17-P19 WeakPolarHBondContact O-CD 3.06Å; P19-V21 PolarHBondContact O-N 3.09Å; P19-V21 VanDerWaalsContact O-N 3.14Å
20	D	35.5	Very low	40.8	Very low	99 Å²	99	128.1 Å²	128.1	53%	0.529	67%	0.67	S	S	.	*			trans	-26.1	106.8	-176.7	-103.9	-101.6	0	0	0	115.9	L22 T23	D20-L22 PolarHBondContact O-N 3.42Å; D20-T23 PolarHBondContact O-OG1 2.73Å
21	V	44.4	Very low	41	Very low	98 Å²	98	120.9 Å²	120.9	59%	0.594	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	43	174.4	-165.5	0	0	0	0	110.3	I18 P19 Y24	I18-V21 HydrophobicContact CG2-CG2 4Å; P19-V21 PolarHBondContact O-N 3.09Å; P19-V21 VanDerWaalsContact O-N 3.14Å; V21-Y24 WeakPolarHBondContact CA-OH 3.02Å; V21-Y24 HydrophobicContact CG1-CE2 4.26Å
22	L	39.8	Very low	41.2	Very low	147 Å²	147	121.6 Å²	121.6	77%	0.77	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.6	-11.9	-174.8	-70.9	177.3	0	0	0	114.2	D20	D20-L22 PolarHBondContact O-N 3.42Å
23	T	37.2	Very low	41.3	Very low	117 Å²	117	117.9 Å²	117.9	72%	0.718	64%	0.638	S	S	*	*	S	Bend	trans	-98	0.4	-174.2	34.4	0	0	0	0	115.5	D20	D20-T23 PolarHBondContact O-OG1 2.73Å
24	Y	35.3	Very low	41.7	Very low	146 Å²	146	108.9 Å²	108.9	57%	0.573	60%	0.599	S	S	*	*			trans	-108.8	54.6	171.5	30.3	-92.8	0	0	0	112.4	V21 T26	V21-Y24 WeakPolarHBondContact CA-OH 3.02Å; V21-Y24 HydrophobicContact CG1-CE2 4.26Å; Y24-T26 PolarHBondContact O-N 3.35Å; Y24-T26 VanDerWaalsContact O-N 3.14Å
25	R	43.7	Very low	42.6	Very low	195 Å²	195	107.6 Å²	107.6	74%	0.736	58%	0.578	S	S	*	*			trans	-77.9	74.2	150.2	-169.6	179.2	-173.3	-176.4	2	107.5
26	T	38.1	Very low	43.2	Very low	105 Å²	105	105.6 Å²	105.6	64%	0.644	56%	0.564	S	S	*	*			trans	-56.3	126.1	178.5	-43.4	0	0	0	0	109	Y24 V28	Y24-T26 PolarHBondContact O-N 3.35Å; Y24-T26 VanDerWaalsContact O-N 3.14Å; T26-V28 PolarHBondContact O-N 2.85Å
27	P	40.8	Very low	43.9	Very low	109 Å²	109	105.5 Å²	105.5	71%	0.708	55%	0.552	S	S	*	*			trans	-61.4	130.7	176.3	25.6	-33.1	0	0	0	109	H29	P27-H29 VanDerWaalsContact C-N 3.3Å; P27-H29 PolarHBondContact O-N 3.22Å
28	V	42.9	Very low	44.7	Very low	49 Å²	49	100.2 Å²	100.2	30%	0.297	52%	0.519	S	S	.	.			trans	-82.2	79	-168.5	-164.3	0	0	0	0	108.6	T26 L30 P100 L208	T26-V28 PolarHBondContact O-N 2.85Å; V28-L30 VanDerWaalsContact C-N 3.3Å; V28-L30 HydrophobicContact CB-CD1 4.5Å; V28-L30 HydrophobicContact CG1-CD1 3.63Å; V28-L30 PolarHBondContact O-N 3.16Å; V28-P100 HydrophobicContact CG1-CG 4.1Å; V28-P100 HydrophobicContact CG2-CG 4.05Å; V28-L208 HydrophobicContact CG1-CD1 4.03Å; V28-L208 HydrophobicContact CG1-CD2 4.26Å
29	H	46	Very low	45.7	Very low	160 Å²	160	99.9 Å²	99.9	74%	0.741	51%	0.509	S	S	*	.			trans	-77.2	78.2	-170.9	-156.4	-47.6	0	0	0	111.7	P27	P27-H29 VanDerWaalsContact C-N 3.3Å; P27-H29 PolarHBondContact O-N 3.22Å
30	L	50	Low	46.5	Very low	10 Å²	10	99.7 Å²	99.7	5%	0.052	50%	0.499	C	S	.	.			trans	-63.3	151.7	166.2	-88.4	63	0	0	0	110.1	V28 E34 V35 I38 A204	V28-L30 VanDerWaalsContact C-N 3.3Å; V28-L30 HydrophobicContact CB-CD1 4.5Å; V28-L30 HydrophobicContact CG1-CD1 3.63Å; V28-L30 PolarHBondContact O-N 3.16Å; L30-E34 HydrophobicContact CD2-CG 4.29Å; L30-V35 HydrophobicContact CB-CG2 3.56Å; L30-V35 HydrophobicContact CD2-CG2 4.26Å; L30-I38 HydrophobicContact CD2-CD1 3.48Å; L30-I38 VanDerWaalsContact CD2-CD1 3.48Å; L30-A204 HydrophobicContact CD1-CB 4.16Å; L30-A204 HydrophobicContact CD2-CB 4.3Å; L30-A204 HydrophobicContact CG-CB 3.9Å
31	P	49.4	Very low	47.4	Very low	40 Å²	40	96.2 Å²	96.2	26%	0.26	48%	0.484	S	S	.	.			trans	-70.3	147.6	165.1	31	-32.4	0	0	0	110.1	D33 E34 V35 M207	P31-D33 VanDerWaalsContact C-N 3.26Å; P31-D33 PolarHBondContact O-N 3.31Å; P31-E34 VanDerWaalsContact CD-OE2 3.28Å; P31-E34 WeakPolarHBondContact CD-OE2 3.28Å; P31-E34 HydrophobicContact CG-CB 3.86Å; P31-E34 PolarHBondContact O-N 2.97Å; P31-V35 PolarHBondContact O-N 2.84Å; P31-V35 VanDerWaalsContact O-N 3.16Å; P31-M207 HydrophobicContact CG-CB 4.14Å; P31-M207 HydrophobicContact CG-CE 4.11Å; P31-M207 HydrophobicContact CG-CG 3.83Å; P31-M207 HydrophobicContact CG-SD 4.12Å
32	E	50.1	Low	48.2	Very low	170 Å²	170	91.9 Å²	91.9	79%	0.794	46%	0.457	S	S	*	.	H	α-helix	trans	-58.5	-35.6	-173.6	-69.9	173.8	93.3	0	0	112.8	E34 V35 E36	E32-E34 VanDerWaalsContact C-N 3.28Å; E32-E34 PolarHBondContact O-N 3.22Å; E32-V35 PolarHBondContact O-N 3.12Å; E32-E36 WeakPolarHBondContact O-CG 3.08Å; E32-E36 PolarHBondContact O-N 2.79Å
33	D	44.5	Very low	49.2	Very low	131 Å²	131	90 Å²	90	70%	0.701	44%	0.443	S	S	*	.	H	α-helix	trans	-57.8	-39.6	177	-48	-74.9	0	0	0	112.5	P31 E36 E37	P31-D33 VanDerWaalsContact C-N 3.26Å; P31-D33 PolarHBondContact O-N 3.31Å; D33-E36 PolarHBondContact O-N 3.4Å; D33-E37 PolarHBondContact O-N 3.07Å
34	E	48.8	Very low	50.3	Low	11 Å²	11	88.8 Å²	88.8	5%	0.051	44%	0.435	C	S	.	.	H	α-helix	trans	-82	-28.4	-177.8	-168.4	173.1	-131.6	0	0	111.6	L30 P31 E32 E36 I38 L102 A204 M207	L30-E34 HydrophobicContact CD2-CG 4.29Å; P31-E34 VanDerWaalsContact CD-OE2 3.28Å; P31-E34 WeakPolarHBondContact CD-OE2 3.28Å; P31-E34 HydrophobicContact CG-CB 3.86Å; P31-E34 PolarHBondContact O-N 2.97Å; E32-E34 VanDerWaalsContact C-N 3.28Å; E32-E34 PolarHBondContact O-N 3.22Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E34-I38 WeakPolarHBondContact O-CB 3.38Å; E34-I38 WeakPolarHBondContact O-CD1 3.36Å; E34-I38 WeakPolarHBondContact O-CG1 3.13Å; E34-I38 PolarHBondContact O-N 2.86Å; E34-L102 HydrophobicContact CG-CD2 4.09Å; E34-A204 HydrophobicContact CG-CB 4.43Å; E34-A204 WeakPolarHBondContact OE1-CA 3.43Å; E34-A204 VanDerWaalsContact OE1-CB 3.28Å; E34-A204 WeakPolarHBondContact OE1-CB 3.22Å; E34-A204 PolarHBondContact OE1-N 3.46Å; E34-A204 WeakPolarHBondContact OE2-CA 2.85Å; E34-A204 WeakPolarHBondContact OE2-CB 3.44Å; E34-M207 VanDerWaalsContact OE2-CG 3.22Å; E34-M207 WeakPolarHBondContact OE2-CG 3.41Å
35	V	55	Low	51.5	Low	40 Å²	40	83.8 Å²	83.8	24%	0.242	42%	0.416	C	S	.	.	H	α-helix	trans	-66.2	-37.7	166	-177.6	0	0	0	0	110.3	L30 P31 E32 I38 R39 F91	L30-V35 HydrophobicContact CB-CG2 3.56Å; L30-V35 HydrophobicContact CD2-CG2 4.26Å; P31-V35 PolarHBondContact O-N 2.84Å; P31-V35 VanDerWaalsContact O-N 3.16Å; E32-V35 PolarHBondContact O-N 3.12Å; V35-I38 PolarHBondContact O-N 2.92Å; V35-R39 WeakPolarHBondContact O-CB 3.16Å; V35-R39 PolarHBondContact O-N 3.32Å; V35-F91 HydrophobicContact CG1-CE1 4.16Å; V35-F91 HydrophobicContact CG1-CZ 3.84Å
36	E	52.5	Low	52.8	Low	112 Å²	112	75.3 Å²	75.3	52%	0.523	39%	0.385	S	S	.	.	H	α-helix	trans	-67.4	-41.9	173.8	-68.5	-131.3	113.9	0	0	112.4	E32 D33 E34 I38 R39 E40	E32-E36 WeakPolarHBondContact O-CG 3.08Å; E32-E36 PolarHBondContact O-N 2.79Å; D33-E36 PolarHBondContact O-N 3.4Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E36-I38 VanDerWaalsContact C-N 3.34Å; E36-I38 PolarHBondContact O-N 3.31Å; E36-R39 CarbonylContact O-C 3.59Å; E36-R39 WeakPolarHBondContact O-CA 3.16Å; E36-R39 WeakPolarHBondContact O-CB 3.06Å; E36-R39 PolarHBondContact O-N 2.68Å; E36-E40 PolarHBondContact O-N 2.64Å
37	E	51.3	Low	54.2	Low	123 Å²	123	76.4 Å²	76.4	58%	0.575	38%	0.378	S	S	*	.	H	α-helix	trans	-59.3	-43.9	172.5	-74.8	-170.2	176	0	0	112	D33 R39 A41	D33-E37 PolarHBondContact O-N 3.07Å; E37-R39 VanDerWaalsContact C-N 3.25Å; E37-R39 PolarHBondContact O-N 3.4Å; E37-A41 WeakPolarHBondContact O-CB 3.45Å; E37-A41 PolarHBondContact O-N 3.23Å
38	I	53.7	Low	55.9	Low	2 Å²	2	76.6 Å²	76.6	1%	0.01	37%	0.373	C	S	.	.	H	α-helix	trans	-64.6	-31.2	174.8	-67.6	167.8	0	0	0	111.3	L30 E34 V35 E36 F42 F91 F94 V95 L98 L102 M200	L30-I38 HydrophobicContact CD2-CD1 3.48Å; L30-I38 VanDerWaalsContact CD2-CD1 3.48Å; E34-I38 WeakPolarHBondContact O-CB 3.38Å; E34-I38 WeakPolarHBondContact O-CD1 3.36Å; E34-I38 WeakPolarHBondContact O-CG1 3.13Å; E34-I38 PolarHBondContact O-N 2.86Å; V35-I38 PolarHBondContact O-N 2.92Å; E36-I38 VanDerWaalsContact C-N 3.34Å; E36-I38 PolarHBondContact O-N 3.31Å; I38-F42 WeakPolarHBondContact O-CB 3.5Å; I38-F42 PolarHBondContact O-N 2.88Å; I38-F91 HydrophobicContact CG2-CE2 4.28Å; I38-F94 HydrophobicContact CG2-CD1 3.64Å; I38-F94 HydrophobicContact CG2-CE1 3.86Å; I38-V95 HydrophobicContact CG2-CG2 3.79Å; I38-L98 HydrophobicContact CD1-CB 4.38Å; I38-L98 HydrophobicContact CD1-CD2 4.46Å; I38-L98 HydrophobicContact CG1-CD2 4.14Å; I38-L98 HydrophobicContact CG2-CD2 3.91Å; I38-L102 HydrophobicContact CD1-CD2 4.11Å; I38-M200 HydrophobicContact CG1-CE 3.91Å
39	R	60.9	Low	57.7	Low	125 Å²	125	77.1 Å²	77.1	47%	0.472	39%	0.388	S	S	.	.	H	α-helix	trans	-79	-36.8	179.7	-165.5	-177.5	-164	-174.6	8.9	113.6	V35 E36 E37 F42 K43 F91	V35-R39 WeakPolarHBondContact O-CB 3.16Å; V35-R39 PolarHBondContact O-N 3.32Å; E36-R39 CarbonylContact O-C 3.59Å; E36-R39 WeakPolarHBondContact O-CA 3.16Å; E36-R39 WeakPolarHBondContact O-CB 3.06Å; E36-R39 PolarHBondContact O-N 2.68Å; E37-R39 VanDerWaalsContact C-N 3.25Å; E37-R39 PolarHBondContact O-N 3.4Å; R39-F42 PolarHBondContact O-N 2.61Å; R39-K43 WeakPolarHBondContact O-CG 3.2Å; R39-K43 PolarHBondContact O-N 3.47Å; R39-K43 VanDerWaalsContact O-N 3.07Å; R39-F91 HydrophobicContact CB-CE2 3.76Å; R39-F91 HydrophobicContact CB-CZ 3.92Å; R39-F91 HydrophobicContact CG-CE2 3.93Å; R39-F91 HydrophobicContact CG-CZ 4.09Å
40	E	55.6	Low	59.4	Low	104 Å²	104	72.7 Å²	72.7	49%	0.486	37%	0.37	S	S	.	.	H	α-helix	trans	-65.7	-41.3	168.4	-69.3	-53.1	120.3	0	0	110.4	E36 F42 K43 V44	E36-E40 PolarHBondContact O-N 2.64Å; E40-F42 VanDerWaalsContact C-N 3.34Å; E40-F42 PolarHBondContact O-N 2.8Å; E40-K43 PolarHBondContact O-N 3.14Å; E40-K43 IonicContact OE1-NZ 3.84Å; E40-K43 PolarHBondContact OE1-NZ 3.06Å; E40-K43 IonicContact OE2-NZ 3.48Å; E40-V44 PolarHBondContact O-N 3.48Å
41	A	56.4	Low	61	Low	26 Å²	26	73.5 Å²	73.5	22%	0.215	38%	0.381	C	S	.	.	H	α-helix	trans	-59.1	-44.6	171.3	0	0	0	0	0	111.7	E37 K43 V44 F45 M200	E37-A41 WeakPolarHBondContact O-CB 3.45Å; E37-A41 PolarHBondContact O-N 3.23Å; A41-K43 PolarHBondContact O-N 3.44Å; A41-V44 WeakPolarHBondContact O-CB 3.46Å; A41-V44 PolarHBondContact O-N 2.82Å; A41-V44 VanDerWaalsContact O-N 3.07Å; A41-F45 WeakPolarHBondContact O-CD2 3.28Å; A41-M200 HydrophobicContact CB-CE 4.04Å; A41-M200 HydrophobicContact CB-SD 4.47Å
42	F	60.4	Low	62.7	Low	7 Å²	7	75.5 Å²	75.5	3%	0.031	39%	0.386	C	S	.	.	H	α-helix	trans	-57.3	-44.8	177.4	-169.2	-90.6	0	0	0	112.2	I38 R39 E40 V44 F45 D46 G51 I53 F91 F94	I38-F42 WeakPolarHBondContact O-CB 3.5Å; I38-F42 PolarHBondContact O-N 2.88Å; R39-F42 PolarHBondContact O-N 2.61Å; E40-F42 VanDerWaalsContact C-N 3.34Å; E40-F42 PolarHBondContact O-N 2.8Å; F42-V44 PolarHBondContact O-N 3.04Å; F42-V44 VanDerWaalsContact O-N 3.15Å; F42-F45 WeakPolarHBondContact O-CA 3.44Å; F42-F45 PolarHBondContact O-N 3.46Å; F42-D46 HydrophobicContact CD1-CB 3.82Å; F42-D46 HydrophobicContact CE1-CB 3.65Å; F42-D46 PolarHBondContact O-N 2.9Å; F42-G51 VanDerWaalsContact CZ-O 3.26Å; F42-G51 WeakPolarHBondContact CZ-O 3.19Å; F42-I53 HydrophobicContact CD2-CD1 3.63Å; F42-I53 HydrophobicContact CD2-CG1 4.06Å; F42-I53 HydrophobicContact CE1-CG1 4.41Å; F42-I53 HydrophobicContact CE2-CD1 3.58Å; F42-I53 HydrophobicContact CE2-CG1 3.64Å; F42-I53 HydrophobicContact CG-CD1 4.38Å; F42-I53 HydrophobicContact CZ-CD1 4.29Å; F42-I53 HydrophobicContact CZ-CG1 3.84Å; F42-F91 HydrophobicContact CB-CD2 4.1Å; F42-F91 HydrophobicContact CB-CE2 4.36Å; F42-F91 HydrophobicContact CD1-CD2 4.25Å; F42-F91 HydrophobicContact CD2-CB 4.49Å; F42-F91 AromaticContact CD2-CD2 3.89Å; F42-F91 HydrophobicContact CD2-CD2 3.89Å; F42-F91 HydrophobicContact CE1-CB 4.37Å; F42-F91 HydrophobicContact CE2-CB 4.12Å; F42-F91 HydrophobicContact CE2-CD2 4.36Å; F42-F91 AromaticContact CG-CD2 3.82Å; F42-F91 HydrophobicContact CG-CD2 3.82Å; F42-F91 HydrophobicContact CZ-CB 4.05Å; F42-F94 HydrophobicContact CB-CD1 4.43Å; F42-F94 HydrophobicContact CB-CE1 4.35Å; F42-F94 HydrophobicContact CD2-CB 3.98Å; F42-F94 AromaticContact CD2-CD1 3.74Å; F42-F94 HydrophobicContact CD2-CD1 3.74Å; F42-F94 HydrophobicContact CD2-CD2 4.37Å; F42-F94 HydrophobicContact CD2-CE1 4.25Å; F42-F94 AromaticContact CD2-CG 3.8Å; F42-F94 HydrophobicContact CD2-CG 3.8Å; F42-F94 HydrophobicContact CE2-CB 4.05Å; F42-F94 HydrophobicContact CE2-CG 4.27Å
43	K	61.6	Low	64	Low	109 Å²	109	67.7 Å²	67.7	47%	0.474	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-13.4	175.7	-69.2	167.9	-176.3	172.8	0	115.2	R39 E40 A41 D46	R39-K43 WeakPolarHBondContact O-CG 3.2Å; R39-K43 PolarHBondContact O-N 3.47Å; R39-K43 VanDerWaalsContact O-N 3.07Å; E40-K43 PolarHBondContact O-N 3.14Å; E40-K43 IonicContact OE1-NZ 3.84Å; E40-K43 PolarHBondContact OE1-NZ 3.06Å; E40-K43 IonicContact OE2-NZ 3.48Å; A41-K43 PolarHBondContact O-N 3.44Å; K43-D46 VanDerWaalsContact O-O 3.09Å
44	V	58.9	Low	65.9	Low	90 Å²	90	62.4 Å²	62.4	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-80.9	-24.1	172.4	177.3	0	0	0	0	111.1	E40 A41 F42	E40-V44 PolarHBondContact O-N 3.48Å; A41-V44 WeakPolarHBondContact O-CB 3.46Å; A41-V44 PolarHBondContact O-N 2.82Å; A41-V44 VanDerWaalsContact O-N 3.07Å; F42-V44 PolarHBondContact O-N 3.04Å; F42-V44 VanDerWaalsContact O-N 3.15Å
45	F	61.8	Low	67.5	Low	41 Å²	41	63.8 Å²	63.8	18%	0.18	33%	0.328	C	S	.	.	H	α-helix	trans	-94.1	-52.8	175.1	-62.2	-83	0	0	0	111.8	A41 F42 R47 I53 E57 A61 F94	A41-F45 WeakPolarHBondContact O-CD2 3.28Å; F42-F45 WeakPolarHBondContact O-CA 3.44Å; F42-F45 PolarHBondContact O-N 3.46Å; F45-R47 PolarHBondContact O-N 3.12Å; F45-R47 VanDerWaalsContact O-N 3.15Å; F45-I53 HydrophobicContact CB-CB 4.46Å; F45-I53 HydrophobicContact CB-CD1 3.54Å; F45-I53 HydrophobicContact CB-CG1 3.68Å; F45-I53 HydrophobicContact CB-CG2 3.92Å; F45-I53 HydrophobicContact CD2-CD1 4.37Å; F45-I53 HydrophobicContact CG-CD1 4.1Å; F45-E57 WeakPolarHBondContact O-CB 3.1Å; F45-A61 HydrophobicContact CD1-CB 3.39Å; F45-A61 HydrophobicContact CE1-CB 3.57Å; F45-A61 HydrophobicContact CG-CB 4.48Å; F45-F94 HydrophobicContact CD2-CZ 4.5Å; F45-F94 HydrophobicContact CE2-CZ 4.49Å
