A0A075B6Q6_HUMAN Loading...

A-kinase anchoring protein 4

AlphaFold DB , UniProt , Accession A0A075B6Q6, Species HUMAN (Homo sapiens, Human), Gene AKAP4, 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	25.5	Very low	36.6	Very low	240 Å²	240	143 Å²	143	100%	1.182	71%	0.712	S	S	*	*				0	89.8	0	-69.8	179.8	166.5	0	0	105.8
2	S	30.3	Very low	36.6	Very low	122 Å²	122	146.5 Å²	146.5	85%	0.853	71%	0.711	S	S	*	*			trans	-82.6	119.5	169.7	-83.8	0	0	0	0	106	D4	S2-D4 PolarHBondContact O-N 3.19Å; S2-D4 VanDerWaalsContact O-N 3.14Å
3	D	33	Very low	36.1	Very low	149 Å²	149	141.9 Å²	141.9	80%	0.797	73%	0.725	S	S	*	*			trans	-64.5	112.1	169	-67.5	-37.9	0	0	0	107.6	I5	D3-I5 PolarHBondContact O-N 3.48Å
4	D	39.3	Very low	36.2	Very low	165 Å²	165	139.9 Å²	139.9	88%	0.882	72%	0.722	S	S	*	*			trans	-65.9	112.6	173.9	-118.1	-16.5	0	0	0	108	S2 D6	S2-D4 PolarHBondContact O-N 3.19Å; S2-D4 VanDerWaalsContact O-N 3.14Å; D4-D6 PolarHBondContact O-N 3.08Å; D4-D6 VanDerWaalsContact O-N 3.17Å
5	I	37.9	Very low	35.9	Very low	98 Å²	98	135.5 Å²	135.5	50%	0.503	71%	0.708	S	S	.	*			trans	-78.4	104.8	-179.5	-64.5	173.2	0	0	0	107.5	D3 W7	D3-I5 PolarHBondContact O-N 3.48Å; I5-W7 HydrophobicContact CB-CZ2 4.4Å; I5-W7 HydrophobicContact CG2-CD2 3.87Å; I5-W7 HydrophobicContact CG2-CE3 4.35Å; I5-W7 HydrophobicContact CG2-CG 4.26Å; I5-W7 HydrophobicContact CG2-CH2 4.43Å; I5-W7 HydrophobicContact CG2-CZ2 3.95Å; I5-W7 PolarHBondContact O-N 3.23Å; I5-W7 PolarHBondContact O-NE1 2.97Å
6	D	44.2	Very low	36	Very low	79 Å²	79	135.6 Å²	135.6	42%	0.422	70%	0.701	S	S	.	*			trans	-72.8	90.3	171.1	-177.7	-7	0	0	0	109.6	D4 L8 R9 S10	D4-D6 PolarHBondContact O-N 3.08Å; D4-D6 VanDerWaalsContact O-N 3.17Å; D6-L8 PolarHBondContact O-N 3.11Å; D6-L8 PolarHBondContact OD1-N 3.03Å; D6-L8 VanDerWaalsContact OD1-N 3.14Å; D6-R9 CarbonylContact O-C 3.58Å; D6-R9 PolarHBondContact O-N 3.16Å; D6-R9 PolarHBondContact OD1-N 3.5Å; D6-R9 WeakPolarHBondContact OD2-CB 3.27Å; D6-R9 WeakPolarHBondContact OD2-CD 3.23Å; D6-R9 VanDerWaalsContact OD2-CG 3.23Å; D6-R9 WeakPolarHBondContact OD2-CG 3.12Å; D6-S10 WeakPolarHBondContact O-CA 3.38Å; D6-S10 VanDerWaalsContact O-CB 3.27Å; D6-S10 WeakPolarHBondContact O-CB 3.36Å; D6-S10 PolarHBondContact O-N 3.34Å
7	W	43.1	Very low	36	Very low	170 Å²	170	130.2 Å²	130.2	64%	0.644	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-23.3	-179	-61.7	93	0	0	0	113.5	I5	I5-W7 HydrophobicContact CB-CZ2 4.4Å; I5-W7 HydrophobicContact CG2-CD2 3.87Å; I5-W7 HydrophobicContact CG2-CE3 4.35Å; I5-W7 HydrophobicContact CG2-CG 4.26Å; I5-W7 HydrophobicContact CG2-CH2 4.43Å; I5-W7 HydrophobicContact CG2-CZ2 3.95Å; I5-W7 PolarHBondContact O-N 3.23Å; I5-W7 PolarHBondContact O-NE1 2.97Å
8	L	39.5	Very low	36.1	Very low	122 Å²	122	128.2 Å²	128.2	64%	0.639	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-25.5	178.7	-72.5	163.4	0	0	0	112.2	D6 V17	D6-L8 PolarHBondContact O-N 3.11Å; D6-L8 PolarHBondContact OD1-N 3.03Å; D6-L8 VanDerWaalsContact OD1-N 3.14Å; L8-V17 HydrophobicContact CD2-CB 3.92Å; L8-V17 HydrophobicContact CD2-CG1 3.91Å
9	R	37.3	Very low	36.1	Very low	213 Å²	213	129.9 Å²	129.9	80%	0.804	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	5	-176.5	-50.1	-178	96.1	-174.6	6.8	113.7	D6 H11	D6-R9 CarbonylContact O-C 3.58Å; D6-R9 PolarHBondContact O-N 3.16Å; D6-R9 PolarHBondContact OD1-N 3.5Å; D6-R9 WeakPolarHBondContact OD2-CB 3.27Å; D6-R9 WeakPolarHBondContact OD2-CD 3.23Å; D6-R9 VanDerWaalsContact OD2-CG 3.23Å; D6-R9 WeakPolarHBondContact OD2-CG 3.12Å; R9-H11 PolarHBondContact O-N 3.38Å
10	S	37.7	Very low	36.2	Very low	46 Å²	46	130.8 Å²	130.8	32%	0.322	67%	0.67	S	S	.	*			trans	-65	116.1	179.3	-175.8	0	0	0	0	110.9	D6 R12	D6-S10 WeakPolarHBondContact O-CA 3.38Å; D6-S10 VanDerWaalsContact O-CB 3.27Å; D6-S10 WeakPolarHBondContact O-CB 3.36Å; D6-S10 PolarHBondContact O-N 3.34Å; S10-R12 PolarHBondContact O-N 3.03Å