46	D	69.9	Low	68.8	Low	17 Å²	17	69.2 Å²	69.2	9%	0.091	35%	0.351	C	S	.	.			trans	-67.6	101.5	171.7	174.9	6.8	0	0	0	109.5	F42 K43 G49 N50 G51	F42-D46 HydrophobicContact CD1-CB 3.82Å; F42-D46 HydrophobicContact CE1-CB 3.65Å; F42-D46 PolarHBondContact O-N 2.9Å; K43-D46 VanDerWaalsContact O-O 3.09Å; D46-G49 WeakPolarHBondContact OD1-CA 3.43Å; D46-G49 PolarHBondContact OD1-N 2.98Å; D46-N50 PolarHBondContact OD1-N 2.97Å; D46-G51 WeakPolarHBondContact OD2-CA 3.07Å; D46-G51 PolarHBondContact OD2-N 3.01Å
47	R	68.1	Low	70	Confident	129 Å²	129	64.6 Å²	64.6	49%	0.487	33%	0.329	S	S	.	.			trans	-105	-24.7	-170.4	-79.3	-174.2	173.7	-160.7	-1.1	113.9	F45 E57 M60	F45-R47 PolarHBondContact O-N 3.12Å; F45-R47 VanDerWaalsContact O-N 3.15Å; R47-E57 HydrophobicContact CB-CG 4.44Å; R47-E57 PolarHBondContact N-OE1 2.51Å; R47-M60 PolarHBondContact NH1-SD 3.43Å
48	D	76.6	Confident	70.9	Confident	113 Å²	113	59.6 Å²	59.6	60%	0.604	31%	0.307	S	S	*	.	S	Bend	trans	-87.1	-13.8	170	74.3	0.8	0	0	0	112.6	N50 E57	D48-N50 VanDerWaalsContact CG-ND2 3.28Å; D48-N50 WeakPolarHBondContact OD1-CB 3.3Å; D48-N50 PolarHBondContact OD1-N 2.93Å; D48-N50 PolarHBondContact OD1-ND2 3.4Å; D48-N50 PolarHBondContact OD2-ND2 2.69Å; D48-N50 VanDerWaalsContact OD2-ND2 3.09Å; D48-E57 PolarHBondContact N-OE1 3.36Å
49	G	81	Confident	71.6	Confident	59 Å²	59	59.5 Å²	59.5	61%	0.608	31%	0.306	S	S	*	.			trans	83.1	22.2	177.6	0	0	0	0	0	113.5	D46 G51	D46-G49 WeakPolarHBondContact OD1-CA 3.43Å; D46-G49 PolarHBondContact OD1-N 2.98Å; G49-G51 VanDerWaalsContact C-N 3.35Å
50	N	81.9	Confident	71.8	Confident	67 Å²	67	57.6 Å²	57.6	36%	0.358	30%	0.304	S	S	.	.	S	Bend	trans	-77.4	-16	-174.4	76.6	49.8	0	0	0	114.1	D46 D48 F52	D46-N50 PolarHBondContact OD1-N 2.97Å; D48-N50 VanDerWaalsContact CG-ND2 3.28Å; D48-N50 WeakPolarHBondContact OD1-CB 3.3Å; D48-N50 PolarHBondContact OD1-N 2.93Å; D48-N50 PolarHBondContact OD1-ND2 3.4Å; D48-N50 PolarHBondContact OD2-ND2 2.69Å; D48-N50 VanDerWaalsContact OD2-ND2 3.09Å; N50-F52 WeakPolarHBondContact OD1-CA 3.05Å; N50-F52 VanDerWaalsContact OD1-CB 3.26Å; N50-F52 WeakPolarHBondContact OD1-CB 3.12Å; N50-F52 WeakPolarHBondContact OD1-CD2 3.32Å; N50-F52 PolarHBondContact OD1-N 2.63Å; N50-F52 PolarHBondContact OD1-O 3.05Å; N50-F52 VanDerWaalsContact OD1-O 3.13Å
51	G	82.4	Confident	72.1	Confident	28 Å²	28	53 Å²	53	29%	0.289	28%	0.283	S	S	.	.	S	Bend	trans	96	3.9	-178.7	0	0	0	0	0	115.6	F42 D46 G49	F42-G51 VanDerWaalsContact CZ-O 3.26Å; F42-G51 WeakPolarHBondContact CZ-O 3.19Å; D46-G51 WeakPolarHBondContact OD2-CA 3.07Å; D46-G51 PolarHBondContact OD2-N 3.01Å; G49-G51 VanDerWaalsContact C-N 3.35Å
52	F	84.9	Confident	72.3	Confident	82 Å²	82	52 Å²	52	36%	0.36	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-135.4	138.6	-179.8	-54.9	-103	0	0	0	109.7	N50 S54 Q88 V89	N50-F52 WeakPolarHBondContact OD1-CA 3.05Å; N50-F52 VanDerWaalsContact OD1-CB 3.26Å; N50-F52 WeakPolarHBondContact OD1-CB 3.12Å; N50-F52 WeakPolarHBondContact OD1-CD2 3.32Å; N50-F52 PolarHBondContact OD1-N 2.63Å; N50-F52 PolarHBondContact OD1-O 3.05Å; N50-F52 VanDerWaalsContact OD1-O 3.13Å; F52-S54 PolarHBondContact O-N 3.14Å; F52-Q88 HydrophobicContact CB-CB 4.01Å; F52-V89 CarbonylContact C-O 3.23Å; F52-V89 WeakPolarHBondContact CA-O 3.33Å
53	I	78.7	Confident	72.2	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.031	29%	0.292	C	S	.	.			trans	-86.3	108.5	173.7	-59.7	166.2	0	0	0	108.4	F42 F45 L58 V89 F94	F42-I53 HydrophobicContact CD2-CD1 3.63Å; F42-I53 HydrophobicContact CD2-CG1 4.06Å; F42-I53 HydrophobicContact CE1-CG1 4.41Å; F42-I53 HydrophobicContact CE2-CD1 3.58Å; F42-I53 HydrophobicContact CE2-CG1 3.64Å; F42-I53 HydrophobicContact CG-CD1 4.38Å; F42-I53 HydrophobicContact CZ-CD1 4.29Å; F42-I53 HydrophobicContact CZ-CG1 3.84Å; F45-I53 HydrophobicContact CB-CB 4.46Å; F45-I53 HydrophobicContact CB-CD1 3.54Å; F45-I53 HydrophobicContact CB-CG1 3.68Å; F45-I53 HydrophobicContact CB-CG2 3.92Å; F45-I53 HydrophobicContact CD2-CD1 4.37Å; F45-I53 HydrophobicContact CG-CD1 4.1Å; I53-L58 HydrophobicContact CG2-CB 4.04Å; I53-V89 HydrophobicContact CB-CB 4.34Å; I53-V89 PolarHBondContact N-O 2.8Å; I53-V89 PolarHBondContact O-N 2.93Å; I53-V89 VanDerWaalsContact O-N 3.1Å; I53-F94 HydrophobicContact CD1-CD2 3.97Å; I53-F94 HydrophobicContact CD1-CE2 3.95Å
54	S	84.4	Confident	71.5	Confident	20 Å²	20	55.3 Å²	55.3	14%	0.14	30%	0.295	C	S	.	.			trans	-73.1	157.1	176.4	74	0	0	0	0	112.4	F52 Q56 E57 L58	F52-S54 PolarHBondContact O-N 3.14Å; S54-Q56 PolarHBondContact O-N 3.09Å; S54-Q56 VanDerWaalsContact O-N 3.07Å; S54-Q56 PolarHBondContact OG-N 2.81Å; S54-E57 WeakPolarHBondContact CB-OE2 3.26Å; S54-E57 PolarHBondContact N-OE2 3.49Å; S54-E57 VanDerWaalsContact N-OE2 3.08Å; S54-E57 PolarHBondContact O-N 3.01Å; S54-E57 VanDerWaalsContact O-N 3.12Å; S54-E57 WeakPolarHBondContact OG-CG 3.47Å; S54-E57 PolarHBondContact OG-N 2.9Å; S54-E57 PolarHBondContact OG-OE2 3.01Å; S54-L58 WeakPolarHBondContact O-CB 3.42Å; S54-L58 PolarHBondContact O-N 3.44Å
55	K	81.4	Confident	71	Confident	39 Å²	39	53.5 Å²	53.5	17%	0.17	28%	0.282	C	S	.	.	H	α-helix	trans	-48.8	-34.1	169.4	-169.3	-175.3	178.7	-175.1	0	113.1	G59 E71 L74 E75 I78	K55-G59 PolarHBondContact O-N 3.34Å; K55-E71 WeakPolarHBondContact CE-O 3.4Å; K55-E71 PolarHBondContact NZ-O 2.96Å; K55-E71 IonicContact NZ-OE1 3.99Å; K55-L74 HydrophobicContact CD-CB 4.42Å; K55-L74 HydrophobicContact CG-CB 3.79Å; K55-E75 IonicContact NZ-OE2 3.12Å; K55-E75 PolarHBondContact NZ-OE2 3.14Å; K55-I78 HydrophobicContact CB-CD1 4.49Å; K55-I78 HydrophobicContact CB-CG1 3.99Å; K55-I78 HydrophobicContact CG-CG1 4.14Å
56	Q	82.4	Confident	70.1	Confident	155 Å²	155	54.3 Å²	54.3	72%	0.724	30%	0.302	S	S	*	.	H	α-helix	trans	-75.7	-40.4	-177.1	-57.5	-175.1	22.5	0	0	111.8	S54 M60	S54-Q56 PolarHBondContact O-N 3.09Å; S54-Q56 VanDerWaalsContact O-N 3.07Å; S54-Q56 PolarHBondContact OG-N 2.81Å; Q56-M60 WeakPolarHBondContact O-CB 3.35Å; Q56-M60 PolarHBondContact O-N 3.07Å
57	E	77.6	Confident	69	Low	15 Å²	15	54.8 Å²	54.8	7%	0.07	30%	0.303	C	S	.	.	H	α-helix	trans	-74.4	-43.5	178.9	-74.2	163.4	120	0	0	112.4	F45 R47 D48 S54 G59 M60 A61	F45-E57 WeakPolarHBondContact O-CB 3.1Å; R47-E57 HydrophobicContact CB-CG 4.44Å; R47-E57 PolarHBondContact N-OE1 2.51Å; D48-E57 PolarHBondContact N-OE1 3.36Å; S54-E57 WeakPolarHBondContact CB-OE2 3.26Å; S54-E57 PolarHBondContact N-OE2 3.49Å; S54-E57 VanDerWaalsContact N-OE2 3.08Å; S54-E57 PolarHBondContact O-N 3.01Å; S54-E57 VanDerWaalsContact O-N 3.12Å; S54-E57 WeakPolarHBondContact OG-CG 3.47Å; S54-E57 PolarHBondContact OG-N 2.9Å; S54-E57 PolarHBondContact OG-OE2 3.01Å; E57-G59 VanDerWaalsContact C-N 3.26Å; E57-G59 PolarHBondContact O-N 3.5Å; E57-M60 CarbonylContact O-C 3.05Å; E57-M60 WeakPolarHBondContact O-CA 3.29Å; E57-M60 WeakPolarHBondContact O-CB 3.35Å; E57-M60 PolarHBondContact O-N 3.19Å; E57-A61 PolarHBondContact O-N 3.35Å
58	L	70.7	Confident	68.3	Low	18 Å²	18	56 Å²	56	9%	0.094	32%	0.316	C	S	.	.	H	α-helix	trans	-51.1	-50.6	168.9	175.6	63.1	0	0	0	110	I53 S54 M60 A61 M62 L74 I77 I78	I53-L58 HydrophobicContact CG2-CB 4.04Å; S54-L58 WeakPolarHBondContact O-CB 3.42Å; S54-L58 PolarHBondContact O-N 3.44Å; L58-M60 VanDerWaalsContact C-N 3.29Å; L58-M60 PolarHBondContact O-N 3.41Å; L58-A61 PolarHBondContact O-N 3.37Å; L58-M62 HydrophobicContact CD1-CG 4.38Å; L58-M62 HydrophobicContact CD1-SD 3.89Å; L58-M62 HydrophobicContact CD2-SD 4.49Å; L58-M62 HydrophobicContact CG-SD 3.74Å; L58-M62 WeakPolarHBondContact O-CB 3.35Å; L58-M62 WeakPolarHBondContact O-CG 3.08Å; L58-M62 PolarHBondContact O-N 2.87Å; L58-L74 HydrophobicContact CB-CD2 4.43Å; L58-L74 HydrophobicContact CD2-CD2 4.05Å; L58-L74 HydrophobicContact CG-CD2 3.96Å; L58-I77 HydrophobicContact CD2-CB 4.2Å; L58-I77 HydrophobicContact CD2-CG2 3.71Å; L58-I78 HydrophobicContact CB-CD1 4.41Å; L58-I78 HydrophobicContact CD2-CD1 3.62Å; L58-I78 HydrophobicContact CD2-CG1 3.91Å
59	G	67.8	Low	67.3	Low	0 Å²	0	51 Å²	51	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-31	174.6	0	0	0	0	0	114	K55 E57 R63	K55-G59 PolarHBondContact O-N 3.34Å; E57-G59 VanDerWaalsContact C-N 3.26Å; E57-G59 PolarHBondContact O-N 3.5Å; G59-R63 VanDerWaalsContact C-NH2 3.29Å; G59-R63 VanDerWaalsContact O-CB 3.31Å; G59-R63 WeakPolarHBondContact O-CB 3.41Å; G59-R63 WeakPolarHBondContact O-CG 3.33Å; G59-R63 PolarHBondContact O-N 3.49Å; G59-R63 PolarHBondContact O-NE 3.46Å; G59-R63 PolarHBondContact O-NH1 3.39Å; G59-R63 PolarHBondContact O-NH2 2.75Å
60	M	66.3	Low	66.1	Low	85 Å²	85	52.1 Å²	52.1	42%	0.419	28%	0.282	S	S	.	.	H	α-helix	trans	-75.4	-37.8	177.9	-164.7	177.8	-61.5	0	0	112.2	R47 Q56 E57 L58 S64	R47-M60 PolarHBondContact NH1-SD 3.43Å; Q56-M60 WeakPolarHBondContact O-CB 3.35Å; Q56-M60 PolarHBondContact O-N 3.07Å; E57-M60 CarbonylContact O-C 3.05Å; E57-M60 WeakPolarHBondContact O-CA 3.29Å; E57-M60 WeakPolarHBondContact O-CB 3.35Å; E57-M60 PolarHBondContact O-N 3.19Å; L58-M60 VanDerWaalsContact C-N 3.29Å; L58-M60 PolarHBondContact O-N 3.41Å; M60-S64 WeakPolarHBondContact O-CB 3.02Å; M60-S64 PolarHBondContact O-N 2.79Å; M60-S64 PolarHBondContact O-OG 3.31Å
61	A	60.4	Low	65.5	Low	6 Å²	6	55.8 Å²	55.8	5%	0.05	30%	0.297	C	S	.	.	H	α-helix	trans	-65.4	-47.7	171.8	0	0	0	0	0	110.7	F45 E57 L58 R63 S64 L65	F45-A61 HydrophobicContact CD1-CB 3.39Å; F45-A61 HydrophobicContact CE1-CB 3.57Å; F45-A61 HydrophobicContact CG-CB 4.48Å; E57-A61 PolarHBondContact O-N 3.35Å; L58-A61 PolarHBondContact O-N 3.37Å; A61-R63 VanDerWaalsContact C-N 3.34Å; A61-R63 PolarHBondContact O-N 2.95Å; A61-S64 CarbonylContact O-C 3.56Å; A61-S64 WeakPolarHBondContact O-CA 3.16Å; A61-S64 WeakPolarHBondContact O-CB 3.08Å; A61-S64 PolarHBondContact O-N 3.41Å; A61-L65 WeakPolarHBondContact O-CG 3.43Å; A61-L65 PolarHBondContact O-N 2.95Å
62	M	60.3	Low	64.6	Low	7 Å²	7	59.2 Å²	59.2	3%	0.034	31%	0.312	C	S	.	.	H	α-helix	trans	-58.3	-43.4	175.3	-67.2	164.8	106.5	0	0	112.1	L58 S64 L65 G66 Y67 P69 L74 I77 I193	L58-M62 HydrophobicContact CD1-CG 4.38Å; L58-M62 HydrophobicContact CD1-SD 3.89Å; L58-M62 HydrophobicContact CD2-SD 4.49Å; L58-M62 HydrophobicContact CG-SD 3.74Å; L58-M62 WeakPolarHBondContact O-CB 3.35Å; L58-M62 WeakPolarHBondContact O-CG 3.08Å; L58-M62 PolarHBondContact O-N 2.87Å; M62-S64 VanDerWaalsContact C-N 3.33Å; M62-S64 PolarHBondContact O-N 2.88Å; M62-L65 CarbonylContact O-C 3.41Å; M62-L65 WeakPolarHBondContact O-CA 3.25Å; M62-L65 PolarHBondContact O-N 2.79Å; M62-L65 VanDerWaalsContact O-N 3.1Å; M62-G66 PolarHBondContact O-N 3.06Å; M62-Y67 CarbonylContact C-O 3.08Å; M62-Y67 HydrophobicContact CB-CD1 4.25Å; M62-Y67 HydrophobicContact CE-CD1 3.95Å; M62-Y67 HydrophobicContact CE-CE1 3.65Å; M62-Y67 PolarHBondContact O-N 2.97Å; M62-Y67 VanDerWaalsContact O-N 3.08Å; M62-P69 HydrophobicContact CB-CG 3.99Å; M62-P69 HydrophobicContact CE-CB 4.4Å; M62-P69 HydrophobicContact CE-CG 4.32Å; M62-P69 HydrophobicContact SD-CB 4.43Å; M62-P69 HydrophobicContact SD-CG 3.8Å; M62-L74 HydrophobicContact SD-CD2 3.64Å; M62-I77 HydrophobicContact CE-CD1 3.47Å; M62-I77 VanDerWaalsContact CE-CD1 3.47Å; M62-I193 HydrophobicContact CE-CD1 3.44Å; M62-I193 VanDerWaalsContact CE-CD1 3.44Å; M62-I193 HydrophobicContact CG-CD1 4.49Å
63	R	58.8	Low	63.1	Low	107 Å²	107	58.4 Å²	58.4	40%	0.404	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-34.8	173	-76	-178.8	-63.2	-95	0.7	113	G59 A61 L65 G66 Y67 M68	G59-R63 VanDerWaalsContact C-NH2 3.29Å; G59-R63 VanDerWaalsContact O-CB 3.31Å; G59-R63 WeakPolarHBondContact O-CB 3.41Å; G59-R63 WeakPolarHBondContact O-CG 3.33Å; G59-R63 PolarHBondContact O-N 3.49Å; G59-R63 PolarHBondContact O-NE 3.46Å; G59-R63 PolarHBondContact O-NH1 3.39Å; G59-R63 PolarHBondContact O-NH2 2.75Å; A61-R63 VanDerWaalsContact C-N 3.34Å; A61-R63 PolarHBondContact O-N 2.95Å; R63-L65 VanDerWaalsContact C-N 3.27Å; R63-L65 PolarHBondContact O-N 2.77Å; R63-G66 PolarHBondContact O-N 3.39Å; R63-Y67 WeakPolarHBondContact CA-O 3.26Å; R63-Y67 PolarHBondContact N-O 3.11Å; R63-Y67 VanDerWaalsContact N-O 3.13Å; R63-M68 HydrophobicContact CG-CG 4.17Å
64	S	48	Very low	62.3	Low	78 Å²	78	58.6 Å²	58.6	55%	0.545	31%	0.31	S	S	.	.	H	α-helix	trans	-66.9	-29.9	172.9	-54.4	0	0	0	0	112	M60 A61 M62 G66	M60-S64 WeakPolarHBondContact O-CB 3.02Å; M60-S64 PolarHBondContact O-N 2.79Å; M60-S64 PolarHBondContact O-OG 3.31Å; A61-S64 CarbonylContact O-C 3.56Å; A61-S64 WeakPolarHBondContact O-CA 3.16Å; A61-S64 WeakPolarHBondContact O-CB 3.08Å; A61-S64 PolarHBondContact O-N 3.41Å; M62-S64 VanDerWaalsContact C-N 3.33Å; M62-S64 PolarHBondContact O-N 2.88Å; S64-G66 VanDerWaalsContact C-N 3.29Å
65	L	47	Very low	61.4	Low	52 Å²	52	62.3 Å²	62.3	27%	0.272	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	8.2	173.6	-63	170	0	0	0	113.6	A61 M62 R63	A61-L65 WeakPolarHBondContact O-CG 3.43Å; A61-L65 PolarHBondContact O-N 2.95Å; M62-L65 CarbonylContact O-C 3.41Å; M62-L65 WeakPolarHBondContact O-CA 3.25Å; M62-L65 PolarHBondContact O-N 2.79Å; M62-L65 VanDerWaalsContact O-N 3.1Å; R63-L65 VanDerWaalsContact C-N 3.27Å; R63-L65 PolarHBondContact O-N 2.77Å
66	G	44.2	Very low	60.3	Low	58 Å²	58	64.6 Å²	64.6	60%	0.598	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	6.4	173.5	0	0	0	0	0	116.4	M62 R63 S64	M62-G66 PolarHBondContact O-N 3.06Å; R63-G66 PolarHBondContact O-N 3.39Å; S64-G66 VanDerWaalsContact C-N 3.29Å