11	H	34.8	Very low	36.4	Very low	169 Å²	169	129.3 Å²	129.3	78%	0.782	66%	0.663	S	S	*	*	S	Bend	trans	-70.6	-6.3	176.8	64.5	-85.7	0	0	0	113.5	R9 G13	R9-H11 PolarHBondContact O-N 3.38Å; H11-G13 PolarHBondContact O-N 2.93Å
12	R	36.3	Very low	36.9	Very low	185 Å²	185	122.5 Å²	122.5	70%	0.698	64%	0.637	S	S	*	*	S	Bend	trans	-81	97.6	171.6	-62.1	-178.1	-172.5	-115.5	2.3	105.7	S10 V14	S10-R12 PolarHBondContact O-N 3.03Å; R12-V14 HydrophobicContact CB-CG2 4.28Å; R12-V14 VanDerWaalsContact O-CG2 3.3Å; R12-V14 WeakPolarHBondContact O-CG2 3.37Å; R12-V14 PolarHBondContact O-N 3.35Å
13	G	30.6	Very low	37.4	Very low	87 Å²	87	125.2 Å²	125.2	90%	0.897	64%	0.636	S	S	*	*			trans	-66.9	65.7	-169.1	0	0	0	0	0	115.1	H11	H11-G13 PolarHBondContact O-N 2.93Å
14	V	37.1	Very low	37.8	Very low	113 Å²	113	120.1 Å²	120.1	69%	0.685	62%	0.619	S	S	*	*	S	Bend	trans	-97.7	-31.5	-177.9	-147.5	0	0	0	0	112.1	R12	R12-V14 HydrophobicContact CB-CG2 4.28Å; R12-V14 VanDerWaalsContact O-CG2 3.3Å; R12-V14 WeakPolarHBondContact O-CG2 3.37Å; R12-V14 PolarHBondContact O-N 3.35Å
15	C	32.5	Very low	37.8	Very low	75 Å²	75	121.6 Å²	121.6	51%	0.507	62%	0.621	S	S	.	*			trans	-151.8	135	174.6	-58.7	0	0	0	0	111.2
16	K	36.4	Very low	38.2	Very low	137 Å²	137	124.8 Å²	124.8	60%	0.596	63%	0.634	S	S	*	*			trans	-95.8	120.3	168.1	-171.5	-174.6	175.1	-154.5	0	108.3	D18	K16-D18 WeakPolarHBondContact CE-OD1 3.19Å; K16-D18 IonicContact NZ-OD1 2.8Å; K16-D18 IonicContact NZ-OD2 3.63Å
17	V	36.2	Very low	38	Very low	44 Å²	44	127.2 Å²	127.2	27%	0.267	65%	0.647	S	S	.	*			trans	-104.8	114.6	-178.7	-178.4	0	0	0	0	108.1	L8 I71	L8-V17 HydrophobicContact CD2-CB 3.92Å; L8-V17 HydrophobicContact CD2-CG1 3.91Å; V17-I71 HydrophobicContact CG1-CG2 4.27Å
18	D	37.5	Very low	37.8	Very low	94 Å²	94	126.5 Å²	126.5	50%	0.503	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-102.4	135.6	177.1	-69.7	-40.8	0	0	0	109.7	K16	K16-D18 WeakPolarHBondContact CE-OD1 3.19Å; K16-D18 IonicContact NZ-OD1 2.8Å; K16-D18 IonicContact NZ-OD2 3.63Å
19	L	36	Very low	37.7	Very low	161 Å²	161	128.7 Å²	128.7	84%	0.843	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-76.1	128.6	178.2	-137	85.2	0	0	0	109.9
20	Y	39.2	Very low	37.7	Very low	146 Å²	146	124.6 Å²	124.6	57%	0.573	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-81.6	128.4	176.8	176.5	-102.3	0	0	0	111	P22 R30	Y20-P22 HydrophobicContact CE1-CB 4.09Å; Y20-R30 PolarHBondContact OH-NH1 3.2Å
21	N	39.4	Very low	37.3	Very low	100 Å²	100	132.3 Å²	132.3	54%	0.535	68%	0.675	S	S	.	*			trans	-106.2	115.3	175	-173.1	-6.5	0	0	0	110.5	E23	N21-E23 VanDerWaalsContact C-N 3.26Å; N21-E23 PolarHBondContact O-N 3.2Å; N21-E23 PolarHBondContact OD1-N 3.23Å; N21-E23 VanDerWaalsContact OD1-N 3.11Å
22	P	36.7	Very low	37.2	Very low	97 Å²	97	129.1 Å²	129.1	63%	0.63	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-15.3	-178.2	28.1	-34.4	0	0	0	114.4	Y20 G24	Y20-P22 HydrophobicContact CE1-CB 4.09Å; P22-G24 VanDerWaalsContact C-N 3.33Å
23	E	40.3	Very low	36.9	Very low	179 Å²	179	125.1 Å²	125.1	84%	0.836	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-0.2	-177.3	-61	-176.1	167.8	0	0	113.6	N21	N21-E23 VanDerWaalsContact C-N 3.26Å; N21-E23 PolarHBondContact O-N 3.2Å; N21-E23 PolarHBondContact OD1-N 3.23Å; N21-E23 VanDerWaalsContact OD1-N 3.11Å
24	G	42.1	Very low	36.9	Very low	42 Å²	42	124 Å²	124	43%	0.433	64%	0.636	S	S	.	*	S	Bend	trans	-79.7	131.3	177.9	0	0	0	0	0	113.2	P22	P22-G24 VanDerWaalsContact C-N 3.33Å
25	Q	39.4	Very low	36.5	Very low	197 Å²	197	123.8 Å²	123.8	92%	0.921	63%	0.626	S	S	*	*			trans	-41.9	134.2	-174.6	-107.1	-173.8	-41.6	0	0	114.9
26	Q	47	Very low	36.7	Very low	165 Å²	165	125 Å²	125	77%	0.771	63%	0.631	S	S	*	*			trans	-59.9	120.7	-178.4	-162.6	173.2	37.4	0	0	111.7
27	D	38.8	Very low	36.4	Very low	130 Å²	130	124.4 Å²	124.4	70%	0.695	64%	0.635	S	S	*	*			trans	-125.3	137.6	168.1	-158.3	2.2	0	0	0	108.7	D29 R30	D27-D29 PolarHBondContact O-N 3.14Å; D27-R30 WeakPolarHBondContact O-CG 3.27Å; D27-R30 PolarHBondContact O-NE 2.8Å
28	Q	39.1	Very low	36.2	Very low	154 Å²	154	127.5 Å²	127.5	72%	0.72	65%	0.653	S	S	*	*	S	Bend	trans	-93.3	14.5	-147.1	-85.6	-95.8	-10	0	0	116.4
29	D	38.1	Very low	35.9	Very low	168 Å²	168	126.2 Å²	126.2	90%	0.898	65%	0.651	S	S	*	*			trans	-120	46.6	177.1	-88	-25.4	0	0	0	113.6	D27 K31	D27-D29 PolarHBondContact O-N 3.14Å; D29-K31 PolarHBondContact O-N 3.18Å; D29-K31 VanDerWaalsContact O-N 3.16Å
30	R	35.8	Very low	35.9	Very low	128 Å²	128	122.1 Å²	122.1	48%	0.483	63%	0.634	S	S	.	*			trans	-83	94.3	-176.5	-60	-179.8	-180	-160.2	-3.9	111.2	Y20 D27 V32	Y20-R30 PolarHBondContact OH-NH1 3.2Å; D27-R30 WeakPolarHBondContact O-CG 3.27Å; D27-R30 PolarHBondContact O-NE 2.8Å; R30-V32 VanDerWaalsContact C-N 3.28Å; R30-V32 HydrophobicContact CB-CG2 3.94Å; R30-V32 PolarHBondContact O-N 3.22Å
31	K	30.7	Very low	35.7	Very low	207 Å²	207	121.5 Å²	121.5	90%	0.9	64%	0.639	S	S	*	*			trans	-72.1	92.6	153.2	-77.3	-173.3	-177.9	179.7	0	108.1	D29	D29-K31 PolarHBondContact O-N 3.18Å; D29-K31 VanDerWaalsContact O-N 3.16Å
32	V	31.5	Very low	35.8	Very low	102 Å²	102	123.1 Å²	123.1	62%	0.618	65%	0.648	S	S	*	*			trans	-77.4	118.5	173.4	-176.7	0	0	0	0	107.8	R30 C34	R30-V32 VanDerWaalsContact C-N 3.28Å; R30-V32 HydrophobicContact CB-CG2 3.94Å; R30-V32 PolarHBondContact O-N 3.22Å; V32-C34 WeakPolarHBondContact CG1-SG 3.48Å
33	I	30.1	Very low	35.8	Very low	101 Å²	101	124.7 Å²	124.7	52%	0.518	66%	0.655	S	S	.	*			trans	-114.3	110.7	163.1	-59.1	-179.2	0	0	0	106.2	F35 V88	I33-F35 HydrophobicContact CG2-CD2 4.04Å; I33-F35 HydrophobicContact CG2-CE2 3.27Å; I33-F35 HydrophobicContact CG2-CZ 3.91Å; I33-V88 HydrophobicContact CD1-CG2 4.16Å; I33-V88 HydrophobicContact CG2-CG2 4.33Å
34	C	30.5	Very low	35.8	Very low	63 Å²	63	124.1 Å²	124.1	43%	0.426	65%	0.653	S	S	.	*			trans	-99.1	137.5	179.9	-70.7	0	0	0	0	110.2	V32 I70	V32-C34 WeakPolarHBondContact CG1-SG 3.48Å; C34-I70 HydrophobicContact CB-CD1 3.87Å; C34-I70 VanDerWaalsContact SG-CD1 3.55Å
35	F	30.2	Very low	35.7	Very low	109 Å²	109	128.6 Å²	128.6	48%	0.478	67%	0.667	S	S	.	*			trans	-133.4	130.6	159.2	-65.5	-78.6	0	0	0	109.4	I33 V88 L90	I33-F35 HydrophobicContact CG2-CD2 4.04Å; I33-F35 HydrophobicContact CG2-CE2 3.27Å; I33-F35 HydrophobicContact CG2-CZ 3.91Å; F35-V88 HydrophobicContact CD2-CG1 4Å; F35-V88 HydrophobicContact CE2-CG1 3.34Å; F35-V88 HydrophobicContact CZ-CG1 4.09Å; F35-L90 HydrophobicContact CB-CD2 4.02Å; F35-L90 HydrophobicContact CD1-CD2 3.36Å; F35-L90 HydrophobicContact CD2-CD2 3.48Å; F35-L90 VanDerWaalsContact CD2-CD2 3.48Å; F35-L90 HydrophobicContact CE1-CD2 3.59Å; F35-L90 HydrophobicContact CE2-CD2 3.68Å; F35-L90 HydrophobicContact CG-CD2 3.3Å; F35-L90 HydrophobicContact CZ-CD2 3.75Å
36	V	35	Very low	35.9	Very low	102 Å²	102	128.3 Å²	128.3	62%	0.618	66%	0.663	S	S	*	*			trans	-109	130.7	-172.8	176.8	0	0	0	0	108	I70	V36-I70 HydrophobicContact CG2-CD1 4.21Å; V36-I70 HydrophobicContact CG2-CG1 4.13Å
37	D	30.9	Very low	35.8	Very low	124 Å²	124	127 Å²	127	66%	0.663	66%	0.661	S	S	*	*			trans	-90.2	133.9	170	-172.7	4.7	0	0	0	109.4	S39	D37-S39 VanDerWaalsContact OD1-CB 3.27Å; D37-S39 WeakPolarHBondContact OD1-CB 3.3Å; D37-S39 PolarHBondContact OD1-N 3.26Å; D37-S39 VanDerWaalsContact OD1-N 3.11Å; D37-S39 PolarHBondContact OD1-OG 2.85Å; D37-S39 PolarHBondContact OD2-OG 3.23Å
38	V	32.5	Very low	35.7	Very low	109 Å²	109	132 Å²	132	66%	0.661	67%	0.671	S	S	*	*			trans	-119.9	12	-175.6	-119.1	0	0	0	0	112	T40 L41	V38-T40 VanDerWaalsContact C-N 3.26Å; V38-T40 PolarHBondContact O-N 3.17Å; V38-L41 HydrophobicContact CG1-CD1 4.39Å