67	Y	47.1	Very low	59.5	Low	26 Å²	26	59.4 Å²	59.4	10%	0.102	32%	0.319	C	S	.	.			trans	-108.2	137.1	173.8	170.3	-122.7	0	0	0	110.7	M62 R63 P69 E73 C189 I193	M62-Y67 CarbonylContact C-O 3.08Å; M62-Y67 HydrophobicContact CB-CD1 4.25Å; M62-Y67 HydrophobicContact CE-CD1 3.95Å; M62-Y67 HydrophobicContact CE-CE1 3.65Å; M62-Y67 PolarHBondContact O-N 2.97Å; M62-Y67 VanDerWaalsContact O-N 3.08Å; R63-Y67 WeakPolarHBondContact CA-O 3.26Å; R63-Y67 PolarHBondContact N-O 3.11Å; R63-Y67 VanDerWaalsContact N-O 3.13Å; Y67-P69 VanDerWaalsContact C-CD 3.45Å; Y67-P69 HydrophobicContact CD1-CB 4.28Å; Y67-P69 HydrophobicContact CD1-CG 4.36Å; Y67-P69 HydrophobicContact CE1-CB 3.67Å; Y67-P69 HydrophobicContact CE1-CG 4.2Å; Y67-P69 WeakPolarHBondContact O-CD 3.3Å; Y67-E73 PolarHBondContact OH-OE1 2.89Å; Y67-C189 VanDerWaalsContact CB-CB 3.43Å; Y67-C189 WeakPolarHBondContact CB-SG 3.45Å; Y67-C189 HydrophobicContact CD1-CB 4.05Å; Y67-C189 HydrophobicContact CD2-CB 4.08Å; Y67-C189 HydrophobicContact CG-CB 3.61Å; Y67-I193 HydrophobicContact CD1-CD1 4.17Å; Y67-I193 HydrophobicContact CE1-CD1 4.32Å
68	M	52.6	Low	59.1	Low	154 Å²	154	58.9 Å²	58.9	76%	0.759	32%	0.317	S	S	*	.			trans	-116	75.5	-172.4	-163.3	142.1	65.1	0	0	109.6	R63	R63-M68 HydrophobicContact CG-CG 4.17Å
69	P	55.3	Low	59	Low	8 Å²	8	65 Å²	65	5%	0.052	35%	0.345	C	S	.	.			trans	-63.8	142.9	-177.4	29.1	-37.1	0	0	0	110.4	M62 Y67 E73 L74	M62-P69 HydrophobicContact CB-CG 3.99Å; M62-P69 HydrophobicContact CE-CB 4.4Å; M62-P69 HydrophobicContact CE-CG 4.32Å; M62-P69 HydrophobicContact SD-CB 4.43Å; M62-P69 HydrophobicContact SD-CG 3.8Å; Y67-P69 VanDerWaalsContact C-CD 3.45Å; Y67-P69 HydrophobicContact CD1-CB 4.28Å; Y67-P69 HydrophobicContact CD1-CG 4.36Å; Y67-P69 HydrophobicContact CE1-CB 3.67Å; Y67-P69 HydrophobicContact CE1-CG 4.2Å; Y67-P69 WeakPolarHBondContact O-CD 3.3Å; P69-E73 WeakPolarHBondContact CA-OE2 2.91Å; P69-E73 HydrophobicContact CB-CB 4.15Å; P69-L74 HydrophobicContact CB-CD2 4.2Å; P69-L74 HydrophobicContact CB-CG 4.01Å; P69-L74 HydrophobicContact CG-CD1 4.19Å; P69-L74 HydrophobicContact CG-CD2 3.79Å; P69-L74 HydrophobicContact CG-CG 3.92Å
70	N	55.6	Low	58.8	Low	83 Å²	83	74.8 Å²	74.8	44%	0.444	38%	0.382	S	S	.	.			trans	-78	168.9	171.3	80.2	69.6	0	0	0	111.3	V72 E73 L74	N70-V72 VanDerWaalsContact C-N 3.25Å; N70-V72 PolarHBondContact O-N 2.98Å; N70-V72 WeakPolarHBondContact OD1-CA 3.33Å; N70-V72 WeakPolarHBondContact OD1-CB 3.39Å; N70-V72 PolarHBondContact OD1-N 2.68Å; N70-E73 VanDerWaalsContact CG-OE2 3.32Å; N70-E73 PolarHBondContact N-OE2 3.41Å; N70-E73 VanDerWaalsContact ND2-CG 3.34Å; N70-E73 WeakPolarHBondContact ND2-CG 3.22Å; N70-E73 PolarHBondContact ND2-OE2 2.92Å; N70-E73 PolarHBondContact O-N 3.34Å; N70-E73 PolarHBondContact OD1-N 2.81Å; N70-L74 PolarHBondContact O-N 3.02Å; N70-L74 VanDerWaalsContact O-N 3.07Å
71	E	69.4	Low	58.7	Low	145 Å²	145	72.3 Å²	72.3	68%	0.678	37%	0.37	S	S	*	.	H	α-helix	trans	-64.7	-27.1	-173.2	-172.2	164.8	-164	0	0	114.1	K55 E75	K55-E71 WeakPolarHBondContact CE-O 3.4Å; K55-E71 PolarHBondContact NZ-O 2.96Å; K55-E71 IonicContact NZ-OE1 3.99Å; E71-E75 PolarHBondContact O-N 3.36Å; E71-E75 VanDerWaalsContact O-N 3.11Å
72	V	63.3	Low	59.3	Low	99 Å²	99	73.3 Å²	73.3	60%	0.6	38%	0.375	S	S	*	.	H	α-helix	trans	-81.7	-36.5	176.6	-173.1	0	0	0	0	111.3	N70 L74 E75 V76	N70-V72 VanDerWaalsContact C-N 3.25Å; N70-V72 PolarHBondContact O-N 2.98Å; N70-V72 WeakPolarHBondContact OD1-CA 3.33Å; N70-V72 WeakPolarHBondContact OD1-CB 3.39Å; N70-V72 PolarHBondContact OD1-N 2.68Å; V72-L74 VanDerWaalsContact C-N 3.3Å; V72-L74 PolarHBondContact O-N 3.14Å; V72-E75 WeakPolarHBondContact O-CB 3.34Å; V72-E75 PolarHBondContact O-N 2.77Å; V72-V76 HydrophobicContact CG1-CG2 4.45Å; V72-V76 WeakPolarHBondContact O-CB 2.97Å; V72-V76 WeakPolarHBondContact O-CG2 3.31Å; V72-V76 PolarHBondContact O-N 3.19Å
73	E	52.9	Low	59.7	Low	65 Å²	65	78.1 Å²	78.1	30%	0.304	40%	0.398	S	S	.	.	H	α-helix	trans	-60.1	-42.7	171.4	-76	168.5	130.2	0	0	110.8	Y67 P69 N70 V76 I77	Y67-E73 PolarHBondContact OH-OE1 2.89Å; P69-E73 WeakPolarHBondContact CA-OE2 2.91Å; P69-E73 HydrophobicContact CB-CB 4.15Å; N70-E73 VanDerWaalsContact CG-OE2 3.32Å; N70-E73 PolarHBondContact N-OE2 3.41Å; N70-E73 VanDerWaalsContact ND2-CG 3.34Å; N70-E73 WeakPolarHBondContact ND2-CG 3.22Å; N70-E73 PolarHBondContact ND2-OE2 2.92Å; N70-E73 PolarHBondContact O-N 3.34Å; N70-E73 PolarHBondContact OD1-N 2.81Å; E73-V76 PolarHBondContact O-N 3.29Å; E73-I77 WeakPolarHBondContact O-CD1 3.12Å; E73-I77 VanDerWaalsContact O-CG1 3.25Å; E73-I77 WeakPolarHBondContact O-CG1 3.49Å; E73-I77 PolarHBondContact O-N 3.46Å
74	L	62	Low	60.5	Low	11 Å²	11	79 Å²	79	6%	0.058	41%	0.411	C	S	.	.	H	α-helix	trans	-65.4	-41.2	174.5	-71.6	170.7	0	0	0	112.7	K55 L58 M62 P69 N70 V72 I77 I78	K55-L74 HydrophobicContact CD-CB 4.42Å; K55-L74 HydrophobicContact CG-CB 3.79Å; L58-L74 HydrophobicContact CB-CD2 4.43Å; L58-L74 HydrophobicContact CD2-CD2 4.05Å; L58-L74 HydrophobicContact CG-CD2 3.96Å; M62-L74 HydrophobicContact SD-CD2 3.64Å; P69-L74 HydrophobicContact CB-CD2 4.2Å; P69-L74 HydrophobicContact CB-CG 4.01Å; P69-L74 HydrophobicContact CG-CD1 4.19Å; P69-L74 HydrophobicContact CG-CD2 3.79Å; P69-L74 HydrophobicContact CG-CG 3.92Å; N70-L74 PolarHBondContact O-N 3.02Å; N70-L74 VanDerWaalsContact O-N 3.07Å; V72-L74 VanDerWaalsContact C-N 3.3Å; V72-L74 PolarHBondContact O-N 3.14Å; L74-I77 PolarHBondContact O-N 3.26Å; L74-I78 WeakPolarHBondContact O-CB 3.46Å; L74-I78 WeakPolarHBondContact O-CG1 3.1Å; L74-I78 PolarHBondContact O-N 2.84Å
75	E	65.7	Low	62	Low	98 Å²	98	78.1 Å²	78.1	46%	0.458	41%	0.414	S	S	.	.	H	α-helix	trans	-58.4	-48.7	175.2	-160.2	79.3	-125.2	0	0	111.1	K55 E71 V72 I77 I78 Q79	K55-E75 IonicContact NZ-OE2 3.12Å; K55-E75 PolarHBondContact NZ-OE2 3.14Å; E71-E75 PolarHBondContact O-N 3.36Å; E71-E75 VanDerWaalsContact O-N 3.11Å; V72-E75 WeakPolarHBondContact O-CB 3.34Å; V72-E75 PolarHBondContact O-N 2.77Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.26Å; E75-I78 PolarHBondContact O-N 3.3Å; E75-Q79 VanDerWaalsContact O-CB 3.22Å; E75-Q79 WeakPolarHBondContact O-CB 3.31Å; E75-Q79 PolarHBondContact O-N 3.4Å
76	V	60	Low	63.6	Low	87 Å²	87	79 Å²	79	53%	0.527	42%	0.419	S	S	.	.	H	α-helix	trans	-67	-32.3	-178.5	170.1	0	0	0	0	112.2	V72 E73 R80	V72-V76 HydrophobicContact CG1-CG2 4.45Å; V72-V76 WeakPolarHBondContact O-CB 2.97Å; V72-V76 WeakPolarHBondContact O-CG2 3.31Å; V72-V76 PolarHBondContact O-N 3.19Å; E73-V76 PolarHBondContact O-N 3.29Å; V76-R80 VanDerWaalsContact O-CB 3.27Å; V76-R80 WeakPolarHBondContact O-CB 3.23Å; V76-R80 PolarHBondContact O-N 2.74Å
77	I	64.4	Low	65.3	Low	46 Å²	46	77.9 Å²	77.9	24%	0.236	41%	0.408	C	S	.	.	H	α-helix	trans	-74.5	-47.3	175.4	-65.3	164.6	0	0	0	110.5	L58 M62 E73 L74 E75 R80 L81	L58-I77 HydrophobicContact CD2-CB 4.2Å; L58-I77 HydrophobicContact CD2-CG2 3.71Å; M62-I77 HydrophobicContact CE-CD1 3.47Å; M62-I77 VanDerWaalsContact CE-CD1 3.47Å; E73-I77 WeakPolarHBondContact O-CD1 3.12Å; E73-I77 VanDerWaalsContact O-CG1 3.25Å; E73-I77 WeakPolarHBondContact O-CG1 3.49Å; E73-I77 PolarHBondContact O-N 3.46Å; L74-I77 PolarHBondContact O-N 3.26Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.26Å; I77-R80 WeakPolarHBondContact O-CB 3.43Å; I77-R80 PolarHBondContact O-N 3.1Å; I77-L81 HydrophobicContact CG2-CD1 3.77Å; I77-L81 HydrophobicContact CG2-CG 4.37Å; I77-L81 WeakPolarHBondContact O-CG 2.97Å; I77-L81 PolarHBondContact O-N 2.84Å
78	I	70.4	Confident	67	Low	3 Å²	3	79.3 Å²	79.3	2%	0.015	42%	0.416	C	S	.	.	H	α-helix	trans	-57	-53.7	175.5	-68.3	-67.5	0	0	0	109.9	K55 L58 L74 E75 R80 L81 D82 G87 V89	K55-I78 HydrophobicContact CB-CD1 4.49Å; K55-I78 HydrophobicContact CB-CG1 3.99Å; K55-I78 HydrophobicContact CG-CG1 4.14Å; L58-I78 HydrophobicContact CB-CD1 4.41Å; L58-I78 HydrophobicContact CD2-CD1 3.62Å; L58-I78 HydrophobicContact CD2-CG1 3.91Å; L74-I78 WeakPolarHBondContact O-CB 3.46Å; L74-I78 WeakPolarHBondContact O-CG1 3.1Å; L74-I78 PolarHBondContact O-N 2.84Å; E75-I78 PolarHBondContact O-N 3.3Å; I78-R80 PolarHBondContact O-N 2.79Å; I78-L81 PolarHBondContact O-N 3.15Å; I78-D82 HydrophobicContact CG2-CB 4.35Å; I78-D82 WeakPolarHBondContact O-CB 3.13Å; I78-D82 PolarHBondContact O-N 3.09Å; I78-G87 WeakPolarHBondContact CG2-O 2.88Å; I78-V89 HydrophobicContact CD1-CG2 3.82Å
79	Q	67.7	Low	68.3	Low	148 Å²	148	72 Å²	72	69%	0.692	38%	0.38	S	S	*	.	H	α-helix	trans	-60.3	-6.3	177.2	-159.4	-171.6	34.4	0	0	114.6	E75	E75-Q79 VanDerWaalsContact O-CB 3.22Å; E75-Q79 WeakPolarHBondContact O-CB 3.31Å; E75-Q79 PolarHBondContact O-N 3.4Å
80	R	63.5	Low	69.5	Low	205 Å²	205	72 Å²	72	77%	0.774	38%	0.382	S	S	*	.	H	α-helix	trans	-104.5	-14	175.5	-163.3	54.7	167.8	179.7	2.2	113.8	V76 I77 I78	V76-R80 VanDerWaalsContact O-CB 3.27Å; V76-R80 WeakPolarHBondContact O-CB 3.23Å; V76-R80 PolarHBondContact O-N 2.74Å; I77-R80 WeakPolarHBondContact O-CB 3.43Å; I77-R80 PolarHBondContact O-N 3.1Å; I78-R80 PolarHBondContact O-N 2.79Å
81	L	63.7	Low	70.5	Confident	32 Å²	32	70.3 Å²	70.3	17%	0.168	37%	0.37	C	S	.	.	H	α-helix	trans	-107.5	-38.9	178.1	-58.6	173.1	0	0	0	111	I77 I78 M83 V89 L97	I77-L81 HydrophobicContact CG2-CD1 3.77Å; I77-L81 HydrophobicContact CG2-CG 4.37Å; I77-L81 WeakPolarHBondContact O-CG 2.97Å; I77-L81 PolarHBondContact O-N 2.84Å; I78-L81 PolarHBondContact O-N 3.15Å; L81-M83 PolarHBondContact O-N 2.97Å; L81-V89 HydrophobicContact CB-CB 4.39Å; L81-V89 HydrophobicContact CB-CG1 3.91Å; L81-V89 HydrophobicContact CB-CG2 3.51Å; L81-V89 HydrophobicContact CD1-CG2 4.05Å; L81-V89 HydrophobicContact CG-CG2 4.44Å; L81-L97 HydrophobicContact CB-CD1 3.91Å; L81-L97 HydrophobicContact CD2-CD1 3.72Å; L81-L97 HydrophobicContact CG-CD1 4.42Å; L81-L97 VanDerWaalsContact O-CD1 3.3Å; L81-L97 WeakPolarHBondContact O-CD1 3.21Å
82	D	72.9	Confident	70.7	Confident	28 Å²	28	70 Å²	70	15%	0.15	37%	0.369	C	S	.	.			trans	-55.1	122	165.2	-177.3	-9.1	0	0	0	110.2	I78 D84 G85 G87 Q88	I78-D82 HydrophobicContact CG2-CB 4.35Å; I78-D82 WeakPolarHBondContact O-CB 3.13Å; I78-D82 PolarHBondContact O-N 3.09Å; D82-D84 PolarHBondContact OD1-N 2.96Å; D82-G85 WeakPolarHBondContact OD1-CA 2.98Å; D82-G85 PolarHBondContact OD1-N 3.15Å; D82-G87 WeakPolarHBondContact OD2-CA 3.02Å; D82-G87 PolarHBondContact OD2-N 3.13Å; D82-Q88 WeakPolarHBondContact CB-O 3.22Å
83	M	69.7	Low	71.2	Confident	107 Å²	107	66.1 Å²	66.1	53%	0.527	34%	0.344	S	S	.	.	S	Bend	trans	-115.4	-22.9	-179.5	-60.9	-169.6	63.8	0	0	113.3	L81 E93 T96	L81-M83 PolarHBondContact O-N 2.97Å; M83-E93 WeakPolarHBondContact CA-OE1 3.38Å; M83-E93 HydrophobicContact CB-CG 4.36Å; M83-E93 WeakPolarHBondContact CB-OE1 2.99Å; M83-E93 HydrophobicContact CG-CB 4.45Å; M83-E93 HydrophobicContact CG-CG 4.49Å; M83-E93 PolarHBondContact N-OE1 2.85Å; M83-T96 HydrophobicContact CE-CG2 4.06Å; M83-T96 HydrophobicContact SD-CG2 3.62Å
84	D	75.6	Confident	71.8	Confident	125 Å²	125	64.1 Å²	64.1	67%	0.668	33%	0.334	S	S	*	.	S	Bend	trans	-102.8	-18.9	-179.9	80.8	12.6	0	0	0	114.9	D82 D86 E93	D82-D84 PolarHBondContact OD1-N 2.96Å; D84-D86 PolarHBondContact OD1-N 3.07Å; D84-D86 VanDerWaalsContact OD1-N 3.17Å; D84-E93 PolarHBondContact N-OE1 3.46Å; D84-E93 VanDerWaalsContact N-OE1 3.1Å
85	G	79	Confident	72	Confident	60 Å²	60	64.4 Å²	64.4	62%	0.619	34%	0.336	S	S	*	.	S	Bend	trans	100.5	17.6	173.1	0	0	0	0	0	115.6	D82 G87	D82-G85 WeakPolarHBondContact OD1-CA 2.98Å; D82-G85 PolarHBondContact OD1-N 3.15Å; G85-G87 VanDerWaalsContact C-N 3.33Å
86	D	81.3	Confident	71.8	Confident	70 Å²	70	61.5 Å²	61.5	37%	0.374	33%	0.326	S	S	.	.	S	Bend	trans	-74.8	-15.3	-178.8	104.1	-39.8	0	0	0	114.9	D84 Q88	D84-D86 PolarHBondContact OD1-N 3.07Å; D84-D86 VanDerWaalsContact OD1-N 3.17Å; D86-Q88 WeakPolarHBondContact OD1-CA 3.27Å; D86-Q88 VanDerWaalsContact OD1-CB 3.25Å; D86-Q88 WeakPolarHBondContact OD1-CB 3.23Å; D86-Q88 PolarHBondContact OD1-N 3.42Å; D86-Q88 PolarHBondContact OD2-NE2 3.06Å
87	G	78.9	Confident	71.7	Confident	36 Å²	36	60 Å²	60	37%	0.371	31%	0.314	S	S	.	.	S	Bend	trans	86.6	15	-178.5	0	0	0	0	0	115.1	I78 D82 G85	I78-G87 WeakPolarHBondContact CG2-O 2.88Å; D82-G87 WeakPolarHBondContact OD2-CA 3.02Å; D82-G87 PolarHBondContact OD2-N 3.13Å; G85-G87 VanDerWaalsContact C-N 3.33Å
88	Q	83.5	Confident	71	Confident	55 Å²	55	58.2 Å²	58.2	26%	0.257	31%	0.305	S	S	.	.	S	Bend	trans	-131.3	-161.1	176	-47.9	-177.7	105.3	0	0	109	F52 D82 D86	F52-Q88 HydrophobicContact CB-CB 4.01Å; D82-Q88 WeakPolarHBondContact CB-O 3.22Å; D86-Q88 WeakPolarHBondContact OD1-CA 3.27Å; D86-Q88 VanDerWaalsContact OD1-CB 3.25Å; D86-Q88 WeakPolarHBondContact OD1-CB 3.23Å; D86-Q88 PolarHBondContact OD1-N 3.42Å; D86-Q88 PolarHBondContact OD2-NE2 3.06Å
89	V	79.9	Confident	69.9	Low	2 Å²	2	58.1 Å²	58.1	1%	0.012	31%	0.305	C	S	.	.			trans	-136.4	108.8	170	-171.9	0	0	0	0	109.2	F52 I53 I78 L81 E93 F94	F52-V89 CarbonylContact C-O 3.23Å; F52-V89 WeakPolarHBondContact CA-O 3.33Å; I53-V89 HydrophobicContact CB-CB 4.34Å; I53-V89 PolarHBondContact N-O 2.8Å; I53-V89 PolarHBondContact O-N 2.93Å; I53-V89 VanDerWaalsContact O-N 3.1Å; I78-V89 HydrophobicContact CD1-CG2 3.82Å; L81-V89 HydrophobicContact CB-CB 4.39Å; L81-V89 HydrophobicContact CB-CG1 3.91Å; L81-V89 HydrophobicContact CB-CG2 3.51Å; L81-V89 HydrophobicContact CD1-CG2 4.05Å; L81-V89 HydrophobicContact CG-CG2 4.44Å; V89-E93 HydrophobicContact CG1-CB 4.23Å; V89-F94 HydrophobicContact CG1-CB 4.33Å
90	G	80.1	Confident	68.8	Low	8 Å²	8	53.4 Å²	53.4	8%	0.082	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-71.5	155.8	177.2	0	0	0	0	0	112.6	E92 E93 F94	G90-E92 VanDerWaalsContact C-N 3.29Å; G90-E92 PolarHBondContact O-N 2.68Å; G90-E93 PolarHBondContact N-OE2 3.11Å; G90-E93 WeakPolarHBondContact O-CB 3.15Å; G90-E93 PolarHBondContact O-N 2.99Å; G90-F94 PolarHBondContact O-N 2.81Å