39	S	30.9	Very low	35.9	Very low	66 Å²	66	132.8 Å²	132.8	46%	0.462	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.3	-5.7	-171.5	53.1	0	0	0	0	115.7	D37	D37-S39 VanDerWaalsContact OD1-CB 3.27Å; D37-S39 WeakPolarHBondContact OD1-CB 3.3Å; D37-S39 PolarHBondContact OD1-N 3.26Å; D37-S39 VanDerWaalsContact OD1-N 3.11Å; D37-S39 PolarHBondContact OD1-OG 2.85Å; D37-S39 PolarHBondContact OD2-OG 3.23Å
40	T	35	Very low	35.9	Very low	76 Å²	76	130.9 Å²	130.9	47%	0.466	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.1	5.1	-173	51	0	0	0	0	116.7	V38 N42 L62	V38-T40 VanDerWaalsContact C-N 3.26Å; V38-T40 PolarHBondContact O-N 3.17Å; T40-N42 PolarHBondContact O-N 2.72Å; T40-L62 HydrophobicContact CG2-CD2 4.31Å
41	L	35.2	Very low	35.9	Very low	133 Å²	133	129.6 Å²	129.6	70%	0.696	68%	0.679	S	S	*	*			trans	-75.9	66.9	173	-79.1	165.8	0	0	0	111.1	V38 V43	V38-L41 HydrophobicContact CG1-CD1 4.39Å; L41-V43 PolarHBondContact O-N 3.02Å
42	N	41.7	Very low	36.3	Very low	134 Å²	134	124.4 Å²	124.4	72%	0.717	68%	0.675	S	S	*	*			trans	-86.8	101.3	165.4	-142.1	57.2	0	0	0	107.4	T40 E44	T40-N42 PolarHBondContact O-N 2.72Å; N42-E44 PolarHBondContact O-N 3.44Å; N42-E44 VanDerWaalsContact O-N 3.1Å
43	V	38.2	Very low	36.4	Very low	129 Å²	129	125 Å²	125	78%	0.782	68%	0.684	S	S	*	*			trans	-73.4	98.6	173.1	-177.9	0	0	0	0	107.7	L41	L41-V43 PolarHBondContact O-N 3.02Å
44	E	38.9	Very low	36.7	Very low	168 Å²	168	125.2 Å²	125.2	79%	0.785	69%	0.694	S	S	*	*			trans	-119.1	96.9	160.7	-75.1	-167.7	151.9	0	0	109.2	N42 K46	N42-E44 PolarHBondContact O-N 3.44Å; N42-E44 VanDerWaalsContact O-N 3.1Å; E44-K46 PolarHBondContact O-N 2.88Å
45	D	41.5	Very low	37.3	Very low	135 Å²	135	127.3 Å²	127.3	72%	0.722	71%	0.71	S	S	*	*			trans	-79.9	109.4	171.7	-166.1	13.8	0	0	0	108.5
46	K	42.4	Very low	37.8	Very low	192 Å²	192	127.3 Å²	127.3	84%	0.835	72%	0.723	S	S	*	*			trans	-143.4	102	161.9	-75.8	-155.9	175.5	176.8	0	111.7	E44	E44-K46 PolarHBondContact O-N 2.88Å
47	D	45.5	Very low	37.4	Very low	137 Å²	137	131.1 Å²	131.1	73%	0.733	73%	0.734	S	S	*	*			trans	-38	126.8	161.9	-67.8	-60.5	0	0	0	113.7
48	Y	36.7	Very low	37.6	Very low	234 Å²	234	129.3 Å²	129.3	92%	0.918	74%	0.744	S	S	*	*			trans	-149.1	131.8	138.3	-83.9	-67.7	0	0	0	112.3
49	K	42.8	Very low	37.5	Very low	172 Å²	172	130.1 Å²	130.1	75%	0.748	75%	0.745	S	S	*	*			trans	-72.2	149.9	-178.7	-98.1	179.9	145.1	-95.4	0	114.4
50	D	38.5	Very low	37.6	Very low	127 Å²	127	135.1 Å²	135.1	68%	0.679	77%	0.766	S	S	*	*			trans	59.5	113.8	143	-56.2	-31.4	0	0	0	119.9
51	A	35.2	Very low	37.5	Very low	101 Å²	101	137.7 Å²	137.7	84%	0.835	78%	0.776	S	S	*	*				154	131.9	111.3	0	0	0	0	0	114.1
52	A	38.6	Very low	37.6	Very low	98 Å²	98	136.8 Å²	136.8	81%	0.81	77%	0.772	S	S	*	*			trans	2.8	125.6	160.6	0	0	0	0	0	121.7
53	S	34.2	Very low	37.1	Very low	116 Å²	116	133.8 Å²	133.8	81%	0.811	77%	0.772	S	S	*	*			trans	85.7	100.9	133.5	-149.7	0	0	0	0	120.2
54	S	37.5	Very low	37	Very low	104 Å²	104	132 Å²	132	73%	0.727	77%	0.766	S	S	*	*				85.2	115.5	127.3	-146.2	0	0	0	0	121.7
55	S	41.9	Very low	36.9	Very low	108 Å²	108	129.1 Å²	129.1	76%	0.755	76%	0.755	S	S	*	*			trans	87.4	127.6	137.2	75.4	0	0	0	0	120.3
56	S	40.3	Very low	36.5	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	76%	0.758	S	S	*	*			trans	80.5	141.8	160.1	-155.1	0	0	0	0	116.6
57	E	27.5	Very low	36.1	Very low	182 Å²	182	128.3 Å²	128.3	85%	0.85	75%	0.75	S	S	*	*	S	Bend	trans	88	131.6	169.8	-53.2	-175.4	158.1	0	0	116.3	N59	E57-N59 PolarHBondContact O-N 2.92Å
58	G	34.7	Very low	35.7	Very low	85 Å²	85	129.8 Å²	129.8	88%	0.876	75%	0.75	S	S	*	*			trans	-68.5	126.1	-158.3	0	0	0	0	0	113.1
59	N	31	Very low	35.4	Very low	127 Å²	127	126.7 Å²	126.7	68%	0.679	74%	0.744	S	S	*	*			trans	-147.6	91.6	161.5	-162.6	-10	0	0	0	106.9	E57 N61	E57-N59 PolarHBondContact O-N 2.92Å; N59-N61 PolarHBondContact O-N 3.14Å