91	F	76.7	Confident	67.8	Low	47 Å²	47	48.3 Å²	48.3	21%	0.206	27%	0.27	C	S	.	.	H	α-helix	trans	-55.5	-41.2	177.5	-180	-107.5	0	0	0	113.2	V35 I38 R39 F42 E93 F94 V95	V35-F91 HydrophobicContact CG1-CE1 4.16Å; V35-F91 HydrophobicContact CG1-CZ 3.84Å; I38-F91 HydrophobicContact CG2-CE2 4.28Å; R39-F91 HydrophobicContact CB-CE2 3.76Å; R39-F91 HydrophobicContact CB-CZ 3.92Å; R39-F91 HydrophobicContact CG-CE2 3.93Å; R39-F91 HydrophobicContact CG-CZ 4.09Å; F42-F91 HydrophobicContact CB-CD2 4.1Å; F42-F91 HydrophobicContact CB-CE2 4.36Å; F42-F91 HydrophobicContact CD1-CD2 4.25Å; F42-F91 HydrophobicContact CD2-CB 4.49Å; F42-F91 AromaticContact CD2-CD2 3.89Å; F42-F91 HydrophobicContact CD2-CD2 3.89Å; F42-F91 HydrophobicContact CE1-CB 4.37Å; F42-F91 HydrophobicContact CE2-CB 4.12Å; F42-F91 HydrophobicContact CE2-CD2 4.36Å; F42-F91 AromaticContact CG-CD2 3.82Å; F42-F91 HydrophobicContact CG-CD2 3.82Å; F42-F91 HydrophobicContact CZ-CB 4.05Å; F91-E93 VanDerWaalsContact C-N 3.26Å; F91-E93 PolarHBondContact O-N 3.42Å; F91-F94 PolarHBondContact O-N 2.74Å; F91-V95 HydrophobicContact CD1-CG2 4.25Å; F91-V95 HydrophobicContact CD2-CG2 4.26Å; F91-V95 HydrophobicContact CE1-CG2 3.81Å; F91-V95 HydrophobicContact CE2-CG2 3.79Å; F91-V95 HydrophobicContact CG-CG2 4.47Å; F91-V95 HydrophobicContact CZ-CG2 3.56Å; F91-V95 WeakPolarHBondContact O-CB 3.38Å; F91-V95 VanDerWaalsContact O-CG2 3.3Å; F91-V95 WeakPolarHBondContact O-CG2 3.45Å; F91-V95 PolarHBondContact O-N 2.78Å
92	E	73.6	Confident	66.8	Low	138 Å²	138	46.9 Å²	46.9	65%	0.645	26%	0.263	S	S	*	.	H	α-helix	trans	-62.4	-31.4	176.3	-73	-68.5	126.5	0	0	112.9	G90 T96	G90-E92 VanDerWaalsContact C-N 3.29Å; G90-E92 PolarHBondContact O-N 2.68Å; E92-T96 WeakPolarHBondContact O-CB 3.42Å; E92-T96 PolarHBondContact O-N 2.87Å; E92-T96 PolarHBondContact O-OG1 2.82Å
93	E	72.9	Confident	65.1	Low	17 Å²	17	45.6 Å²	45.6	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-79.1	-44.8	179.5	-54.4	-178.8	121.5	0	0	110.4	M83 D84 V89 G90 F91 V95 T96 L97	M83-E93 WeakPolarHBondContact CA-OE1 3.38Å; M83-E93 HydrophobicContact CB-CG 4.36Å; M83-E93 WeakPolarHBondContact CB-OE1 2.99Å; M83-E93 HydrophobicContact CG-CB 4.45Å; M83-E93 HydrophobicContact CG-CG 4.49Å; M83-E93 PolarHBondContact N-OE1 2.85Å; D84-E93 PolarHBondContact N-OE1 3.46Å; D84-E93 VanDerWaalsContact N-OE1 3.1Å; V89-E93 HydrophobicContact CG1-CB 4.23Å; G90-E93 PolarHBondContact N-OE2 3.11Å; G90-E93 WeakPolarHBondContact O-CB 3.15Å; G90-E93 PolarHBondContact O-N 2.99Å; F91-E93 VanDerWaalsContact C-N 3.26Å; F91-E93 PolarHBondContact O-N 3.42Å; E93-V95 VanDerWaalsContact C-N 3.31Å; E93-V95 PolarHBondContact O-N 2.87Å; E93-T96 CarbonylContact O-C 3.27Å; E93-T96 WeakPolarHBondContact O-CA 3.22Å; E93-T96 PolarHBondContact O-N 3.28Å; E93-L97 WeakPolarHBondContact O-CB 3.41Å; E93-L97 WeakPolarHBondContact O-CD1 3.36Å; E93-L97 VanDerWaalsContact O-CG 3.31Å; E93-L97 WeakPolarHBondContact O-CG 3.5Å; E93-L97 PolarHBondContact O-N 2.67Å
94	F	67.1	Low	63.6	Low	23 Å²	23	42.3 Å²	42.3	10%	0.101	25%	0.246	C	C	.	.	H	α-helix	trans	-53.7	-49.2	170.7	-163.4	-105.8	0	0	0	110.3	I38 F42 F45 I53 V89 G90 F91 L97 L98	I38-F94 HydrophobicContact CG2-CD1 3.64Å; I38-F94 HydrophobicContact CG2-CE1 3.86Å; F42-F94 HydrophobicContact CB-CD1 4.43Å; F42-F94 HydrophobicContact CB-CE1 4.35Å; F42-F94 HydrophobicContact CD2-CB 3.98Å; F42-F94 AromaticContact CD2-CD1 3.74Å; F42-F94 HydrophobicContact CD2-CD1 3.74Å; F42-F94 HydrophobicContact CD2-CD2 4.37Å; F42-F94 HydrophobicContact CD2-CE1 4.25Å; F42-F94 AromaticContact CD2-CG 3.8Å; F42-F94 HydrophobicContact CD2-CG 3.8Å; F42-F94 HydrophobicContact CE2-CB 4.05Å; F42-F94 HydrophobicContact CE2-CG 4.27Å; F45-F94 HydrophobicContact CD2-CZ 4.5Å; F45-F94 HydrophobicContact CE2-CZ 4.49Å; I53-F94 HydrophobicContact CD1-CD2 3.97Å; I53-F94 HydrophobicContact CD1-CE2 3.95Å; V89-F94 HydrophobicContact CG1-CB 4.33Å; G90-F94 PolarHBondContact O-N 2.81Å; F91-F94 PolarHBondContact O-N 2.74Å; F94-L97 PolarHBondContact O-N 3.41Å; F94-L98 HydrophobicContact CD1-CD1 4.46Å; F94-L98 HydrophobicContact CD1-CD2 3.86Å; F94-L98 HydrophobicContact CD2-CD1 4.28Å; F94-L98 HydrophobicContact CE1-CD2 3.56Å; F94-L98 HydrophobicContact CE2-CD1 4.33Å; F94-L98 HydrophobicContact CG-CD1 4.34Å; F94-L98 HydrophobicContact CZ-CD1 4.46Å; F94-L98 HydrophobicContact CZ-CD2 4Å; F94-L98 VanDerWaalsContact O-CB 3.31Å; F94-L98 WeakPolarHBondContact O-CB 3.32Å; F94-L98 WeakPolarHBondContact O-CD1 3.26Å; F94-L98 PolarHBondContact O-N 2.82Å
95	V	64.7	Low	61.9	Low	17 Å²	17	38.4 Å²	38.4	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-65.7	-37.7	173.6	173.9	0	0	0	0	112.4	I38 F91 E93 L97 G99	I38-V95 HydrophobicContact CG2-CG2 3.79Å; F91-V95 HydrophobicContact CD1-CG2 4.25Å; F91-V95 HydrophobicContact CD2-CG2 4.26Å; F91-V95 HydrophobicContact CE1-CG2 3.81Å; F91-V95 HydrophobicContact CE2-CG2 3.79Å; F91-V95 HydrophobicContact CG-CG2 4.47Å; F91-V95 HydrophobicContact CZ-CG2 3.56Å; F91-V95 WeakPolarHBondContact O-CB 3.38Å; F91-V95 VanDerWaalsContact O-CG2 3.3Å; F91-V95 WeakPolarHBondContact O-CG2 3.45Å; F91-V95 PolarHBondContact O-N 2.78Å; E93-V95 VanDerWaalsContact C-N 3.31Å; E93-V95 PolarHBondContact O-N 2.87Å; V95-L97 VanDerWaalsContact C-N 3.27Å; V95-L97 PolarHBondContact O-N 3.05Å; V95-G99 VanDerWaalsContact O-CA 3.29Å; V95-G99 WeakPolarHBondContact O-CA 3.4Å; V95-G99 PolarHBondContact O-N 3.42Å
96	T	62.5	Low	60	Low	38 Å²	38	38.5 Å²	38.5	23%	0.233	23%	0.232	C	C	.	.	H	α-helix	trans	-69.7	-22.2	176.6	-67.5	0	0	0	0	112.9	M83 E92 E93 P100	M83-T96 HydrophobicContact CE-CG2 4.06Å; M83-T96 HydrophobicContact SD-CG2 3.62Å; E92-T96 WeakPolarHBondContact O-CB 3.42Å; E92-T96 PolarHBondContact O-N 2.87Å; E92-T96 PolarHBondContact O-OG1 2.82Å; E93-T96 CarbonylContact O-C 3.27Å; E93-T96 WeakPolarHBondContact O-CA 3.22Å; E93-T96 PolarHBondContact O-N 3.28Å; T96-P100 WeakPolarHBondContact O-CD 3.28Å; T96-P100 WeakPolarHBondContact O-CG 3.19Å
97	L	56.8	Low	58.1	Low	54 Å²	54	37.8 Å²	37.8	28%	0.283	23%	0.227	S	C	.	.	H	α-helix	trans	-86.7	-54.7	175.7	-73.8	155.8	0	0	0	110.5	L81 E93 F94 V95 L201	L81-L97 HydrophobicContact CB-CD1 3.91Å; L81-L97 HydrophobicContact CD2-CD1 3.72Å; L81-L97 HydrophobicContact CG-CD1 4.42Å; L81-L97 VanDerWaalsContact O-CD1 3.3Å; L81-L97 WeakPolarHBondContact O-CD1 3.21Å; E93-L97 WeakPolarHBondContact O-CB 3.41Å; E93-L97 WeakPolarHBondContact O-CD1 3.36Å; E93-L97 VanDerWaalsContact O-CG 3.31Å; E93-L97 WeakPolarHBondContact O-CG 3.5Å; E93-L97 PolarHBondContact O-N 2.67Å; F94-L97 PolarHBondContact O-N 3.41Å; V95-L97 VanDerWaalsContact C-N 3.27Å; V95-L97 PolarHBondContact O-N 3.05Å; L97-L201 WeakPolarHBondContact O-CD2 3.29Å
98	L	50.6	Low	56.1	Low	10 Å²	10	40.6 Å²	40.6	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-63.2	178.5	-82.3	59.3	0	0	0	109.5	I38 F94 K101 L102 M200 L201	I38-L98 HydrophobicContact CD1-CB 4.38Å; I38-L98 HydrophobicContact CD1-CD2 4.46Å; I38-L98 HydrophobicContact CG1-CD2 4.14Å; I38-L98 HydrophobicContact CG2-CD2 3.91Å; F94-L98 HydrophobicContact CD1-CD1 4.46Å; F94-L98 HydrophobicContact CD1-CD2 3.86Å; F94-L98 HydrophobicContact CD2-CD1 4.28Å; F94-L98 HydrophobicContact CE1-CD2 3.56Å; F94-L98 HydrophobicContact CE2-CD1 4.33Å; F94-L98 HydrophobicContact CG-CD1 4.34Å; F94-L98 HydrophobicContact CZ-CD1 4.46Å; F94-L98 HydrophobicContact CZ-CD2 4Å; F94-L98 VanDerWaalsContact O-CB 3.31Å; F94-L98 WeakPolarHBondContact O-CB 3.32Å; F94-L98 WeakPolarHBondContact O-CD1 3.26Å; F94-L98 PolarHBondContact O-N 2.82Å; L98-K101 PolarHBondContact O-N 2.73Å; L98-L102 HydrophobicContact CB-CD1 3.66Å; L98-L102 HydrophobicContact CG-CD1 4.42Å; L98-L102 WeakPolarHBondContact O-CB 3.38Å; L98-L102 WeakPolarHBondContact O-CD1 3.4Å; L98-L102 PolarHBondContact O-N 3.1Å; L98-L102 VanDerWaalsContact O-N 3.14Å; L98-M200 WeakPolarHBondContact CA-O 3.47Å; L98-M200 HydrophobicContact CD2-CB 3.73Å; L98-M200 HydrophobicContact CD2-CE 3.84Å; L98-M200 HydrophobicContact CD2-CG 4.39Å; L98-M200 HydrophobicContact CD2-SD 3.86Å; L98-M200 HydrophobicContact CG-CB 3.72Å; L98-M200 WeakPolarHBondContact CG-O 3.13Å; L98-L201 WeakPolarHBondContact O-CD2 3.46Å
99	G	46.8	Very low	53.8	Low	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-50.9	-43.5	-166.4	0	0	0	0	0	117.2	V95	V95-G99 VanDerWaalsContact O-CA 3.29Å; V95-G99 WeakPolarHBondContact O-CA 3.4Å; V95-G99 PolarHBondContact O-N 3.42Å
100	P	44.7	Very low	51.7	Low	50 Å²	50	51.8 Å²	51.8	33%	0.325	29%	0.292	S	S	.	.	H	α-helix	trans	-66.4	-47.2	-176.9	-24.8	34.3	0	0	0	113.7	V28 T96 N205	V28-P100 HydrophobicContact CG1-CG 4.1Å; V28-P100 HydrophobicContact CG2-CG 4.05Å; T96-P100 WeakPolarHBondContact O-CD 3.28Å; T96-P100 WeakPolarHBondContact O-CG 3.19Å; P100-N205 PolarHBondContact O-ND2 3.16Å
101	K	43.3	Very low	49.6	Very low	97 Å²	97	57.1 Å²	57.1	42%	0.422	31%	0.313	S	S	.	.	H	α-helix	trans	-77.7	-54.1	-176.1	-152.2	-151	-52.4	159.1	0	108.7	L98 A104 L201 N205	L98-K101 PolarHBondContact O-N 2.73Å; K101-A104 HydrophobicContact CG-CB 4.09Å; K101-A104 VanDerWaalsContact O-CB 3.23Å; K101-A104 WeakPolarHBondContact O-CB 3.27Å; K101-A104 PolarHBondContact O-N 3.4Å; K101-L201 HydrophobicContact CB-CB 3.86Å; K101-L201 HydrophobicContact CB-CD2 3.5Å; K101-L201 VanDerWaalsContact CB-CD2 3.5Å; K101-L201 HydrophobicContact CB-CG 4.15Å; K101-L201 HydrophobicContact CD-CB 3.85Å; K101-L201 HydrophobicContact CG-CB 4.38Å; K101-N205 WeakPolarHBondContact O-CB 2.93Å
102	L	42.5	Very low	47.7	Very low	2 Å²	2	61.3 Å²	61.3	1%	0.01	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	16.3	-132.6	-179.2	-127.4	81.3	0	0	0	112	E34 I38 L98 A104 M200 L201 I202 A203 A204	E34-L102 HydrophobicContact CG-CD2 4.09Å; I38-L102 HydrophobicContact CD1-CD2 4.11Å; L98-L102 HydrophobicContact CB-CD1 3.66Å; L98-L102 HydrophobicContact CG-CD1 4.42Å; L98-L102 WeakPolarHBondContact O-CB 3.38Å; L98-L102 WeakPolarHBondContact O-CD1 3.4Å; L98-L102 PolarHBondContact O-N 3.1Å; L98-L102 VanDerWaalsContact O-N 3.14Å; L102-A104 PolarHBondContact O-N 2.88Å; L102-M200 HydrophobicContact CD1-CB 4.26Å; L102-M200 WeakPolarHBondContact CD1-O 3.42Å; L102-L201 CarbonylContact C-O 3.4Å; L102-L201 VanDerWaalsContact CA-CA 3.49Å; L102-L201 CarbonylContact O-C 3.4Å; L102-I202 CarbonylContact O-C 2.8Å; L102-I202 WeakPolarHBondContact O-CA 3.27Å; L102-I202 PolarHBondContact O-N 2.88Å; L102-A203 HydrophobicContact CD2-CB 3.68Å; L102-A203 HydrophobicContact CG-CB 3.78Å; L102-A204 HydrophobicContact CB-CB 3.36Å; L102-A204 HydrophobicContact CD2-CB 3.26Å; L102-A204 HydrophobicContact CG-CB 3.73Å
103	S	37.9	Very low	45.9	Very low	1 Å²	1	57.6 Å²	57.6	1%	0.007	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-67	54.5	-178.9	47.9	0	0	0	0	116.9	A105 I202 A203 A204 N205 Q206	S103-A105 CarbonylContact C-O 3.56Å; S103-A105 WeakPolarHBondContact CA-O 2.9Å; S103-A105 WeakPolarHBondContact CB-O 3.43Å; S103-A105 PolarHBondContact O-N 2.7Å; S103-I202 WeakPolarHBondContact CA-O 3.34Å; S103-I202 WeakPolarHBondContact CB-O 3.48Å; S103-I202 PolarHBondContact N-O 3.39Å; S103-A203 WeakPolarHBondContact CB-O 3.44Å; S103-A203 PolarHBondContact OG-O 3.14Å; S103-A204 VanDerWaalsContact OG-CA 3.32Å; S103-A204 WeakPolarHBondContact OG-CA 3.24Å; S103-A204 PolarHBondContact OG-N 3.3Å; S103-A204 VanDerWaalsContact OG-N 3.12Å; S103-N205 CarbonylContact O-C 3.12Å; S103-N205 VanDerWaalsContact O-C 3.27Å; S103-N205 PolarHBondContact OG-N 3.18Å; S103-Q206 PolarHBondContact O-N 3.38Å; S103-Q206 WeakPolarHBondContact OG-CA 3.5Å; S103-Q206 WeakPolarHBondContact OG-CB 3.34Å; S103-Q206 PolarHBondContact OG-N 2.67Å
104	A	37.8	Very low	43.9	Very low	39 Å²	39	60.4 Å²	60.4	32%	0.322	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-62	-26.6	163.2	0	0	0	0	0	110.3	K101 L102 N205 R209	K101-A104 HydrophobicContact CG-CB 4.09Å; K101-A104 VanDerWaalsContact O-CB 3.23Å; K101-A104 WeakPolarHBondContact O-CB 3.27Å; K101-A104 PolarHBondContact O-N 3.4Å; L102-A104 PolarHBondContact O-N 2.88Å; A104-N205 HydrophobicContact CB-CB 4.41Å; A104-R209 VanDerWaalsContact CA-NH2 3.29Å; A104-R209 PolarHBondContact O-NH2 3.24Å; A104-R209 VanDerWaalsContact O-NH2 3.14Å
105	A	39.2	Very low	42.5	Very low	42 Å²	42	64.8 Å²	64.8	35%	0.347	38%	0.383	S	S	.	.	S	Bend	trans	-102.4	149.9	158.1	0	0	0	0	0	110.6	S103 M107 I202	S103-A105 CarbonylContact C-O 3.56Å; S103-A105 WeakPolarHBondContact CA-O 2.9Å; S103-A105 WeakPolarHBondContact CB-O 3.43Å; S103-A105 PolarHBondContact O-N 2.7Å; A105-M107 PolarHBondContact O-N 2.93Å; A105-I202 HydrophobicContact CB-CD1 3.91Å; A105-I202 HydrophobicContact CB-CG1 3.88Å; A105-I202 HydrophobicContact CB-CG2 4.26Å
106	G	39.9	Very low	41	Very low	62 Å²	62	69.3 Å²	69.3	64%	0.639	40%	0.401	S	S	*	.			trans	-82.6	112.1	-178.3	0	0	0	0	0	112.8
107	M	40.3	Very low	39.8	Very low	55 Å²	55	72.5 Å²	72.5	27%	0.271	42%	0.417	S	S	.	.			trans	-80	142.9	162.8	-67.9	-67.9	-97.1	0	0	110.3	A105 F111 V199 I202 Q206	A105-M107 PolarHBondContact O-N 2.93Å; M107-F111 HydrophobicContact CE-CD2 4.48Å; M107-F111 HydrophobicContact CE-CE2 3.6Å; M107-F111 HydrophobicContact CE-CZ 3.72Å; M107-V199 HydrophobicContact CE-CG1 4.39Å; M107-I202 HydrophobicContact CG-CG2 3.5Å; M107-I202 WeakPolarHBondContact CG-O 3.34Å; M107-I202 HydrophobicContact SD-CG2 3.61Å; M107-Q206 PolarHBondContact O-NE2 2.79Å
108	P	37.5	Very low	38.7	Very low	95 Å²	95	72.7 Å²	72.7	62%	0.617	42%	0.422	S	S	*	.			trans	-69.3	140.9	179.3	28.5	-34.2	0	0	0	111.6	K110	P108-K110 PolarHBondContact O-N 2.59Å
109	D	35.3	Very low	38	Very low	118 Å²	118	76.5 Å²	76.5	63%	0.631	45%	0.446	S	S	*	.	S	Bend	trans	-54.9	10	-167.8	-81	-104.7	0	0	0	119.1	R210	D109-R210 VanDerWaalsContact CG-NH2 3.34Å; D109-R210 IonicContact OD1-CZ 2.61Å; D109-R210 IonicContact OD1-NH1 2.71Å; D109-R210 PolarHBondContact OD1-NH1 3.25Å; D109-R210 IonicContact OD1-NH2 3.59Å; D109-R210 PolarHBondContact OD1-NH2 2.92Å; D109-R210 VanDerWaalsContact OD1-NH2 3.12Å; D109-R210 IonicContact OD2-CZ 2.66Å; D109-R210 IonicContact OD2-NH1 3.92Å; D109-R210 IonicContact OD2-NH2 2.68Å; D109-R210 PolarHBondContact OD2-NH2 3.35Å
110	K	34.9	Very low	37.5	Very low	175 Å²	175	80.9 Å²	80.9	76%	0.761	47%	0.465	S	S	*	.			trans	-144.5	68.6	-175.6	-63	-168.4	179.3	-171	0	114.2	P108 H112	P108-K110 PolarHBondContact O-N 2.59Å; K110-H112 PolarHBondContact O-N 3.08Å
111	F	36.1	Very low	37.2	Very low	119 Å²	119	88.2 Å²	88.2	52%	0.522	49%	0.486	S	S	.	.			trans	-80.1	105.8	154.2	-98.2	-110.2	0	0	0	108.7	M107 F116	M107-F111 HydrophobicContact CE-CD2 4.48Å; M107-F111 HydrophobicContact CE-CE2 3.6Å; M107-F111 HydrophobicContact CE-CZ 3.72Å; F111-F116 AromaticContact CE1-CD2 3.82Å; F111-F116 HydrophobicContact CE1-CD2 3.82Å; F111-F116 AromaticContact CE1-CE2 3.97Å; F111-F116 HydrophobicContact CE1-CE2 3.97Å
112	H	37.1	Very low	36.8	Very low	136 Å²	136	91.1 Å²	91.1	63%	0.63	50%	0.499	S	S	*	.			trans	-91.4	116.5	163.9	-81.1	-68.2	0	0	0	108	K110 A114 D115	K110-H112 PolarHBondContact O-N 3.08Å; H112-A114 PolarHBondContact O-N 3.24Å; H112-D115 PolarHBondContact O-N 3.44Å
113	G	35.8	Very low	36.5	Very low	59 Å²	59	94.3 Å²	94.3	61%	0.608	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-9.5	-172.3	0	0	0	0	0	116.8
114	A	32.1	Very low	36.4	Very low	77 Å²	77	98.1 Å²	98.1	64%	0.636	54%	0.541	S	S	*	.	H	α-helix	trans	-73.3	-26.5	177.3	0	0	0	0	0	114.4	H112	H112-A114 PolarHBondContact O-N 3.24Å
115	D	36.4	Very low	36.5	Very low	115 Å²	115	102 Å²	102	62%	0.615	55%	0.554	S	S	*	*	H	α-helix	trans	-81.4	-35.2	-176.1	-81.6	-65.7	0	0	0	112.9	H112 D117 S118 V119	H112-D115 PolarHBondContact O-N 3.44Å; D115-D117 VanDerWaalsContact C-N 3.35Å; D115-D117 PolarHBondContact O-N 3.47Å; D115-S118 PolarHBondContact O-N 2.91Å; D115-V119 WeakPolarHBondContact O-CG2 3.08Å; D115-V119 PolarHBondContact O-N 3Å
116	F	34.8	Very low	36.4	Very low	111 Å²	111	109 Å²	109	49%	0.487	58%	0.58	S	S	.	*	H	α-helix	trans	-66.7	-39.7	179.8	-135.8	-93.5	0	0	0	111.5	F111 V119 F120	F111-F116 AromaticContact CE1-CD2 3.82Å; F111-F116 HydrophobicContact CE1-CD2 3.82Å; F111-F116 AromaticContact CE1-CE2 3.97Å; F111-F116 HydrophobicContact CE1-CE2 3.97Å; F116-V119 PolarHBondContact O-N 2.88Å; F116-F120 HydrophobicContact CD1-CB 4.13Å; F116-F120 HydrophobicContact CD1-CD2 4.37Å; F116-F120 HydrophobicContact CD1-CG 4.45Å; F116-F120 HydrophobicContact CE1-CB 4.32Å; F116-F120 AromaticContact CE1-CD2 3.72Å; F116-F120 HydrophobicContact CE1-CD2 3.72Å; F116-F120 HydrophobicContact CE1-CE2 4.32Å; F116-F120 HydrophobicContact CE1-CG 4.17Å; F116-F120 HydrophobicContact CZ-CD2 4.38Å; F116-F120 WeakPolarHBondContact O-CB 3.3Å; F116-F120 PolarHBondContact O-N 3.1Å
117	D	35.3	Very low	36.4	Very low	105 Å²	105	113.2 Å²	113.2	56%	0.561	58%	0.58	S	S	*	*	H	α-helix	trans	-57.3	-49	174.1	-147.7	-30.9	0	0	0	111.1	D115 V119 W121	D115-D117 VanDerWaalsContact C-N 3.35Å; D115-D117 PolarHBondContact O-N 3.47Å; D117-V119 VanDerWaalsContact C-N 3.28Å; D117-V119 PolarHBondContact O-N 3.24Å; D117-W121 WeakPolarHBondContact O-CB 3.34Å; D117-W121 PolarHBondContact O-N 3.28Å; D117-W121 VanDerWaalsContact O-N 3.1Å
118	S	35	Very low	36.5	Very low	58 Å²	58	114.3 Å²	114.3	41%	0.406	59%	0.587	S	S	.	*	H	α-helix	trans	-74.6	-8.1	-179.7	-172.4	0	0	0	0	115.2	D115 K122	D115-S118 PolarHBondContact O-N 2.91Å; S118-K122 VanDerWaalsContact O-CB 3.23Å; S118-K122 WeakPolarHBondContact O-CB 3.33Å; S118-K122 VanDerWaalsContact O-CD 3.27Å; S118-K122 WeakPolarHBondContact O-CD 3.41Å; S118-K122 PolarHBondContact OG-NZ 3.31Å
119	V	35.3	Very low	37.2	Very low	90 Å²	90	113.2 Å²	113.2	55%	0.545	58%	0.579	S	S	.	*	H	α-helix	trans	-105.2	-48.9	175.8	174.9	0	0	0	0	111.2	D115 F116 D117 C123	D115-V119 WeakPolarHBondContact O-CG2 3.08Å; D115-V119 PolarHBondContact O-N 3Å; F116-V119 PolarHBondContact O-N 2.88Å; D117-V119 VanDerWaalsContact C-N 3.28Å; D117-V119 PolarHBondContact O-N 3.24Å; V119-C123 PolarHBondContact O-N 3.39Å; V119-C123 PolarHBondContact O-SG 2.73Å
120	F	36.3	Very low	37.9	Very low	93 Å²	93	110.5 Å²	110.5	41%	0.408	57%	0.566	S	S	.	*	H	α-helix	trans	-79.5	-41	-174.3	-141	-90.4	0	0	0	112	F116 K122	F116-F120 HydrophobicContact CD1-CB 4.13Å; F116-F120 HydrophobicContact CD1-CD2 4.37Å; F116-F120 HydrophobicContact CD1-CG 4.45Å; F116-F120 HydrophobicContact CE1-CB 4.32Å; F116-F120 AromaticContact CE1-CD2 3.72Å; F116-F120 HydrophobicContact CE1-CD2 3.72Å; F116-F120 HydrophobicContact CE1-CE2 4.32Å; F116-F120 HydrophobicContact CE1-CG 4.17Å; F116-F120 HydrophobicContact CZ-CD2 4.38Å; F116-F120 WeakPolarHBondContact O-CB 3.3Å; F116-F120 PolarHBondContact O-N 3.1Å; F120-K122 VanDerWaalsContact C-N 3.33Å
121	W	38.5	Very low	38.8	Very low	203 Å²	203	106.6 Å²	106.6	77%	0.769	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-7	-177.9	-139.6	-125.5	0	0	0	114.1	D117	D117-W121 WeakPolarHBondContact O-CB 3.34Å; D117-W121 PolarHBondContact O-N 3.28Å; D117-W121 VanDerWaalsContact O-N 3.1Å
122	K	34.2	Very low	39.6	Very low	159 Å²	159	105.1 Å²	105.1	69%	0.691	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-16.4	-179.3	-154.1	173.2	-168.6	169.2	0	113.3	S118 F120 D124	S118-K122 VanDerWaalsContact O-CB 3.23Å; S118-K122 WeakPolarHBondContact O-CB 3.33Å; S118-K122 VanDerWaalsContact O-CD 3.27Å; S118-K122 WeakPolarHBondContact O-CD 3.41Å; S118-K122 PolarHBondContact OG-NZ 3.31Å; F120-K122 VanDerWaalsContact C-N 3.33Å; K122-D124 PolarHBondContact O-N 3.46Å
123	C	36.1	Very low	40.3	Very low	68 Å²	68	100.1 Å²	100.1	46%	0.459	53%	0.526	S	S	.	.	S	Bend	trans	-81.9	107.3	174.1	-77.7	0	0	0	0	110.4	V119 M125	V119-C123 PolarHBondContact O-N 3.39Å; V119-C123 PolarHBondContact O-SG 2.73Å; C123-M125 PolarHBondContact O-N 2.72Å
124	D	37.4	Very low	41.2	Very low	82 Å²	82	98.8 Å²	98.8	44%	0.439	50%	0.503	S	S	.	.			trans	-61.1	92.5	169.8	-164.3	-10.5	0	0	0	109.4	K122 Q126 K127	K122-D124 PolarHBondContact O-N 3.46Å; D124-Q126 PolarHBondContact O-N 3.2Å; D124-K127 HydrophobicContact CB-CD 4.18Å; D124-K127 PolarHBondContact O-N 2.62Å; D124-K127 VanDerWaalsContact OD2-CE 3.32Å; D124-K127 WeakPolarHBondContact OD2-CE 3.41Å; D124-K127 IonicContact OD2-NZ 2.84Å; D124-K127 PolarHBondContact OD2-NZ 3.04Å
125	M	39.3	Very low	42.3	Very low	120 Å²	120	103.4 Å²	103.4	59%	0.591	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-16.5	-168.1	-70	-178.7	74.7	0	0	114.1	C123 K127	C123-M125 PolarHBondContact O-N 2.72Å; M125-K127 PolarHBondContact O-N 2.81Å
126	Q	36.5	Very low	43.2	Very low	190 Å²	190	102.3 Å²	102.3	89%	0.888	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-11.7	173.3	-59.6	-171.8	5.7	0	0	113.9	D124	D124-Q126 PolarHBondContact O-N 3.2Å
127	K	40.1	Very low	44	Very low	150 Å²	150	98.9 Å²	98.9	65%	0.652	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-11.5	-176.5	-67.8	173.2	-176.9	148.4	0	114.5	D124 M125 T129	D124-K127 HydrophobicContact CB-CD 4.18Å; D124-K127 PolarHBondContact O-N 2.62Å; D124-K127 VanDerWaalsContact OD2-CE 3.32Å; D124-K127 WeakPolarHBondContact OD2-CE 3.41Å; D124-K127 IonicContact OD2-NZ 2.84Å; D124-K127 PolarHBondContact OD2-NZ 3.04Å; M125-K127 PolarHBondContact O-N 2.81Å; K127-T129 PolarHBondContact O-N 3.2Å
128	L	43.6	Very low	45	Very low	78 Å²	78	97.3 Å²	97.3	41%	0.408	47%	0.471	S	S	.	.			trans	-65.2	117.1	-177.4	-168.3	73.2	0	0	0	110.5	E132	L128-E132 HydrophobicContact CD1-CB 3.65Å; L128-E132 HydrophobicContact CG-CB 4.21Å
129	T	51.4	Low	45.8	Very low	72 Å²	72	99.9 Å²	99.9	44%	0.442	48%	0.481	S	S	.	.			trans	-80.1	162.4	-176.6	64.5	0	0	0	0	112.4	K127 D131 E132 L133	K127-T129 PolarHBondContact O-N 3.2Å; T129-D131 PolarHBondContact O-N 2.78Å; T129-E132 VanDerWaalsContact CB-OE2 3.31Å; T129-E132 WeakPolarHBondContact CB-OE2 3.27Å; T129-E132 WeakPolarHBondContact CG2-OE2 3.17Å; T129-E132 PolarHBondContact N-OE2 2.91Å; T129-E132 PolarHBondContact O-N 2.88Å; T129-E132 VanDerWaalsContact OG1-CD 3.25Å; T129-E132 WeakPolarHBondContact OG1-CG 3.42Å; T129-E132 PolarHBondContact OG1-N 2.85Å; T129-E132 PolarHBondContact OG1-OE2 2.87Å; T129-L133 PolarHBondContact O-N 3.37Å
130	V	50.6	Low	46.4	Very low	61 Å²	61	98.8 Å²	98.8	37%	0.37	47%	0.474	S	S	.	.	H	α-helix	trans	-60	-33.9	178.7	-179.4	0	0	0	0	111.7	K134 I154	V130-K134 WeakPolarHBondContact O-CB 3.29Å; V130-K134 VanDerWaalsContact O-CG 3.31Å; V130-K134 WeakPolarHBondContact O-CG 3.25Å; V130-K134 PolarHBondContact O-N 2.66Å; V130-I154 HydrophobicContact CG1-CD1 4.44Å; V130-I154 HydrophobicContact CG1-CG2 4.36Å
131	D	52.3	Low	47	Very low	93 Å²	93	96.5 Å²	96.5	50%	0.497	46%	0.464	S	S	.	.	H	α-helix	trans	-77.9	-29.2	178.6	-66.5	-64.5	0	0	0	113.3	T129 R135	T129-D131 PolarHBondContact O-N 2.78Å; D131-R135 WeakPolarHBondContact O-CB 3.35Å; D131-R135 VanDerWaalsContact O-CG 3.27Å; D131-R135 WeakPolarHBondContact O-CG 3.21Å; D131-R135 PolarHBondContact O-N 2.85Å
132	E	53.1	Low	47.6	Very low	88 Å²	88	93.7 Å²	93.7	41%	0.411	45%	0.453	S	S	.	.	H	α-helix	trans	-69.7	-41.5	169.3	-69.6	162.2	137.8	0	0	110.8	L128 T129 R135 L136	L128-E132 HydrophobicContact CD1-CB 3.65Å; L128-E132 HydrophobicContact CG-CB 4.21Å; T129-E132 VanDerWaalsContact CB-OE2 3.31Å; T129-E132 WeakPolarHBondContact CB-OE2 3.27Å; T129-E132 WeakPolarHBondContact CG2-OE2 3.17Å; T129-E132 PolarHBondContact N-OE2 2.91Å; T129-E132 PolarHBondContact O-N 2.88Å; T129-E132 VanDerWaalsContact OG1-CD 3.25Å; T129-E132 WeakPolarHBondContact OG1-CG 3.42Å; T129-E132 PolarHBondContact OG1-N 2.85Å; T129-E132 PolarHBondContact OG1-OE2 2.87Å; E132-R135 PolarHBondContact O-N 3Å; E132-L136 WeakPolarHBondContact O-CB 3.19Å; E132-L136 PolarHBondContact O-N 3.17Å
133	L	53.3	Low	48	Very low	31 Å²	31	93.4 Å²	93.4	16%	0.162	46%	0.459	C	S	.	.	H	α-helix	trans	-63	-44.5	172.4	-179.8	65.9	0	0	0	112.2	T129 R135 L136 L137 I188	T129-L133 PolarHBondContact O-N 3.37Å; L133-R135 VanDerWaalsContact C-N 3.31Å; L133-R135 PolarHBondContact O-N 2.92Å; L133-L136 PolarHBondContact O-N 3.46Å; L133-L137 HydrophobicContact CD1-CD1 4.26Å; L133-L137 HydrophobicContact CD1-CG 4.34Å; L133-L137 HydrophobicContact CG-CD1 4.09Å; L133-L137 WeakPolarHBondContact O-CB 3.43Å; L133-L137 WeakPolarHBondContact O-CG 3.48Å; L133-L137 PolarHBondContact O-N 2.92Å; L133-I188 HydrophobicContact CD2-CD1 3.47Å; L133-I188 VanDerWaalsContact CD2-CD1 3.47Å; L133-I188 HydrophobicContact CD2-CG1 4.1Å
134	K	53.9	Low	48.3	Very low	31 Å²	31	97.9 Å²	97.9	14%	0.135	47%	0.473	C	S	.	.	H	α-helix	trans	-57.8	-43.1	173.8	-81.3	-179.5	-175.7	-177.5	0	111.5	V130 Y138 I150 E151 I154	V130-K134 WeakPolarHBondContact O-CB 3.29Å; V130-K134 VanDerWaalsContact O-CG 3.31Å; V130-K134 WeakPolarHBondContact O-CG 3.25Å; V130-K134 PolarHBondContact O-N 2.66Å; K134-Y138 WeakPolarHBondContact O-CB 3.5Å; K134-Y138 PolarHBondContact O-N 2.63Å; K134-I150 HydrophobicContact CG-CG2 4.22Å; K134-E151 HydrophobicContact CD-CG 4.44Å; K134-E151 IonicContact NZ-OE1 3.36Å; K134-E151 PolarHBondContact NZ-OE1 2.83Å; K134-I154 HydrophobicContact CG-CD1 3.64Å
135	R	55.4	Low	48.9	Very low	174 Å²	174	95.7 Å²	95.7	66%	0.657	46%	0.461	S	S	*	.	H	α-helix	trans	-65.8	-46.1	176.9	-77.6	171.7	179.5	157.4	3.1	111.6	D131 E132 L133 L137 Y138 D139	D131-R135 WeakPolarHBondContact O-CB 3.35Å; D131-R135 VanDerWaalsContact O-CG 3.27Å; D131-R135 WeakPolarHBondContact O-CG 3.21Å; D131-R135 PolarHBondContact O-N 2.85Å; E132-R135 PolarHBondContact O-N 3Å; L133-R135 VanDerWaalsContact C-N 3.31Å; L133-R135 PolarHBondContact O-N 2.92Å; R135-L137 PolarHBondContact O-N 3.48Å; R135-Y138 PolarHBondContact O-N 3.43Å; R135-D139 WeakPolarHBondContact O-CB 2.95Å; R135-D139 PolarHBondContact O-N 2.71Å
136	L	54.2	Low	49.7	Very low	91 Å²	91	93.9 Å²	93.9	48%	0.476	46%	0.457	S	S	.	.	H	α-helix	trans	-58.7	-47.9	177.9	-173.8	64.6	0	0	0	111	E132 L133 T140	E132-L136 WeakPolarHBondContact O-CB 3.19Å; E132-L136 PolarHBondContact O-N 3.17Å; L133-L136 PolarHBondContact O-N 3.46Å; L136-T140 WeakPolarHBondContact O-CB 3.45Å; L136-T140 PolarHBondContact O-N 3.02Å; L136-T140 PolarHBondContact O-OG1 2.92Å
137	L	51.5	Low	50.6	Low	40 Å²	40	88.8 Å²	88.8	21%	0.209	43%	0.434	C	S	.	.	H	α-helix	trans	-62.6	-43.5	175.1	-70.4	170.3	0	0	0	112.3	L133 R135 F141 I150	L133-L137 HydrophobicContact CD1-CD1 4.26Å; L133-L137 HydrophobicContact CD1-CG 4.34Å; L133-L137 HydrophobicContact CG-CD1 4.09Å; L133-L137 WeakPolarHBondContact O-CB 3.43Å; L133-L137 WeakPolarHBondContact O-CG 3.48Å; L133-L137 PolarHBondContact O-N 2.92Å; R135-L137 PolarHBondContact O-N 3.48Å; L137-F141 HydrophobicContact CD2-CD2 4.14Å; L137-F141 HydrophobicContact CD2-CE2 3.89Å; L137-F141 WeakPolarHBondContact O-CB 3.43Å; L137-F141 WeakPolarHBondContact O-CD2 3Å; L137-F141 PolarHBondContact O-N 3.31Å; L137-I150 HydrophobicContact CB-CD1 4Å; L137-I150 HydrophobicContact CB-CG1 4.42Å; L137-I150 HydrophobicContact CB-CG2 4.19Å; L137-I150 HydrophobicContact CD1-CG2 4.04Å
138	Y	56.9	Low	51.2	Low	71 Å²	71	88.9 Å²	88.9	28%	0.278	44%	0.435	S	S	.	.	H	α-helix	trans	-69.5	-36.5	-177.7	179.5	-105	0	0	0	113.2	K134 R135 R142 M147 I150	K134-Y138 WeakPolarHBondContact O-CB 3.5Å; K134-Y138 PolarHBondContact O-N 2.63Å; R135-Y138 PolarHBondContact O-N 3.43Å; Y138-R142 HydrophobicContact CE1-CG 4.27Å; Y138-R142 HydrophobicContact CE2-CG 4.28Å; Y138-R142 WeakPolarHBondContact O-CA 3.42Å; Y138-R142 WeakPolarHBondContact O-CB 3.38Å; Y138-R142 PolarHBondContact O-N 3.18Å; Y138-M147 HydrophobicContact CD2-CB 3.9Å; Y138-M147 HydrophobicContact CD2-CG 4.22Å; Y138-M147 HydrophobicContact CE2-CB 4.12Å; Y138-M147 HydrophobicContact CG-CE 4.43Å; Y138-M147 HydrophobicContact CG-CG 4.44Å; Y138-M147 HydrophobicContact CG-SD 4.44Å; Y138-I150 VanDerWaalsContact CA-CD1 3.48Å; Y138-I150 HydrophobicContact CD2-CD1 4.17Å; Y138-I150 HydrophobicContact CG-CD1 4.48Å