60	L	31.8	Very low	35.2	Very low	170 Å²	170	121.5 Å²	121.5	89%	0.89	72%	0.724	S	S	*	*			trans	-70.9	85.8	168	-63.8	177.9	0	0	0	106.3	L62	L60-L62 VanDerWaalsContact C-N 3.33Å; L60-L62 PolarHBondContact O-N 3.28Å
61	N	33	Very low	35	Very low	130 Å²	130	121.9 Å²	121.9	70%	0.695	72%	0.724	S	S	*	*			trans	-62.6	97	171.2	-117.8	-58.9	0	0	0	107.8	N59 G63	N59-N61 PolarHBondContact O-N 3.14Å; N61-G63 PolarHBondContact O-N 3.47Å; N61-G63 VanDerWaalsContact O-N 3.14Å
62	L	37.9	Very low	35.1	Very low	114 Å²	114	120.7 Å²	120.7	60%	0.597	71%	0.707	S	S	*	*			trans	-77.7	20.3	178.2	-158.9	68	0	0	0	112.1	T40 L60 S64	T40-L62 HydrophobicContact CG2-CD2 4.31Å; L60-L62 VanDerWaalsContact C-N 3.33Å; L60-L62 PolarHBondContact O-N 3.28Å; L62-S64 VanDerWaalsContact C-N 3.28Å; L62-S64 PolarHBondContact O-N 3.47Å
63	G	31.3	Very low	35	Very low	71 Å²	71	120 Å²	120	73%	0.732	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	2.2	-170.1	0	0	0	0	0	115.7	N61	N61-G63 PolarHBondContact O-N 3.47Å; N61-G63 VanDerWaalsContact O-N 3.14Å
64	S	36.1	Very low	35.2	Very low	91 Å²	91	122.2 Å²	122.2	64%	0.636	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.4	37.3	-174.6	75	0	0	0	0	114	L62 E66	L62-S64 VanDerWaalsContact C-N 3.28Å; L62-S64 PolarHBondContact O-N 3.47Å; S64-E66 PolarHBondContact O-N 3.2Å
65	L	37.1	Very low	35.1	Very low	108 Å²	108	121.7 Å²	121.7	57%	0.565	67%	0.672	S	S	*	*			trans	-76	59.6	169.2	-158.1	72.5	0	0	0	109.8	E67	L65-E67 PolarHBondContact O-N 2.99Å
66	E	33.5	Very low	34.9	Very low	168 Å²	168	121.1 Å²	121.1	79%	0.785	67%	0.665	S	S	*	*			trans	-74.2	101.3	167.6	-65	-176.9	-156.8	0	0	107	S64	S64-E66 PolarHBondContact O-N 3.2Å
67	E	33.8	Very low	34.7	Very low	142 Å²	142	123.3 Å²	123.3	66%	0.664	66%	0.663	S	S	*	*	S	Bend	trans	70.9	113	160.3	-50.6	-175.2	164.5	0	0	117.3	L65	L65-E67 PolarHBondContact O-N 2.99Å
68	K	36	Very low	35.3	Very low	168 Å²	168	122.5 Å²	122.5	73%	0.73	66%	0.656	S	S	*	*			trans	91.8	72.3	142.2	-52.3	139.6	175.3	157.9	0	118.4
69	E	31.6	Very low	35.7	Very low	169 Å²	169	128.2 Å²	128.2	79%	0.79	66%	0.657	S	S	*	*			trans	-125.2	128.9	149	-79.8	-168.4	139.7	0	0	112.4
70	I	36.7	Very low	36.3	Very low	64 Å²	64	128.7 Å²	128.7	33%	0.328	66%	0.66	S	S	.	*			trans	-122.8	128.4	-177.8	-61.9	173.3	0	0	0	106.7	C34 V36 V72	C34-I70 HydrophobicContact CB-CD1 3.87Å; C34-I70 VanDerWaalsContact SG-CD1 3.55Å; V36-I70 HydrophobicContact CG2-CD1 4.21Å; V36-I70 HydrophobicContact CG2-CG1 4.13Å; I70-V72 HydrophobicContact CG2-CG2 4.19Å
71	I	35.7	Very low	36.9	Very low	135 Å²	135	130.2 Å²	130.2	69%	0.692	66%	0.662	S	S	*	*			trans	-104.5	124.6	176.7	-54.9	176.7	0	0	0	109.2	V17	V17-I71 HydrophobicContact CG1-CG2 4.27Å
72	V	35.9	Very low	37.3	Very low	76 Å²	76	128.8 Å²	128.8	46%	0.461	66%	0.662	S	S	.	*			trans	-111.5	120.6	-178.7	-179.7	0	0	0	0	109	I70 K74	I70-V72 HydrophobicContact CG2-CG2 4.19Å; V72-K74 HydrophobicContact CG1-CG 4.33Å
73	I	37.1	Very low	37.4	Very low	84 Å²	84	132.6 Å²	132.6	43%	0.431	67%	0.674	S	S	.	*			trans	-97.5	121.3	173.6	-55.7	176.6	0	0	0	108.2
74	K	37.9	Very low	37.7	Very low	162 Å²	162	136.2 Å²	136.2	70%	0.704	68%	0.682	S	S	*	*			trans	-105.2	136.8	174.2	-70.8	-177.7	178.6	179.2	0	109.6	V72 T76	V72-K74 HydrophobicContact CG1-CG 4.33Å; K74-T76 PolarHBondContact O-N 3.14Å
75	D	36.3	Very low	37.7	Very low	93 Å²	93	141.1 Å²	141.1	50%	0.497	70%	0.695	S	S	.	*			trans	-67.6	128.8	165.3	-174.8	7	0	0	0	109.4	E77	D75-E77 WeakPolarHBondContact OD1-CG 3.42Å; D75-E77 PolarHBondContact OD1-N 3.31Å
76	T	37.3	Very low	37.7	Very low	96 Å²	96	139.2 Å²	139.2	59%	0.589	70%	0.701	S	S	*	*			trans	-110.1	2.6	-178.2	53.5	0	0	0	0	112.6	K74 K78	K74-T76 PolarHBondContact O-N 3.14Å; T76-K78 PolarHBondContact O-N 3.02Å
77	E	37.6	Very low	37.7	Very low	154 Å²	154	135.1 Å²	135.1	72%	0.72	69%	0.692	S	S	*	*	S	Bend	trans	-85.4	-1.4	-167.8	79.3	-160.3	178.2	0	0	115.1	D75	D75-E77 WeakPolarHBondContact OD1-CG 3.42Å; D75-E77 PolarHBondContact OD1-N 3.31Å