139	D	52.6	Low	51.6	Low	113 Å²	113	88.2 Å²	88.2	60%	0.604	43%	0.431	S	S	*	.	H	α-helix	trans	-78.6	-35.9	178.2	-144.3	48.2	0	0	0	111.4	R135 R142	R135-D139 WeakPolarHBondContact O-CB 2.95Å; R135-D139 PolarHBondContact O-N 2.71Å; D139-R142 IonicContact OD1-NH1 3.16Å
140	T	48.3	Very low	51.7	Low	67 Å²	67	84.9 Å²	84.9	41%	0.411	41%	0.411	S	S	.	.	H	α-helix	trans	-70.7	-37.7	177.8	-56.5	0	0	0	0	113.3	L136 F195	L136-T140 WeakPolarHBondContact O-CB 3.45Å; L136-T140 PolarHBondContact O-N 3.02Å; L136-T140 PolarHBondContact O-OG1 2.92Å; T140-F195 HydrophobicContact CG2-CE1 4.24Å; T140-F195 HydrophobicContact CG2-CE2 3.71Å; T140-F195 HydrophobicContact CG2-CZ 3.37Å
141	F	48.9	Very low	51.9	Low	44 Å²	44	86.1 Å²	86.1	19%	0.193	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	25.7	-174.3	-62.7	-80.3	0	0	0	113.6	L137 D143 H144 L145 F195	L137-F141 HydrophobicContact CD2-CD2 4.14Å; L137-F141 HydrophobicContact CD2-CE2 3.89Å; L137-F141 WeakPolarHBondContact O-CB 3.43Å; L137-F141 WeakPolarHBondContact O-CD2 3Å; L137-F141 PolarHBondContact O-N 3.31Å; F141-D143 PolarHBondContact O-N 2.86Å; F141-H144 PolarHBondContact O-N 3.19Å; F141-L145 HydrophobicContact CB-CB 4.08Å; F141-L145 HydrophobicContact CB-CD1 3.9Å; F141-L145 HydrophobicContact CB-CG 4.36Å; F141-L145 HydrophobicContact CD2-CD1 4.31Å; F141-L145 HydrophobicContact CG-CD1 4.06Å; F141-L145 PolarHBondContact O-N 3.41Å; F141-F195 AromaticContact CE1-CD2 3.7Å; F141-F195 HydrophobicContact CE1-CD2 3.7Å; F141-F195 AromaticContact CE1-CE2 3.84Å; F141-F195 HydrophobicContact CE1-CE2 3.84Å; F141-F195 HydrophobicContact CE2-CD2 4.2Å; F141-F195 HydrophobicContact CE2-CE2 4.3Å; F141-F195 HydrophobicContact CZ-CB 4.38Å; F141-F195 AromaticContact CZ-CD2 3.23Å; F141-F195 HydrophobicContact CZ-CD2 3.23Å; F141-F195 AromaticContact CZ-CE2 3.56Å; F141-F195 HydrophobicContact CZ-CE2 3.56Å; F141-F195 AromaticContact CZ-CG 3.92Å; F141-F195 HydrophobicContact CZ-CG 3.92Å; F141-F195 HydrophobicContact CZ-CZ 4.48Å
142	R	50	Low	51.9	Low	145 Å²	145	86 Å²	86	55%	0.547	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-30.7	-166.3	-158.7	168.8	175.9	-178	-6.1	115.8	Y138 D139	Y138-R142 HydrophobicContact CE1-CG 4.27Å; Y138-R142 HydrophobicContact CE2-CG 4.28Å; Y138-R142 WeakPolarHBondContact O-CA 3.42Å; Y138-R142 WeakPolarHBondContact O-CB 3.38Å; Y138-R142 PolarHBondContact O-N 3.18Å; D139-R142 IonicContact OD1-NH1 3.16Å
143	D	43.6	Very low	51.8	Low	153 Å²	153	84.3 Å²	84.3	82%	0.818	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-1.9	179.2	-61.2	-63.1	0	0	0	113.9	F141	F141-D143 PolarHBondContact O-N 2.86Å
144	H	42	Very low	51.7	Low	161 Å²	161	84.3 Å²	84.3	75%	0.745	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	-24.4	-173.1	-68.3	-19.1	0	0	0	114.8	F141	F141-H144 PolarHBondContact O-N 3.19Å
145	L	49.2	Very low	51.3	Low	37 Å²	37	88.4 Å²	88.4	19%	0.194	43%	0.426	C	S	.	.			trans	-130	120.9	178	-79.7	165.5	0	0	0	109.8	F141 D149 I150 I153	F141-L145 HydrophobicContact CB-CB 4.08Å; F141-L145 HydrophobicContact CB-CD1 3.9Å; F141-L145 HydrophobicContact CB-CG 4.36Å; F141-L145 HydrophobicContact CD2-CD1 4.31Å; F141-L145 HydrophobicContact CG-CD1 4.06Å; F141-L145 PolarHBondContact O-N 3.41Å; L145-D149 HydrophobicContact CD2-CB 3.83Å; L145-I150 HydrophobicContact CB-CD1 4.34Å; L145-I150 HydrophobicContact CB-CG1 4.11Å; L145-I153 HydrophobicContact CD2-CD1 3.97Å
146	T	56.8	Low	50.8	Low	82 Å²	82	84.9 Å²	84.9	50%	0.503	42%	0.424	S	S	.	.			trans	-76	157.9	171.4	80	0	0	0	0	109.8	K148 D149 I150	T146-K148 PolarHBondContact O-N 2.93Å; T146-K148 PolarHBondContact OG1-N 3.38Å; T146-D149 WeakPolarHBondContact CA-OD2 3.48Å; T146-D149 VanDerWaalsContact CB-OD2 3.22Å; T146-D149 WeakPolarHBondContact CB-OD2 3.22Å; T146-D149 WeakPolarHBondContact CG2-OD2 3.33Å; T146-D149 PolarHBondContact N-OD2 3.27Å; T146-D149 WeakPolarHBondContact O-CB 3.47Å; T146-D149 PolarHBondContact O-N 2.98Å; T146-D149 PolarHBondContact OG1-N 3.23Å; T146-D149 PolarHBondContact OG1-OD2 3.1Å; T146-I150 PolarHBondContact O-N 2.93Å; T146-I150 VanDerWaalsContact O-N 3.14Å
147	M	55.6	Low	50.4	Low	83 Å²	83	82.5 Å²	82.5	41%	0.409	41%	0.411	S	S	.	.	H	α-helix	trans	-58.9	-23.5	179.3	-153.6	163.5	-155.4	0	0	112.9	Y138 E151	Y138-M147 HydrophobicContact CD2-CB 3.9Å; Y138-M147 HydrophobicContact CD2-CG 4.22Å; Y138-M147 HydrophobicContact CE2-CB 4.12Å; Y138-M147 HydrophobicContact CG-CE 4.43Å; Y138-M147 HydrophobicContact CG-CG 4.44Å; Y138-M147 HydrophobicContact CG-SD 4.44Å; M147-E151 WeakPolarHBondContact O-CG 3.16Å; M147-E151 PolarHBondContact O-N 3.35Å; M147-E151 VanDerWaalsContact O-N 3.14Å
148	K	53.1	Low	49.9	Very low	152 Å²	152	86.1 Å²	86.1	66%	0.661	43%	0.427	S	S	*	.	H	α-helix	trans	-78.7	-30.2	176.4	-160.4	171.4	-172.2	176	0	113.1	T146 E151 N152	T146-K148 PolarHBondContact O-N 2.93Å; T146-K148 PolarHBondContact OG1-N 3.38Å; K148-E151 PolarHBondContact O-N 3.34Å; K148-N152 VanDerWaalsContact O-CG 3.28Å; K148-N152 PolarHBondContact O-N 3.12Å; K148-N152 PolarHBondContact O-ND2 3.13Å
149	D	50.8	Low	49	Very low	63 Å²	63	89.6 Å²	89.6	34%	0.337	45%	0.45	S	S	.	.	H	α-helix	trans	-70.9	-41.2	173	-52.8	-54.7	0	0	0	110	L145 T146 E151 N152 I153	L145-D149 HydrophobicContact CD2-CB 3.83Å; T146-D149 WeakPolarHBondContact CA-OD2 3.48Å; T146-D149 VanDerWaalsContact CB-OD2 3.22Å; T146-D149 WeakPolarHBondContact CB-OD2 3.22Å; T146-D149 WeakPolarHBondContact CG2-OD2 3.33Å; T146-D149 PolarHBondContact N-OD2 3.27Å; T146-D149 WeakPolarHBondContact O-CB 3.47Å; T146-D149 PolarHBondContact O-N 2.98Å; T146-D149 PolarHBondContact OG1-N 3.23Å; T146-D149 PolarHBondContact OG1-OD2 3.1Å; D149-E151 VanDerWaalsContact C-N 3.31Å; D149-E151 PolarHBondContact O-N 2.93Å; D149-N152 PolarHBondContact O-N 3.07Å; D149-I153 WeakPolarHBondContact O-CB 3.43Å; D149-I153 WeakPolarHBondContact O-CD1 3.41Å; D149-I153 VanDerWaalsContact O-CG1 3.24Å; D149-I153 WeakPolarHBondContact O-CG1 3.44Å; D149-I153 PolarHBondContact O-N 3.08Å
150	I	54	Low	48.4	Very low	3 Å²	3	92.5 Å²	92.5	2%	0.015	46%	0.46	C	S	.	.	H	α-helix	trans	-59.3	-42	173.4	-62.5	170.1	0	0	0	110.8	K134 L137 Y138 L145 T146 I154	K134-I150 HydrophobicContact CG-CG2 4.22Å; L137-I150 HydrophobicContact CB-CD1 4Å; L137-I150 HydrophobicContact CB-CG1 4.42Å; L137-I150 HydrophobicContact CB-CG2 4.19Å; L137-I150 HydrophobicContact CD1-CG2 4.04Å; Y138-I150 VanDerWaalsContact CA-CD1 3.48Å; Y138-I150 HydrophobicContact CD2-CD1 4.17Å; Y138-I150 HydrophobicContact CG-CD1 4.48Å; L145-I150 HydrophobicContact CB-CD1 4.34Å; L145-I150 HydrophobicContact CB-CG1 4.11Å; T146-I150 PolarHBondContact O-N 2.93Å; T146-I150 VanDerWaalsContact O-N 3.14Å; I150-I154 HydrophobicContact CG2-CD1 4.01Å; I150-I154 WeakPolarHBondContact O-CD1 3.32Å; I150-I154 VanDerWaalsContact O-CG1 3.27Å; I150-I154 WeakPolarHBondContact O-CG1 3.11Å; I150-I154 PolarHBondContact O-N 3.47Å; I150-I154 VanDerWaalsContact O-N 3.15Å
151	E	55	Low	48.1	Very low	87 Å²	87	93.3 Å²	93.3	41%	0.407	46%	0.461	S	S	.	.	H	α-helix	trans	-67.9	-40.9	174.6	-72.8	-169.9	141.7	0	0	113.3	K134 M147 K148 D149 I153 I154 M155	K134-E151 HydrophobicContact CD-CG 4.44Å; K134-E151 IonicContact NZ-OE1 3.36Å; K134-E151 PolarHBondContact NZ-OE1 2.83Å; M147-E151 WeakPolarHBondContact O-CG 3.16Å; M147-E151 PolarHBondContact O-N 3.35Å; M147-E151 VanDerWaalsContact O-N 3.14Å; K148-E151 PolarHBondContact O-N 3.34Å; D149-E151 VanDerWaalsContact C-N 3.31Å; D149-E151 PolarHBondContact O-N 2.93Å; E151-I153 PolarHBondContact O-N 3.42Å; E151-I154 PolarHBondContact O-N 3.21Å; E151-M155 WeakPolarHBondContact O-CB 3.44Å; E151-M155 VanDerWaalsContact O-CG 3.29Å; E151-M155 WeakPolarHBondContact O-CG 3.27Å; E151-M155 PolarHBondContact O-N 3.24Å
152	N	51	Low	47.7	Very low	89 Å²	89	97.4 Å²	97.4	48%	0.476	49%	0.485	S	S	.	.	H	α-helix	trans	-61.2	-43.1	174.3	-74	-22.3	0	0	0	111.8	K148 D149 I154 M155 T156	K148-N152 VanDerWaalsContact O-CG 3.28Å; K148-N152 PolarHBondContact O-N 3.12Å; K148-N152 PolarHBondContact O-ND2 3.13Å; D149-N152 PolarHBondContact O-N 3.07Å; N152-I154 VanDerWaalsContact C-N 3.29Å; N152-I154 PolarHBondContact O-N 3.42Å; N152-M155 PolarHBondContact O-N 3.02Å; N152-T156 WeakPolarHBondContact O-CB 3.4Å; N152-T156 PolarHBondContact O-N 2.91Å; N152-T156 PolarHBondContact O-OG1 2.83Å
153	I	51.3	Low	46.9	Very low	54 Å²	54	95.9 Å²	95.9	28%	0.277	50%	0.496	S	S	.	.	H	α-helix	trans	-59.9	-40	176.9	-69.7	162.5	0	0	0	110.8	L145 D149 E151 L187 F191	L145-I153 HydrophobicContact CD2-CD1 3.97Å; D149-I153 WeakPolarHBondContact O-CB 3.43Å; D149-I153 WeakPolarHBondContact O-CD1 3.41Å; D149-I153 VanDerWaalsContact O-CG1 3.24Å; D149-I153 WeakPolarHBondContact O-CG1 3.44Å; D149-I153 PolarHBondContact O-N 3.08Å; E151-I153 PolarHBondContact O-N 3.42Å; I153-L187 HydrophobicContact CG2-CD2 4.02Å; I153-F191 HydrophobicContact CD1-CZ 4.45Å; I153-F191 HydrophobicContact CG2-CE2 4.47Å
154	I	51.1	Low	46.6	Very low	30 Å²	30	97.9 Å²	97.9	15%	0.154	50%	0.501	C	S	.	.	H	α-helix	trans	-72.4	-26.4	178.7	-69.1	166.8	0	0	0	112.8	V130 K134 I150 E151 N152	V130-I154 HydrophobicContact CG1-CD1 4.44Å; V130-I154 HydrophobicContact CG1-CG2 4.36Å; K134-I154 HydrophobicContact CG-CD1 3.64Å; I150-I154 HydrophobicContact CG2-CD1 4.01Å; I150-I154 WeakPolarHBondContact O-CD1 3.32Å; I150-I154 VanDerWaalsContact O-CG1 3.27Å; I150-I154 WeakPolarHBondContact O-CG1 3.11Å; I150-I154 PolarHBondContact O-N 3.47Å; I150-I154 VanDerWaalsContact O-N 3.15Å; E151-I154 PolarHBondContact O-N 3.21Å; N152-I154 VanDerWaalsContact C-N 3.29Å; N152-I154 PolarHBondContact O-N 3.42Å
155	M	46	Very low	46.5	Very low	117 Å²	117	99.3 Å²	99.3	58%	0.576	51%	0.508	S	S	*	.	H	α-helix	trans	-98.6	-21	-175	-68.4	-64	-162.5	0	0	115.3	E151 N152 E157	E151-M155 WeakPolarHBondContact O-CB 3.44Å; E151-M155 VanDerWaalsContact O-CG 3.29Å; E151-M155 WeakPolarHBondContact O-CG 3.27Å; E151-M155 PolarHBondContact O-N 3.24Å; N152-M155 PolarHBondContact O-N 3.02Å; M155-E157 PolarHBondContact O-N 2.76Å; M155-E157 VanDerWaalsContact O-N 3.16Å
156	T	44.4	Very low	45.6	Very low	100 Å²	100	103.1 Å²	103.1	61%	0.613	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-68.7	-18.1	-169	-60.2	0	0	0	0	114.1	N152 E158	N152-T156 WeakPolarHBondContact O-CB 3.4Å; N152-T156 PolarHBondContact O-N 2.91Å; N152-T156 PolarHBondContact O-OG1 2.83Å; T156-E158 VanDerWaalsContact C-N 3.34Å; T156-E158 PolarHBondContact O-N 3.46Å
157	E	46.1	Very low	44.7	Very low	42 Å²	42	106.6 Å²	106.6	20%	0.196	55%	0.548	C	S	.	.	G	3₁₀ helix	trans	-79.9	-3.4	-175.6	-60.9	-170.3	122.3	0	0	115.4	M155 V183 R184 L187	M155-E157 PolarHBondContact O-N 2.76Å; M155-E157 VanDerWaalsContact O-N 3.16Å; E157-V183 HydrophobicContact CB-CB 4.11Å; E157-V183 HydrophobicContact CB-CG1 4.3Å; E157-V183 HydrophobicContact CB-CG2 4.47Å; E157-V183 HydrophobicContact CG-CB 4.38Å; E157-V183 HydrophobicContact CG-CG1 4.33Å; E157-V183 VanDerWaalsContact OE1-CG1 3.25Å; E157-V183 WeakPolarHBondContact OE1-CG1 3.31Å; E157-V183 WeakPolarHBondContact OE2-CB 3.45Å; E157-R184 WeakPolarHBondContact OE2-CA 3.43Å; E157-R184 PolarHBondContact OE2-N 2.93Å; E157-R184 VanDerWaalsContact OE2-N 3.14Å; E157-L187 HydrophobicContact CG-CD2 4.37Å
158	E	42.1	Very low	43.7	Very low	116 Å²	116	109.4 Å²	109.4	54%	0.542	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-66.8	-37	178.5	-71.3	-170	124.7	0	0	113.4	T156 H180	T156-E158 VanDerWaalsContact C-N 3.34Å; T156-E158 PolarHBondContact O-N 3.46Å; E158-H180 IonicContact OE1-CE1 3.75Å; E158-H180 PolarHBondContact OE1-CE1 3.04Å; E158-H180 IonicContact OE1-NE2 2.61Å; E158-H180 PolarHBondContact OE1-NE2 3.42Å
159	N	36.9	Very low	43.2	Very low	144 Å²	144	108.1 Å²	108.1	77%	0.77	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-85.1	-16.2	-166.2	-90.7	-23.4	0	0	0	115.8
160	H	39.4	Very low	42.7	Very low	174 Å²	174	113 Å²	113	81%	0.806	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-90.1	-6.8	-172	-97.5	-75.7	0	0	0	115.5
161	L	43.2	Very low	42.1	Very low	84 Å²	84	119.9 Å²	119.9	44%	0.44	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-93.3	5.2	-179.9	-76.1	176	0	0	0	114.8	K179 V183	L161-K179 HydrophobicContact CD1-CB 4.09Å; L161-K179 HydrophobicContact CD1-CD 4.45Å; L161-V183 HydrophobicContact CD1-CG2 3.73Å
162	N	39.8	Very low	41.2	Very low	130 Å²	130	121.5 Å²	121.5	70%	0.695	65%	0.647	S	S	*	*	S	Bend	trans	-106.2	38.9	-168.6	-152.5	91	0	0	0	113.8
163	S	34.1	Very low	40.8	Very low	113 Å²	113	122.3 Å²	122.3	79%	0.79	66%	0.659	S	S	*	*	S	Bend	trans	-146.2	18.6	-176.8	-60.6	0	0	0	0	115.7
164	Q	36.1	Very low	40	Very low	195 Å²	195	124.6 Å²	124.6	91%	0.911	68%	0.678	S	S	*	*			trans	-131.7	93.2	163.5	-79.4	-168.1	-42.6	0	0	110.4
165	E	41	Very low	39.2	Very low	190 Å²	190	127.7 Å²	127.7	89%	0.888	70%	0.698	S	S	*	*			trans	-118.6	121.8	164.1	-73.8	-170.2	97.9	0	0	109.3
166	S	30.7	Very low	38.9	Very low	118 Å²	118	130.4 Å²	130.4	83%	0.825	71%	0.709	S	S	*	*			trans	-152.9	57	164.1	69.4	0	0	0	0	112
167	H	37.1	Very low	38.5	Very low	155 Å²	155	132.5 Å²	132.5	72%	0.718	71%	0.712	S	S	*	*				50.4	102.3	129.2	-171.3	-53.5	0	0	0	119.2	D169	H167-D169 IonicContact CE1-OD2 3.49Å; H167-D169 PolarHBondContact CE1-OD2 3.16Å; H167-D169 IonicContact NE2-OD2 3.9Å
168	V	34.9	Very low	38.2	Very low	141 Å²	141	136.7 Å²	136.7	86%	0.855	73%	0.732	S	S	*	*				-146.4	134	121.2	-168	0	0	0	0	108.8
169	D	42.3	Very low	37.8	Very low	126 Å²	126	137.6 Å²	137.6	67%	0.674	73%	0.734	S	S	*	*			trans	-74.7	148.1	-177.3	-48.1	-104.8	0	0	0	114.5	H167	H167-D169 IonicContact CE1-OD2 3.49Å; H167-D169 PolarHBondContact CE1-OD2 3.16Å; H167-D169 IonicContact NE2-OD2 3.9Å
170	I	41.1	Very low	37.6	Very low	166 Å²	166	133.9 Å²	133.9	85%	0.851	71%	0.712	S	S	*	*			trans	-150.6	141.6	136.7	-105.1	159.1	0	0	0	108	T172	I170-T172 PolarHBondContact O-N 3.41Å
171	D	40.4	Very low	37.6	Very low	147 Å²	147	128.5 Å²	128.5	79%	0.786	69%	0.691	S	S	*	*	S	Bend	trans	-77	106	-166.9	-165.1	-33.8	0	0	0	113.2
172	T	36.1	Very low	37.2	Very low	120 Å²	120	128.9 Å²	128.9	74%	0.736	70%	0.7	S	S	*	*			trans	-162.8	125.9	149.3	-70.2	0	0	0	0	107.8	I170 P174	I170-T172 PolarHBondContact O-N 3.41Å; T172-P174 VanDerWaalsContact O-CD 3.23Å; T172-P174 WeakPolarHBondContact O-CD 3.32Å
173	S	42.3	Very low	37	Very low	106 Å²	106	124.8 Å²	124.8	74%	0.741	68%	0.679	S	S	*	*			trans	-69	117.6	-173.6	-47.1	0	0	0	0	113.6	T175	S173-T175 PolarHBondContact O-N 2.73Å
174	P	35.8	Very low	37.2	Very low	102 Å²	102	123.2 Å²	123.2	66%	0.662	66%	0.656	S	S	*	*			trans	-78.9	114.6	164.6	32	-30.2	0	0	0	108.9	T172	T172-P174 VanDerWaalsContact O-CD 3.23Å; T172-P174 WeakPolarHBondContact O-CD 3.32Å
175	T	33.9	Very low	37.3	Very low	95 Å²	95	119.7 Å²	119.7	58%	0.583	64%	0.638	S	S	*	*			trans	-61	140.6	176.3	24.3	0	0	0	0	110.9	S173 Q177 E178	S173-T175 PolarHBondContact O-N 2.73Å; T175-Q177 PolarHBondContact O-N 2.99Å; T175-E178 PolarHBondContact O-N 3.29Å
176	Q	39	Very low	37	Very low	174 Å²	174	112.7 Å²	112.7	81%	0.813	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-17.1	-179.3	-70.4	172.6	-66.4	0	0	114.6	E178	Q176-E178 PolarHBondContact O-N 2.86Å
177	Q	37.1	Very low	37.4	Very low	145 Å²	145	109.7 Å²	109.7	68%	0.678	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.9	-34	174.9	-165.3	164.9	0.4	0	0	113.8	T175 T181	T175-Q177 PolarHBondContact O-N 2.99Å; Q177-T181 WeakPolarHBondContact O-CG2 3.42Å
178	E	38.1	Very low	37.7	Very low	129 Å²	129	106.1 Å²	106.1	60%	0.603	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-53.4	-174.4	-63.4	-165.7	122.9	0	0	113.3	T175 Q176 H180 T181	T175-E178 PolarHBondContact O-N 3.29Å; Q176-E178 PolarHBondContact O-N 2.86Å; E178-H180 PolarHBondContact O-N 2.77Å; E178-T181 PolarHBondContact O-N 3.46Å; E178-T181 PolarHBondContact O-OG1 3.47Å
179	K	33.7	Very low	37.9	Very low	136 Å²	136	99.9 Å²	99.9	59%	0.591	53%	0.532	S	S	*	.	H	α-helix	trans	-54.4	-41.3	-178.9	-76.3	-172	176.4	-175.4	0	112.1	L161 T181 C182	L161-K179 HydrophobicContact CD1-CB 4.09Å; L161-K179 HydrophobicContact CD1-CD 4.45Å; K179-T181 PolarHBondContact O-N 3.38Å; K179-C182 PolarHBondContact O-N 3.4Å
180	H	33.9	Very low	37.9	Very low	65 Å²	65	96.3 Å²	96.3	30%	0.301	52%	0.52	S	S	.	.	H	α-helix	trans	-62.5	-18.9	177.3	-95.1	-78.7	0	0	0	115.9	E158 E178 R184	E158-H180 IonicContact OE1-CE1 3.75Å; E158-H180 PolarHBondContact OE1-CE1 3.04Å; E158-H180 IonicContact OE1-NE2 2.61Å; E158-H180 PolarHBondContact OE1-NE2 3.42Å; E178-H180 PolarHBondContact O-N 2.77Å; H180-R184 PolarHBondContact ND1-NH2 3.45Å; H180-R184 PolarHBondContact O-NE 2.86Å
181	T	38.8	Very low	38.1	Very low	62 Å²	62	92.4 Å²	92.4	38%	0.38	50%	0.497	S	S	.	.	H	α-helix	trans	-95	-12.4	-178.9	65.9	0	0	0	0	113.4	Q177 E178 K179 K185	Q177-T181 WeakPolarHBondContact O-CG2 3.42Å; E178-T181 PolarHBondContact O-N 3.46Å; E178-T181 PolarHBondContact O-OG1 3.47Å; K179-T181 PolarHBondContact O-N 3.38Å; T181-K185 WeakPolarHBondContact O-CD 3.44Å; T181-K185 WeakPolarHBondContact O-CE 3.39Å; T181-K185 WeakPolarHBondContact O-CG 3.33Å
182	C	35.7	Very low	38.2	Very low	92 Å²	92	87.2 Å²	87.2	62%	0.622	47%	0.474	S	S	*	.	H	α-helix	trans	-82.1	-59.6	-178.9	-169.7	0	0	0	0	111.1	K179 R184 K185 S186	K179-C182 PolarHBondContact O-N 3.4Å; C182-R184 PolarHBondContact O-N 2.94Å; C182-K185 PolarHBondContact O-N 3.02Å; C182-K185 VanDerWaalsContact O-N 3.15Å; C182-S186 PolarHBondContact O-N 3.48Å; C182-S186 VanDerWaalsContact O-N 3.16Å
183	V	35.3	Very low	38.7	Very low	43 Å²	43	83.3 Å²	83.3	26%	0.261	45%	0.449	S	S	.	.	H	α-helix	trans	-60.6	-49.1	-176.7	-124.8	0	0	0	0	111.1	E157 L161 K185 S186 L187	E157-V183 HydrophobicContact CB-CB 4.11Å; E157-V183 HydrophobicContact CB-CG1 4.3Å; E157-V183 HydrophobicContact CB-CG2 4.47Å; E157-V183 HydrophobicContact CG-CB 4.38Å; E157-V183 HydrophobicContact CG-CG1 4.33Å; E157-V183 VanDerWaalsContact OE1-CG1 3.25Å; E157-V183 WeakPolarHBondContact OE1-CG1 3.31Å; E157-V183 WeakPolarHBondContact OE2-CB 3.45Å; L161-V183 HydrophobicContact CD1-CG2 3.73Å; V183-K185 VanDerWaalsContact C-N 3.26Å; V183-K185 PolarHBondContact O-N 2.59Å; V183-K185 VanDerWaalsContact O-N 3.13Å; V183-S186 WeakPolarHBondContact O-CA 3.45Å; V183-S186 WeakPolarHBondContact O-CB 3.16Å; V183-S186 PolarHBondContact O-N 3.14Å; V183-L187 PolarHBondContact O-N 2.95Å
184	R	37.6	Very low	38.7	Very low	80 Å²	80	80.6 Å²	80.6	30%	0.302	43%	0.433	S	S	.	.	H	α-helix	trans	-56.6	-32.8	176.6	-72.3	-166	-81.7	-172.9	-14	114	E157 H180 C182 I188	E157-R184 WeakPolarHBondContact OE2-CA 3.43Å; E157-R184 PolarHBondContact OE2-N 2.93Å; E157-R184 VanDerWaalsContact OE2-N 3.14Å; H180-R184 PolarHBondContact ND1-NH2 3.45Å; H180-R184 PolarHBondContact O-NE 2.86Å; C182-R184 PolarHBondContact O-N 2.94Å; R184-I188 WeakPolarHBondContact O-CB 3.45Å; R184-I188 VanDerWaalsContact O-CD1 3.27Å; R184-I188 WeakPolarHBondContact O-CD1 3.31Å; R184-I188 WeakPolarHBondContact O-CG1 3.22Å; R184-I188 PolarHBondContact O-N 3.21Å
185	K	38.2	Very low	39.3	Very low	121 Å²	121	78.7 Å²	78.7	53%	0.526	41%	0.414	S	S	.	.	H	α-helix	trans	-73.4	-38.1	174.7	-74.7	173.4	-165.5	165.4	0	112.1	T181 C182 V183 C189	T181-K185 WeakPolarHBondContact O-CD 3.44Å; T181-K185 WeakPolarHBondContact O-CE 3.39Å; T181-K185 WeakPolarHBondContact O-CG 3.33Å; C182-K185 PolarHBondContact O-N 3.02Å; C182-K185 VanDerWaalsContact O-N 3.15Å; V183-K185 VanDerWaalsContact C-N 3.26Å; V183-K185 PolarHBondContact O-N 2.59Å; V183-K185 VanDerWaalsContact O-N 3.13Å; K185-C189 WeakPolarHBondContact O-CB 3.17Å; K185-C189 PolarHBondContact O-N 3.13Å
186	S	36	Very low	39.9	Very low	43 Å²	43	77.3 Å²	77.3	30%	0.301	40%	0.403	S	S	.	.	H	α-helix	trans	-64.8	-48.5	174.5	-163.5	0	0	0	0	110.9	C182 V183 C189 A190	C182-S186 PolarHBondContact O-N 3.48Å; C182-S186 VanDerWaalsContact O-N 3.16Å; V183-S186 WeakPolarHBondContact O-CA 3.45Å; V183-S186 WeakPolarHBondContact O-CB 3.16Å; V183-S186 PolarHBondContact O-N 3.14Å; S186-C189 PolarHBondContact O-N 3.15Å; S186-A190 VanDerWaalsContact O-CB 3.28Å; S186-A190 WeakPolarHBondContact O-CB 3.26Å; S186-A190 PolarHBondContact O-N 3.23Å
187	L	38.4	Very low	40.3	Very low	56 Å²	56	72 Å²	72	29%	0.293	38%	0.379	S	S	.	.	H	α-helix	trans	-68.3	-39.3	-179.9	-156.3	74.3	0	0	0	112.6	I153 E157 V183 A190 F191	I153-L187 HydrophobicContact CG2-CD2 4.02Å; E157-L187 HydrophobicContact CG-CD2 4.37Å; V183-L187 PolarHBondContact O-N 2.95Å; L187-A190 PolarHBondContact O-N 3.25Å; L187-F191 HydrophobicContact CG-CD2 4.37Å; L187-F191 WeakPolarHBondContact O-CB 3.47Å; L187-F191 PolarHBondContact O-N 2.8Å
188	I	43.2	Very low	40.8	Very low	80 Å²	80	67.2 Å²	67.2	41%	0.41	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-39.3	173.8	-72.2	166	0	0	0	111	L133 R184 F191 A192	L133-I188 HydrophobicContact CD2-CD1 3.47Å; L133-I188 VanDerWaalsContact CD2-CD1 3.47Å; L133-I188 HydrophobicContact CD2-CG1 4.1Å; R184-I188 WeakPolarHBondContact O-CB 3.45Å; R184-I188 VanDerWaalsContact O-CD1 3.27Å; R184-I188 WeakPolarHBondContact O-CD1 3.31Å; R184-I188 WeakPolarHBondContact O-CG1 3.22Å; R184-I188 PolarHBondContact O-N 3.21Å; I188-F191 PolarHBondContact O-N 2.68Å; I188-A192 VanDerWaalsContact O-CB 3.29Å; I188-A192 WeakPolarHBondContact O-CB 3.37Å; I188-A192 PolarHBondContact O-N 2.98Å
189	C	40.2	Very low	41	Very low	9 Å²	9	62.9 Å²	62.9	6%	0.061	34%	0.344	C	S	.	.	H	α-helix	trans	-77.2	-34.6	177.2	-158.7	0	0	0	0	112.7	Y67 K185 S186 F191 A192 I193	Y67-C189 VanDerWaalsContact CB-CB 3.43Å; Y67-C189 WeakPolarHBondContact CB-SG 3.45Å; Y67-C189 HydrophobicContact CD1-CB 4.05Å; Y67-C189 HydrophobicContact CD2-CB 4.08Å; Y67-C189 HydrophobicContact CG-CB 3.61Å; K185-C189 WeakPolarHBondContact O-CB 3.17Å; K185-C189 PolarHBondContact O-N 3.13Å; S186-C189 PolarHBondContact O-N 3.15Å; C189-F191 VanDerWaalsContact C-N 3.27Å; C189-F191 PolarHBondContact O-N 3.16Å; C189-A192 PolarHBondContact O-N 2.94Å; C189-A192 VanDerWaalsContact O-N 3.16Å; C189-I193 VanDerWaalsContact O-CB 3.28Å; C189-I193 WeakPolarHBondContact O-CB 3.2Å; C189-I193 WeakPolarHBondContact O-CD1 3.35Å; C189-I193 VanDerWaalsContact O-CG1 3.27Å; C189-I193 WeakPolarHBondContact O-CG1 3.42Å; C189-I193 PolarHBondContact O-N 3.07Å; C189-I193 VanDerWaalsContact SG-CD1 3.57Å
190	A	41.4	Very low	41.4	Very low	51 Å²	51	58.4 Å²	58.4	42%	0.421	33%	0.326	S	S	.	.	H	α-helix	trans	-59.9	-39.3	169.2	0	0	0	0	0	110.9	S186 L187 A194	S186-A190 VanDerWaalsContact O-CB 3.28Å; S186-A190 WeakPolarHBondContact O-CB 3.26Å; S186-A190 PolarHBondContact O-N 3.23Å; L187-A190 PolarHBondContact O-N 3.25Å; A190-A194 WeakPolarHBondContact O-CA 3Å; A190-A194 WeakPolarHBondContact O-CB 3.28Å; A190-A194 PolarHBondContact O-N 3.25Å
191	F	44.4	Very low	41.7	Very low	85 Å²	85	56.4 Å²	56.4	37%	0.373	32%	0.317	S	S	.	.	H	α-helix	trans	-70.5	-39	170.4	-98.9	-94	0	0	0	113.1	I153 L187 I188 C189 A194 F195	I153-F191 HydrophobicContact CD1-CZ 4.45Å; I153-F191 HydrophobicContact CG2-CE2 4.47Å; L187-F191 HydrophobicContact CG-CD2 4.37Å; L187-F191 WeakPolarHBondContact O-CB 3.47Å; L187-F191 PolarHBondContact O-N 2.8Å; I188-F191 PolarHBondContact O-N 2.68Å; C189-F191 VanDerWaalsContact C-N 3.27Å; C189-F191 PolarHBondContact O-N 3.16Å; F191-A194 CarbonylContact O-C 3.47Å; F191-A194 PolarHBondContact O-N 3.06Å; F191-F195 WeakPolarHBondContact O-CA 3.27Å; F191-F195 WeakPolarHBondContact O-CB 3.25Å; F191-F195 PolarHBondContact O-N 2.61Å
192	A	43.8	Very low	41.8	Very low	37 Å²	37	55.9 Å²	55.9	31%	0.306	31%	0.311	S	S	.	.	H	α-helix	trans	-68	-39.9	178.2	0	0	0	0	0	111.6	I188 C189 F195 I196	I188-A192 VanDerWaalsContact O-CB 3.29Å; I188-A192 WeakPolarHBondContact O-CB 3.37Å; I188-A192 PolarHBondContact O-N 2.98Å; C189-A192 PolarHBondContact O-N 2.94Å; C189-A192 VanDerWaalsContact O-N 3.16Å; A192-F195 PolarHBondContact O-N 3.05Å; A192-I196 VanDerWaalsContact O-CB 3.32Å; A192-I196 WeakPolarHBondContact O-CB 3.33Å; A192-I196 WeakPolarHBondContact O-CD1 3.22Å; A192-I196 WeakPolarHBondContact O-CG1 3.48Å; A192-I196 PolarHBondContact O-N 3.48Å
193	I	45.4	Very low	41.9	Very low	39 Å²	39	53.3 Å²	53.3	20%	0.2	30%	0.296	C	S	.	.	H	α-helix	trans	-69.5	-47.8	172.6	-67.8	160.2	0	0	0	109.2	M62 Y67 C189 F195 I196 I197	M62-I193 HydrophobicContact CE-CD1 3.44Å; M62-I193 VanDerWaalsContact CE-CD1 3.44Å; M62-I193 HydrophobicContact CG-CD1 4.49Å; Y67-I193 HydrophobicContact CD1-CD1 4.17Å; Y67-I193 HydrophobicContact CE1-CD1 4.32Å; C189-I193 VanDerWaalsContact O-CB 3.28Å; C189-I193 WeakPolarHBondContact O-CB 3.2Å; C189-I193 WeakPolarHBondContact O-CD1 3.35Å; C189-I193 VanDerWaalsContact O-CG1 3.27Å; C189-I193 WeakPolarHBondContact O-CG1 3.42Å; C189-I193 PolarHBondContact O-N 3.07Å; C189-I193 VanDerWaalsContact SG-CD1 3.57Å; I193-F195 PolarHBondContact O-N 3.49Å; I193-I196 PolarHBondContact O-N 3.14Å; I193-I197 HydrophobicContact CG2-CD1 3.65Å; I193-I197 HydrophobicContact CG2-CG1 4.28Å; I193-I197 WeakPolarHBondContact O-CA 3.22Å; I193-I197 WeakPolarHBondContact O-CB 3.48Å; I193-I197 WeakPolarHBondContact O-CG1 3.41Å; I193-I197 PolarHBondContact O-N 3.15Å
194	A	44.1	Very low	42	Very low	49 Å²	49	51.2 Å²	51.2	41%	0.405	28%	0.284	S	S	.	.	H	α-helix	trans	-66.4	-16.3	175.2	0	0	0	0	0	113.3	A190 F191 S198	A190-A194 WeakPolarHBondContact O-CA 3Å; A190-A194 WeakPolarHBondContact O-CB 3.28Å; A190-A194 PolarHBondContact O-N 3.25Å; F191-A194 CarbonylContact O-C 3.47Å; F191-A194 PolarHBondContact O-N 3.06Å; A194-S198 WeakPolarHBondContact O-CA 3.28Å; A194-S198 WeakPolarHBondContact O-CB 3.47Å; A194-S198 PolarHBondContact O-N 3.39Å; A194-S198 PolarHBondContact O-OG 3.42Å
195	F	46.9	Very low	42	Very low	62 Å²	62	49 Å²	49	27%	0.272	28%	0.278	S	S	.	.	H	α-helix	trans	-94.5	-38.4	174.3	178.8	-114.9	0	0	0	112.8	T140 F141 F191 A192 I193 I197 S198 V199	T140-F195 HydrophobicContact CG2-CE1 4.24Å; T140-F195 HydrophobicContact CG2-CE2 3.71Å; T140-F195 HydrophobicContact CG2-CZ 3.37Å; F141-F195 AromaticContact CE1-CD2 3.7Å; F141-F195 HydrophobicContact CE1-CD2 3.7Å; F141-F195 AromaticContact CE1-CE2 3.84Å; F141-F195 HydrophobicContact CE1-CE2 3.84Å; F141-F195 HydrophobicContact CE2-CD2 4.2Å; F141-F195 HydrophobicContact CE2-CE2 4.3Å; F141-F195 HydrophobicContact CZ-CB 4.38Å; F141-F195 AromaticContact CZ-CD2 3.23Å; F141-F195 HydrophobicContact CZ-CD2 3.23Å; F141-F195 AromaticContact CZ-CE2 3.56Å; F141-F195 HydrophobicContact CZ-CE2 3.56Å; F141-F195 AromaticContact CZ-CG 3.92Å; F141-F195 HydrophobicContact CZ-CG 3.92Å; F141-F195 HydrophobicContact CZ-CZ 4.48Å; F191-F195 WeakPolarHBondContact O-CA 3.27Å; F191-F195 WeakPolarHBondContact O-CB 3.25Å; F191-F195 PolarHBondContact O-N 2.61Å; A192-F195 PolarHBondContact O-N 3.05Å; I193-F195 PolarHBondContact O-N 3.49Å; F195-I197 VanDerWaalsContact C-N 3.35Å; F195-S198 CarbonylContact O-C 3.51Å; F195-S198 PolarHBondContact O-N 2.87Å; F195-S198 VanDerWaalsContact O-N 3.11Å; F195-V199 HydrophobicContact CD1-CG2 4.35Å; F195-V199 HydrophobicContact CD2-CG2 3.7Å; F195-V199 HydrophobicContact CE1-CG2 3.99Å; F195-V199 HydrophobicContact CE2-CG2 3.3Å; F195-V199 HydrophobicContact CG-CG2 4.23Å; F195-V199 HydrophobicContact CZ-CG2 3.46Å; F195-V199 VanDerWaalsContact CZ-CG2 3.46Å; F195-V199 VanDerWaalsContact O-CB 3.27Å; F195-V199 WeakPolarHBondContact O-CB 3.31Å; F195-V199 VanDerWaalsContact O-CG2 3.28Å; F195-V199 WeakPolarHBondContact O-CG2 3.09Å; F195-V199 PolarHBondContact O-N 3.47Å