78	K	39.5	Very low	37.8	Very low	166 Å²	166	131.9 Å²	131.9	72%	0.722	68%	0.681	S	S	*	*			trans	-123.8	107.4	176	-57.1	-157.3	-178.9	179.8	0	113	T76 D80	T76-K78 PolarHBondContact O-N 3.02Å; K78-D80 PolarHBondContact O-N 2.8Å; K78-D80 VanDerWaalsContact O-N 3.08Å
79	K	43.5	Very low	37.8	Very low	204 Å²	204	128.3 Å²	128.3	89%	0.887	68%	0.676	S	S	*	*			trans	-78.1	31.7	175	-159.3	-174.2	177.2	-179.3	0	112.6
80	D	42.5	Very low	38.1	Very low	138 Å²	138	123.3 Å²	123.3	74%	0.738	66%	0.655	S	S	*	*			trans	-121.3	101.7	175.2	-77.9	-43.9	0	0	0	108.6	K78 S82	K78-D80 PolarHBondContact O-N 2.8Å; K78-D80 VanDerWaalsContact O-N 3.08Å; D80-S82 PolarHBondContact O-N 3.22Å
81	Q	43.9	Very low	38.1	Very low	202 Å²	202	129.2 Å²	129.2	94%	0.944	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	20.6	-167.8	-64.9	179.5	1.4	0	0	114.9
82	S	42.6	Very low	38.2	Very low	100 Å²	100	128.6 Å²	128.6	70%	0.699	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	7.9	-165.1	67.4	0	0	0	0	117.6	D80	D80-S82 PolarHBondContact O-N 3.22Å
83	K	40.4	Very low	38.2	Very low	194 Å²	194	132.7 Å²	132.7	84%	0.843	69%	0.685	S	S	*	*			trans	-164.3	91	163.9	-98.7	142.2	-170.3	-165.6	0	110	E85	K83-E85 VanDerWaalsContact C-N 3.28Å; K83-E85 PolarHBondContact O-N 2.67Å
84	T	37.2	Very low	38.4	Very low	147 Å²	147	131 Å²	131	90%	0.902	68%	0.683	S	S	*	*			trans	-69.4	84.8	169	39.9	0	0	0	0	109.8	G86	T84-G86 PolarHBondContact O-N 3.11Å
85	E	35.7	Very low	38.7	Very low	193 Å²	193	125.8 Å²	125.8	90%	0.902	67%	0.666	S	S	*	*			trans	-82	94.6	160.6	-169.6	169.5	-174.5	0	0	106.8	K83	K83-E85 VanDerWaalsContact C-N 3.28Å; K83-E85 PolarHBondContact O-N 2.67Å
86	G	36.5	Very low	39.1	Very low	68 Å²	68	127.7 Å²	127.7	70%	0.701	69%	0.687	S	S	*	*			trans	-78.1	124.2	-171.8	0	0	0	0	0	112.1	T84	T84-G86 PolarHBondContact O-N 3.11Å
87	S	34.9	Very low	39.4	Very low	83 Å²	83	126.5 Å²	126.5	58%	0.58	68%	0.677	S	S	*	*			trans	-81.6	128.3	160.7	46.3	0	0	0	0	109.3
88	V	35.7	Very low	39.8	Very low	73 Å²	73	122.6 Å²	122.6	44%	0.442	67%	0.665	S	S	.	*			trans	-108.4	120.5	176.4	172.2	0	0	0	0	106.9	I33 F35 L90	I33-V88 HydrophobicContact CD1-CG2 4.16Å; I33-V88 HydrophobicContact CG2-CG2 4.33Å; F35-V88 HydrophobicContact CD2-CG1 4Å; F35-V88 HydrophobicContact CE2-CG1 3.34Å; F35-V88 HydrophobicContact CZ-CG1 4.09Å; V88-L90 HydrophobicContact CG1-CD2 4.22Å; V88-L90 HydrophobicContact CG1-CG 4.18Å
89	C	35.2	Very low	40.4	Very low	93 Å²	93	119 Å²	119	63%	0.628	66%	0.656	S	S	*	*			trans	-103.3	123.3	172.6	-63.1	0	0	0	0	109.6	F91	C89-F91 HydrophobicContact CB-CE2 4.16Å
90	L	37.6	Very low	40.8	Very low	65 Å²	65	111.6 Å²	111.6	34%	0.34	63%	0.631	S	S	.	*			trans	-105.3	119.8	177.9	-64.7	169.1	0	0	0	108.7	F35 V88 Y112	F35-L90 HydrophobicContact CB-CD2 4.02Å; F35-L90 HydrophobicContact CD1-CD2 3.36Å; F35-L90 HydrophobicContact CD2-CD2 3.48Å; F35-L90 VanDerWaalsContact CD2-CD2 3.48Å; F35-L90 HydrophobicContact CE1-CD2 3.59Å; F35-L90 HydrophobicContact CE2-CD2 3.68Å; F35-L90 HydrophobicContact CG-CD2 3.3Å; F35-L90 HydrophobicContact CZ-CD2 3.75Å; V88-L90 HydrophobicContact CG1-CD2 4.22Å; V88-L90 HydrophobicContact CG1-CG 4.18Å; L90-Y112 HydrophobicContact CD1-CE1 4.21Å; L90-Y112 HydrophobicContact CD1-CE2 4.41Å; L90-Y112 WeakPolarHBondContact CD1-OH 3.46Å
91	F	36.9	Very low	41.1	Very low	187 Å²	187	106.1 Å²	106.1	82%	0.82	60%	0.602	S	S	*	*			trans	-106.4	120.5	167.5	-66.9	-81.6	0	0	0	107.9	C89	C89-F91 HydrophobicContact CB-CE2 4.16Å
92	K	38.7	Very low	41.6	Very low	122 Å²	122	99.1 Å²	99.1	53%	0.53	57%	0.571	S	S	.	*			trans	-128.1	136.5	173.3	175.4	152.9	150.1	-166.3	0	107.1	A94 W104	K92-A94 PolarHBondContact O-N 2.81Å; K92-A94 VanDerWaalsContact O-N 3.12Å; K92-W104 HydrophobicContact CB-CH2 3.41Å; K92-W104 VanDerWaalsContact CB-CH2 3.41Å; K92-W104 HydrophobicContact CB-CZ2 3.55Å; K92-W104 HydrophobicContact CB-CZ3 4.2Å; K92-W104 HydrophobicContact CD-CH2 4.07Å; K92-W104 HydrophobicContact CD-CZ2 3.27Å; K92-W104 HydrophobicContact CG-CH2 3.87Å; K92-W104 HydrophobicContact CG-CZ2 3.56Å