196	I	46.9	Very low	42	Very low	66 Å²	66	45.3 Å²	45.3	34%	0.338	26%	0.263	S	S	.	.	H	α-helix	trans	-61.3	-50.7	167.3	-72.6	163	0	0	0	107.9	A192 I193 S198 V199 M200	A192-I196 VanDerWaalsContact O-CB 3.32Å; A192-I196 WeakPolarHBondContact O-CB 3.33Å; A192-I196 WeakPolarHBondContact O-CD1 3.22Å; A192-I196 WeakPolarHBondContact O-CG1 3.48Å; A192-I196 PolarHBondContact O-N 3.48Å; I193-I196 PolarHBondContact O-N 3.14Å; I196-S198 VanDerWaalsContact C-N 3.34Å; I196-S198 PolarHBondContact O-N 2.76Å; I196-V199 PolarHBondContact O-N 2.73Å; I196-M200 HydrophobicContact CG2-SD 4.42Å; I196-M200 WeakPolarHBondContact O-CA 3.18Å; I196-M200 VanDerWaalsContact O-CB 3.25Å; I196-M200 WeakPolarHBondContact O-CB 3.44Å; I196-M200 WeakPolarHBondContact O-CG 3.43Å; I196-M200 PolarHBondContact O-N 3.11Å
197	I	47.5	Very low	42.1	Very low	63 Å²	63	46.9 Å²	46.9	32%	0.323	27%	0.266	S	S	.	.	H	α-helix	trans	-59.9	-41.8	168.8	-65.1	176.4	0	0	0	109.7	I193 F195 V199 M200 L201	I193-I197 HydrophobicContact CG2-CD1 3.65Å; I193-I197 HydrophobicContact CG2-CG1 4.28Å; I193-I197 WeakPolarHBondContact O-CA 3.22Å; I193-I197 WeakPolarHBondContact O-CB 3.48Å; I193-I197 WeakPolarHBondContact O-CG1 3.41Å; I193-I197 PolarHBondContact O-N 3.15Å; F195-I197 VanDerWaalsContact C-N 3.35Å; I197-V199 PolarHBondContact O-N 3.2Å; I197-M200 CarbonylContact O-C 3.59Å; I197-L201 HydrophobicContact CG2-CD1 3.36Å; I197-L201 HydrophobicContact CG2-CG 4.04Å; I197-L201 WeakPolarHBondContact O-CA 3.44Å; I197-L201 WeakPolarHBondContact O-CB 3.47Å; I197-L201 WeakPolarHBondContact O-CD1 3.09Å; I197-L201 WeakPolarHBondContact O-CG 3.14Å; I197-L201 PolarHBondContact O-N 2.86Å
198	S	46.8	Very low	41.9	Very low	44 Å²	44	46.4 Å²	46.4	31%	0.308	26%	0.263	S	S	.	.	H	α-helix	trans	-73.2	-18.9	177.3	-67.5	0	0	0	0	116.1	A194 F195 I196 L201 I202	A194-S198 WeakPolarHBondContact O-CA 3.28Å; A194-S198 WeakPolarHBondContact O-CB 3.47Å; A194-S198 PolarHBondContact O-N 3.39Å; A194-S198 PolarHBondContact O-OG 3.42Å; F195-S198 CarbonylContact O-C 3.51Å; F195-S198 PolarHBondContact O-N 2.87Å; F195-S198 VanDerWaalsContact O-N 3.11Å; I196-S198 VanDerWaalsContact C-N 3.34Å; I196-S198 PolarHBondContact O-N 2.76Å; S198-L201 CarbonylContact O-C 3.52Å; S198-L201 PolarHBondContact O-N 3.22Å; S198-I202 WeakPolarHBondContact O-CB 3.41Å; S198-I202 WeakPolarHBondContact O-CG1 3.5Å; S198-I202 PolarHBondContact O-N 3.39Å
199	V	42.9	Very low	41.6	Very low	37 Å²	37	49.5 Å²	49.5	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-91.8	-41.4	177.1	169.6	0	0	0	0	110.6	M107 F195 I196 I197 L201 I202 A203	M107-V199 HydrophobicContact CE-CG1 4.39Å; F195-V199 HydrophobicContact CD1-CG2 4.35Å; F195-V199 HydrophobicContact CD2-CG2 3.7Å; F195-V199 HydrophobicContact CE1-CG2 3.99Å; F195-V199 HydrophobicContact CE2-CG2 3.3Å; F195-V199 HydrophobicContact CG-CG2 4.23Å; F195-V199 HydrophobicContact CZ-CG2 3.46Å; F195-V199 VanDerWaalsContact CZ-CG2 3.46Å; F195-V199 VanDerWaalsContact O-CB 3.27Å; F195-V199 WeakPolarHBondContact O-CB 3.31Å; F195-V199 VanDerWaalsContact O-CG2 3.28Å; F195-V199 WeakPolarHBondContact O-CG2 3.09Å; F195-V199 PolarHBondContact O-N 3.47Å; I196-V199 PolarHBondContact O-N 2.73Å; I197-V199 PolarHBondContact O-N 3.2Å; V199-L201 PolarHBondContact O-N 2.98Å; V199-L201 VanDerWaalsContact O-N 3.11Å; V199-I202 CarbonylContact O-C 2.93Å; V199-I202 VanDerWaalsContact O-C 3.23Å; V199-I202 VanDerWaalsContact O-CA 3.3Å; V199-I202 WeakPolarHBondContact O-CA 3.27Å; V199-I202 PolarHBondContact O-N 3.28Å; V199-A203 PolarHBondContact O-N 2.94Å
200	M	41.7	Very low	41.7	Very low	43 Å²	43	55.2 Å²	55.2	21%	0.212	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	26.4	155.3	-44.3	-165.5	92.1	0	0	111.4	I38 A41 L98 L102 I196 I197	I38-M200 HydrophobicContact CG1-CE 3.91Å; A41-M200 HydrophobicContact CB-CE 4.04Å; A41-M200 HydrophobicContact CB-SD 4.47Å; L98-M200 WeakPolarHBondContact CA-O 3.47Å; L98-M200 HydrophobicContact CD2-CB 3.73Å; L98-M200 HydrophobicContact CD2-CE 3.84Å; L98-M200 HydrophobicContact CD2-CG 4.39Å; L98-M200 HydrophobicContact CD2-SD 3.86Å; L98-M200 HydrophobicContact CG-CB 3.72Å; L98-M200 WeakPolarHBondContact CG-O 3.13Å; L102-M200 HydrophobicContact CD1-CB 4.26Å; L102-M200 WeakPolarHBondContact CD1-O 3.42Å; I196-M200 HydrophobicContact CG2-SD 4.42Å; I196-M200 WeakPolarHBondContact O-CA 3.18Å; I196-M200 VanDerWaalsContact O-CB 3.25Å; I196-M200 WeakPolarHBondContact O-CB 3.44Å; I196-M200 WeakPolarHBondContact O-CG 3.43Å; I196-M200 PolarHBondContact O-N 3.11Å; I197-M200 CarbonylContact O-C 3.59Å
201	L	41.3	Very low	41.4	Very low	22 Å²	22	55.9 Å²	55.9	12%	0.115	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-144.1	24.9	156	-64.1	173.3	0	0	0	108.6	L97 L98 K101 L102 I197 S198 V199	L97-L201 WeakPolarHBondContact O-CD2 3.29Å; L98-L201 WeakPolarHBondContact O-CD2 3.46Å; K101-L201 HydrophobicContact CB-CB 3.86Å; K101-L201 HydrophobicContact CB-CD2 3.5Å; K101-L201 VanDerWaalsContact CB-CD2 3.5Å; K101-L201 HydrophobicContact CB-CG 4.15Å; K101-L201 HydrophobicContact CD-CB 3.85Å; K101-L201 HydrophobicContact CG-CB 4.38Å; L102-L201 CarbonylContact C-O 3.4Å; L102-L201 VanDerWaalsContact CA-CA 3.49Å; L102-L201 CarbonylContact O-C 3.4Å; I197-L201 HydrophobicContact CG2-CD1 3.36Å; I197-L201 HydrophobicContact CG2-CG 4.04Å; I197-L201 WeakPolarHBondContact O-CA 3.44Å; I197-L201 WeakPolarHBondContact O-CB 3.47Å; I197-L201 WeakPolarHBondContact O-CD1 3.09Å; I197-L201 WeakPolarHBondContact O-CG 3.14Å; I197-L201 PolarHBondContact O-N 2.86Å; S198-L201 CarbonylContact O-C 3.52Å; S198-L201 PolarHBondContact O-N 3.22Å; V199-L201 PolarHBondContact O-N 2.98Å; V199-L201 VanDerWaalsContact O-N 3.11Å
202	I	40.9	Very low	41.2	Very low	52 Å²	52	59.4 Å²	59.4	27%	0.267	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.2	8	171.5	-77.5	175.7	0	0	0	114.2	L102 S103 A105 M107 S198 V199	L102-I202 CarbonylContact O-C 2.8Å; L102-I202 WeakPolarHBondContact O-CA 3.27Å; L102-I202 PolarHBondContact O-N 2.88Å; S103-I202 WeakPolarHBondContact CA-O 3.34Å; S103-I202 WeakPolarHBondContact CB-O 3.48Å; S103-I202 PolarHBondContact N-O 3.39Å; A105-I202 HydrophobicContact CB-CD1 3.91Å; A105-I202 HydrophobicContact CB-CG1 3.88Å; A105-I202 HydrophobicContact CB-CG2 4.26Å; M107-I202 HydrophobicContact CG-CG2 3.5Å; M107-I202 WeakPolarHBondContact CG-O 3.34Å; M107-I202 HydrophobicContact SD-CG2 3.61Å; S198-I202 WeakPolarHBondContact O-CB 3.41Å; S198-I202 WeakPolarHBondContact O-CG1 3.5Å; S198-I202 PolarHBondContact O-N 3.39Å; V199-I202 CarbonylContact O-C 2.93Å; V199-I202 VanDerWaalsContact O-C 3.23Å; V199-I202 VanDerWaalsContact O-CA 3.3Å; V199-I202 WeakPolarHBondContact O-CA 3.27Å; V199-I202 PolarHBondContact O-N 3.28Å
203	A	37.1	Very low	40.9	Very low	37 Å²	37	70.3 Å²	70.3	31%	0.306	36%	0.362	S	S	.	.	S	Bend	trans	-99.6	-44.4	178.1	0	0	0	0	0	122.4	L102 S103 V199	L102-A203 HydrophobicContact CD2-CB 3.68Å; L102-A203 HydrophobicContact CG-CB 3.78Å; S103-A203 WeakPolarHBondContact CB-O 3.44Å; S103-A203 PolarHBondContact OG-O 3.14Å; V199-A203 PolarHBondContact O-N 2.94Å
204	A	37.2	Very low	40.7	Very low	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.371	C	S	.	.	S	Bend	trans	-100.4	-13.8	-177.9	0	0	0	0	0	123.7	L30 E34 L102 S103 Q206 M207 L208	L30-A204 HydrophobicContact CD1-CB 4.16Å; L30-A204 HydrophobicContact CD2-CB 4.3Å; L30-A204 HydrophobicContact CG-CB 3.9Å; E34-A204 HydrophobicContact CG-CB 4.43Å; E34-A204 WeakPolarHBondContact OE1-CA 3.43Å; E34-A204 VanDerWaalsContact OE1-CB 3.28Å; E34-A204 WeakPolarHBondContact OE1-CB 3.22Å; E34-A204 PolarHBondContact OE1-N 3.46Å; E34-A204 WeakPolarHBondContact OE2-CA 2.85Å; E34-A204 WeakPolarHBondContact OE2-CB 3.44Å; L102-A204 HydrophobicContact CB-CB 3.36Å; L102-A204 HydrophobicContact CD2-CB 3.26Å; L102-A204 HydrophobicContact CG-CB 3.73Å; S103-A204 VanDerWaalsContact OG-CA 3.32Å; S103-A204 WeakPolarHBondContact OG-CA 3.24Å; S103-A204 PolarHBondContact OG-N 3.3Å; S103-A204 VanDerWaalsContact OG-N 3.12Å; A204-Q206 VanDerWaalsContact C-N 3.28Å; A204-Q206 PolarHBondContact O-N 2.97Å; A204-M207 VanDerWaalsContact C-N 3.3Å; A204-M207 HydrophobicContact CB-CB 4.28Å; A204-M207 HydrophobicContact CB-CG 4.21Å; A204-M207 CarbonylContact O-C 3.59Å; A204-M207 WeakPolarHBondContact O-CA 3.35Å; A204-M207 WeakPolarHBondContact O-CB 3.12Å; A204-M207 PolarHBondContact O-N 3.2Å; A204-L208 PolarHBondContact O-N 3.2Å
205	N	38.6	Very low	40.5	Very low	33 Å²	33	73.1 Å²	73.1	18%	0.176	37%	0.369	C	S	.	.	H	α-helix	trans	-78.8	-8.1	-178.8	-172.9	-84.6	0	0	0	113.2	P100 K101 S103 A104 L208 R209	P100-N205 PolarHBondContact O-ND2 3.16Å; K101-N205 WeakPolarHBondContact O-CB 2.93Å; S103-N205 CarbonylContact O-C 3.12Å; S103-N205 VanDerWaalsContact O-C 3.27Å; S103-N205 PolarHBondContact OG-N 3.18Å; A104-N205 HydrophobicContact CB-CB 4.41Å; N205-L208 HydrophobicContact CB-CD1 4.31Å; N205-R209 WeakPolarHBondContact O-CB 3.48Å; N205-R209 WeakPolarHBondContact O-CG 3.25Å; N205-R209 PolarHBondContact O-N 3.38Å; N205-R209 VanDerWaalsContact OD1-CZ 3.28Å; N205-R209 PolarHBondContact OD1-NE 2.81Å; N205-R209 PolarHBondContact OD1-NH2 3.19Å
206	Q	37.7	Very low	40.2	Very low	44 Å²	44	73.7 Å²	73.7	21%	0.206	37%	0.374	C	S	.	.	H	α-helix	trans	-67.8	-35.1	147.7	-78.6	-166.4	94.2	0	0	111.1	S103 M107 A204 R209 R210	S103-Q206 PolarHBondContact O-N 3.38Å; S103-Q206 WeakPolarHBondContact OG-CA 3.5Å; S103-Q206 WeakPolarHBondContact OG-CB 3.34Å; S103-Q206 PolarHBondContact OG-N 2.67Å; M107-Q206 PolarHBondContact O-NE2 2.79Å; A204-Q206 VanDerWaalsContact C-N 3.28Å; A204-Q206 PolarHBondContact O-N 2.97Å; Q206-R209 CarbonylContact O-C 3.35Å; Q206-R209 PolarHBondContact O-N 2.82Å; Q206-R210 WeakPolarHBondContact O-CA 3.33Å; Q206-R210 WeakPolarHBondContact O-CB 3.45Å; Q206-R210 WeakPolarHBondContact O-CG 3.23Å; Q206-R210 PolarHBondContact O-N 2.95Å
207	M	37.6	Very low	39.8	Very low	75 Å²	75	74.1 Å²	74.1	37%	0.369	38%	0.376	S	S	.	.	H	α-helix	trans	-64.9	-47.2	169.1	-48.2	-61.1	-162.1	0	0	109.9	P31 E34 A204 R209 R210 G211	P31-M207 HydrophobicContact CG-CB 4.14Å; P31-M207 HydrophobicContact CG-CE 4.11Å; P31-M207 HydrophobicContact CG-CG 3.83Å; P31-M207 HydrophobicContact CG-SD 4.12Å; E34-M207 VanDerWaalsContact OE2-CG 3.22Å; E34-M207 WeakPolarHBondContact OE2-CG 3.41Å; A204-M207 VanDerWaalsContact C-N 3.3Å; A204-M207 HydrophobicContact CB-CB 4.28Å; A204-M207 HydrophobicContact CB-CG 4.21Å; A204-M207 CarbonylContact O-C 3.59Å; A204-M207 WeakPolarHBondContact O-CA 3.35Å; A204-M207 WeakPolarHBondContact O-CB 3.12Å; A204-M207 PolarHBondContact O-N 3.2Å; M207-R209 VanDerWaalsContact C-N 3.31Å; M207-R209 PolarHBondContact O-N 3.48Å; M207-R210 PolarHBondContact O-N 3.16Å; M207-G211 PolarHBondContact O-N 3.42Å
208	L	35.1	Very low	39.3	Very low	46 Å²	46	74.8 Å²	74.8	24%	0.241	38%	0.38	C	S	.	.	H	α-helix	trans	-62.6	-29	172	-62.7	166.5	0	0	0	113.7	V28 A204 N205	V28-L208 HydrophobicContact CG1-CD1 4.03Å; V28-L208 HydrophobicContact CG1-CD2 4.26Å; A204-L208 PolarHBondContact O-N 3.2Å; N205-L208 HydrophobicContact CB-CD1 4.31Å
209	R	37	Very low	38.8	Very low	146 Å²	146	76.9 Å²	76.9	55%	0.551	38%	0.384	S	S	*	.	H	α-helix	trans	-90.2	-26.5	176	-74.1	176.8	-142.8	-177.5	7.7	114.5	A104 N205 Q206 M207 G211 M212	A104-R209 VanDerWaalsContact CA-NH2 3.29Å; A104-R209 PolarHBondContact O-NH2 3.24Å; A104-R209 VanDerWaalsContact O-NH2 3.14Å; N205-R209 WeakPolarHBondContact O-CB 3.48Å; N205-R209 WeakPolarHBondContact O-CG 3.25Å; N205-R209 PolarHBondContact O-N 3.38Å; N205-R209 VanDerWaalsContact OD1-CZ 3.28Å; N205-R209 PolarHBondContact OD1-NE 2.81Å; N205-R209 PolarHBondContact OD1-NH2 3.19Å; Q206-R209 CarbonylContact O-C 3.35Å; Q206-R209 PolarHBondContact O-N 2.82Å; M207-R209 VanDerWaalsContact C-N 3.31Å; M207-R209 PolarHBondContact O-N 3.48Å; R209-G211 VanDerWaalsContact C-N 3.33Å; R209-M212 PolarHBondContact O-N 3.25Å
210	R	41	Very low	38.5	Very low	128 Å²	128	79.7 Å²	79.7	48%	0.483	40%	0.396	S	S	.	.	H	α-helix	trans	-75.3	-29.7	169.8	-71.6	172.6	-175.5	-147	2.4	109.1	D109 Q206 M207 M212	D109-R210 VanDerWaalsContact CG-NH2 3.34Å; D109-R210 IonicContact OD1-CZ 2.61Å; D109-R210 IonicContact OD1-NH1 2.71Å; D109-R210 PolarHBondContact OD1-NH1 3.25Å; D109-R210 IonicContact OD1-NH2 3.59Å; D109-R210 PolarHBondContact OD1-NH2 2.92Å; D109-R210 VanDerWaalsContact OD1-NH2 3.12Å; D109-R210 IonicContact OD2-CZ 2.66Å; D109-R210 IonicContact OD2-NH1 3.92Å; D109-R210 IonicContact OD2-NH2 2.68Å; D109-R210 PolarHBondContact OD2-NH2 3.35Å; Q206-R210 WeakPolarHBondContact O-CA 3.33Å; Q206-R210 WeakPolarHBondContact O-CB 3.45Å; Q206-R210 WeakPolarHBondContact O-CG 3.23Å; Q206-R210 PolarHBondContact O-N 2.95Å; M207-R210 PolarHBondContact O-N 3.16Å; R210-M212 PolarHBondContact O-N 3.49Å; R210-M212 VanDerWaalsContact O-N 3.09Å
211	G	35.3	Very low	38.3	Very low	66 Å²	66	82.5 Å²	82.5	68%	0.68	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	15	165.8	0	0	0	0	0	115.8	M207 R209	M207-G211 PolarHBondContact O-N 3.42Å; R209-G211 VanDerWaalsContact C-N 3.33Å
212	M	40.9	Very low	38	Very low	159 Å²	159	87.6 Å²	87.6	78%	0.783	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.1	40.4	177.2	-72.2	-165.8	70.5	0	0	113	R209 R210	R209-M212 PolarHBondContact O-N 3.25Å; R210-M212 PolarHBondContact O-N 3.49Å; R210-M212 VanDerWaalsContact O-N 3.09Å
213	K	37.9	Very low	37.8	Very low	265 Å²	265	90.8 Å²	90.8	100%	1.152	45%	0.45	S	S	*	.			trans	-149.7	0	176.6	-150.5	173.5	-172.8	178.5	0	114.7

Retrieved 213 of 213 residues in 345.6 ms (Link to these results)

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