93	Q	35.8	Very low	42.3	Very low	162 Å²	162	98.9 Å²	98.9	76%	0.757	56%	0.562	S	S	*	*			trans	-62.5	120.2	-179.6	-168.4	170.9	17.7	0	0	109.1
94	A	41.1	Very low	43.3	Very low	49 Å²	49	92.1 Å²	92.1	41%	0.405	53%	0.531	S	S	.	.			trans	-69.1	134.7	178.1	0	0	0	0	0	108.8	K92 S96 V101	K92-A94 PolarHBondContact O-N 2.81Å; K92-A94 VanDerWaalsContact O-N 3.12Å; A94-S96 PolarHBondContact O-N 3.47Å; A94-V101 HydrophobicContact CB-CB 4.23Å; A94-V101 HydrophobicContact CB-CG1 3.67Å; A94-V101 HydrophobicContact CB-CG2 3.57Å
95	P	44.3	Very low	44.2	Very low	53 Å²	53	88.6 Å²	88.6	34%	0.344	51%	0.506	S	S	.	.			trans	-44.6	141	166.3	-29.3	34	0	0	0	111	D97 S100 V101	P95-D97 PolarHBondContact O-N 3.36Å; P95-D97 VanDerWaalsContact O-N 3.1Å; P95-S100 VanDerWaalsContact CB-CB 3.41Å; P95-V101 HydrophobicContact CB-CG2 4.27Å; P95-V101 WeakPolarHBondContact O-CG2 3.27Å
96	S	44.1	Very low	45.2	Very low	133 Å²	133	81.3 Å²	81.3	93%	0.93	47%	0.473	S	S	*	.	S	Bend	trans	-63.6	-19.1	177.6	57.4	0	0	0	0	112.7	A94 P98	A94-S96 PolarHBondContact O-N 3.47Å; S96-P98 WeakPolarHBondContact O-CD 3.32Å
97	D	44.2	Very low	46.5	Very low	70 Å²	70	80.2 Å²	80.2	37%	0.374	46%	0.455	S	S	.	.	S	Bend	trans	-82.8	114.6	172.5	170.8	50.2	0	0	0	111.2	P95 V99 S100 V101	P95-D97 PolarHBondContact O-N 3.36Å; P95-D97 VanDerWaalsContact O-N 3.1Å; D97-V99 PolarHBondContact O-N 2.93Å; D97-V99 VanDerWaalsContact O-N 3.11Å; D97-S100 WeakPolarHBondContact O-CB 2.84Å; D97-S100 PolarHBondContact O-N 3.32Å; D97-S100 VanDerWaalsContact OD2-CB 3.31Å; D97-S100 WeakPolarHBondContact OD2-CB 2.94Å; D97-S100 PolarHBondContact OD2-N 2.86Å; D97-S100 PolarHBondContact OD2-OG 3.18Å; D97-V101 WeakPolarHBondContact O-CG2 3.43Å; D97-V101 PolarHBondContact O-N 3.31Å; D97-V101 VanDerWaalsContact O-N 3.07Å
98	P	46.2	Very low	47.9	Very low	72 Å²	72	77.1 Å²	77.1	47%	0.468	43%	0.431	S	S	.	.	H	α-helix	trans	-55.8	-30.2	-177.4	-26.2	34.8	0	0	0	114.6	S96 L102	S96-P98 WeakPolarHBondContact O-CD 3.32Å; P98-L102 PolarHBondContact O-N 3.08Å; P98-L102 VanDerWaalsContact O-N 3.12Å
99	V	51.2	Low	49.4	Very low	90 Å²	90	76.6 Å²	76.6	55%	0.545	43%	0.426	S	S	.	.	H	α-helix	trans	-71.6	-40	178.4	-179.5	0	0	0	0	110.6	D97 L102 N103	D97-V99 PolarHBondContact O-N 2.93Å; D97-V99 VanDerWaalsContact O-N 3.11Å; V99-L102 PolarHBondContact O-N 3.44Å; V99-N103 PolarHBondContact O-N 3.26Å; V99-N103 PolarHBondContact O-ND2 3.43Å
100	S	51.3	Low	50.4	Low	50 Å²	50	76.8 Å²	76.8	35%	0.35	42%	0.418	S	S	.	.	H	α-helix	trans	-66.7	-35.9	174.7	-62.1	0	0	0	0	112.4	P95 D97 W104	P95-S100 VanDerWaalsContact CB-CB 3.41Å; D97-S100 WeakPolarHBondContact O-CB 2.84Å; D97-S100 PolarHBondContact O-N 3.32Å; D97-S100 VanDerWaalsContact OD2-CB 3.31Å; D97-S100 WeakPolarHBondContact OD2-CB 2.94Å; D97-S100 PolarHBondContact OD2-N 2.86Å; D97-S100 PolarHBondContact OD2-OG 3.18Å; S100-W104 VanDerWaalsContact O-CB 3.26Å; S100-W104 WeakPolarHBondContact O-CB 3.29Å; S100-W104 PolarHBondContact O-N 2.89Å
101	V	50.1	Low	51.6	Low	23 Å²	23	79.3 Å²	79.3	14%	0.139	43%	0.426	C	S	.	.	H	α-helix	trans	-60.2	-47.6	170.7	-175.6	0	0	0	0	111.4	A94 P95 D97 W104 L105	A94-V101 HydrophobicContact CB-CB 4.23Å; A94-V101 HydrophobicContact CB-CG1 3.67Å; A94-V101 HydrophobicContact CB-CG2 3.57Å; P95-V101 HydrophobicContact CB-CG2 4.27Å; P95-V101 WeakPolarHBondContact O-CG2 3.27Å; D97-V101 WeakPolarHBondContact O-CG2 3.43Å; D97-V101 PolarHBondContact O-N 3.31Å; D97-V101 VanDerWaalsContact O-N 3.07Å; V101-W104 PolarHBondContact O-N 3.48Å; V101-L105 HydrophobicContact CG1-CD1 3.92Å; V101-L105 HydrophobicContact CG1-CG 4.36Å; V101-L105 WeakPolarHBondContact O-CG 3.49Å; V101-L105 PolarHBondContact O-N 3.1Å
102	L	54.5	Low	52.6	Low	54 Å²	54	75.2 Å²	75.2	28%	0.283	41%	0.406	S	S	.	.	H	α-helix	trans	-63.3	-46.4	-178.4	-178.5	66.7	0	0	0	111.5	P98 V99 W104 L105 L106 I156 L168	P98-L102 PolarHBondContact O-N 3.08Å; P98-L102 VanDerWaalsContact O-N 3.12Å; V99-L102 PolarHBondContact O-N 3.44Å; L102-W104 VanDerWaalsContact C-N 3.27Å; L102-W104 PolarHBondContact O-N 3.36Å; L102-L105 PolarHBondContact O-N 2.91Å; L102-L106 VanDerWaalsContact O-CB 3.31Å; L102-L106 WeakPolarHBondContact O-CB 3.49Å; L102-L106 PolarHBondContact O-N 3.23Å; L102-I156 HydrophobicContact CD1-CD1 3.86Å; L102-I156 HydrophobicContact CD2-CD1 3.5Å; L102-I156 HydrophobicContact CG-CD1 4.31Å; L102-L168 HydrophobicContact CD1-CD1 3.91Å
103	N	56.9	Low	53.3	Low	95 Å²	95	70.1 Å²	70.1	51%	0.508	39%	0.386	S	S	.	.	H	α-helix	trans	-61.5	-37.6	176.4	-74.4	-32.1	0	0	0	112	V99 S107	V99-N103 PolarHBondContact O-N 3.26Å; V99-N103 PolarHBondContact O-ND2 3.43Å; N103-S107 WeakPolarHBondContact O-CB 3.2Å; N103-S107 PolarHBondContact O-N 2.98Å
104	W	60.9	Low	54.1	Low	53 Å²	53	66.8 Å²	66.8	20%	0.201	37%	0.373	C	S	.	.	H	α-helix	trans	-68.8	-47	177.9	177.8	65	0	0	0	112.2	K92 S100 V101 L102 L106 S107 D108	K92-W104 HydrophobicContact CB-CH2 3.41Å; K92-W104 VanDerWaalsContact CB-CH2 3.41Å; K92-W104 HydrophobicContact CB-CZ2 3.55Å; K92-W104 HydrophobicContact CB-CZ3 4.2Å; K92-W104 HydrophobicContact CD-CH2 4.07Å; K92-W104 HydrophobicContact CD-CZ2 3.27Å; K92-W104 HydrophobicContact CG-CH2 3.87Å; K92-W104 HydrophobicContact CG-CZ2 3.56Å; S100-W104 VanDerWaalsContact O-CB 3.26Å; S100-W104 WeakPolarHBondContact O-CB 3.29Å; S100-W104 PolarHBondContact O-N 2.89Å; V101-W104 PolarHBondContact O-N 3.48Å; L102-W104 VanDerWaalsContact C-N 3.27Å; L102-W104 PolarHBondContact O-N 3.36Å; W104-L106 VanDerWaalsContact C-N 3.3Å; W104-L106 PolarHBondContact O-N 2.56Å; W104-S107 PolarHBondContact O-N 2.79Å; W104-D108 HydrophobicContact CZ2-CB 4.49Å; W104-D108 WeakPolarHBondContact CZ2-OD2 3.45Å; W104-D108 PolarHBondContact NE1-OD2 2.73Å; W104-D108 VanDerWaalsContact NE1-OD2 3.09Å; W104-D108 PolarHBondContact O-N 3.12Å
105	L	56.6	Low	54.6	Low	72 Å²	72	66.3 Å²	66.3	38%	0.377	37%	0.373	S	S	.	.	H	α-helix	trans	-59.3	-42.1	174.6	-74.4	170.5	0	0	0	111.5	V101 L102 D108 L109 L168	V101-L105 HydrophobicContact CG1-CD1 3.92Å; V101-L105 HydrophobicContact CG1-CG 4.36Å; V101-L105 WeakPolarHBondContact O-CG 3.49Å; V101-L105 PolarHBondContact O-N 3.1Å; L102-L105 PolarHBondContact O-N 2.91Å; L105-D108 PolarHBondContact O-N 2.74Å; L105-L109 WeakPolarHBondContact O-CB 2.86Å; L105-L109 PolarHBondContact O-N 2.96Å; L105-L168 HydrophobicContact CB-CD2 4.42Å
106	L	55.6	Low	54.9	Low	41 Å²	41	70 Å²	70	22%	0.215	38%	0.384	C	S	.	.	H	α-helix	trans	-63.3	-45	177.2	-174.5	63.9	0	0	0	111.6	L102 W104 D108 L109 Q110 V154 M170	L102-L106 VanDerWaalsContact O-CB 3.31Å; L102-L106 WeakPolarHBondContact O-CB 3.49Å; L102-L106 PolarHBondContact O-N 3.23Å; W104-L106 VanDerWaalsContact C-N 3.3Å; W104-L106 PolarHBondContact O-N 2.56Å; L106-D108 PolarHBondContact O-N 3.12Å; L106-L109 PolarHBondContact O-N 3.48Å; L106-Q110 WeakPolarHBondContact O-CB 2.92Å; L106-Q110 VanDerWaalsContact O-CG 3.23Å; L106-Q110 WeakPolarHBondContact O-CG 3.42Å; L106-Q110 PolarHBondContact O-N 3.34Å; L106-V154 HydrophobicContact CD1-CG1 4.43Å; L106-M170 HydrophobicContact CD1-SD 4.12Å
107	S	65.6	Low	55.3	Low	44 Å²	44	66 Å²	66	31%	0.308	35%	0.351	S	S	.	.	H	α-helix	trans	-62.2	-42.9	178	-175.9	0	0	0	0	112.1	N103 W104 Q110 K111	N103-S107 WeakPolarHBondContact O-CB 3.2Å; N103-S107 PolarHBondContact O-N 2.98Å; W104-S107 PolarHBondContact O-N 2.79Å; S107-Q110 PolarHBondContact O-N 3.42Å; S107-K111 VanDerWaalsContact O-CG 3.3Å; S107-K111 WeakPolarHBondContact O-CG 3.1Å; S107-K111 PolarHBondContact O-N 2.89Å; S107-K111 WeakPolarHBondContact OG-CE 3.44Å; S107-K111 PolarHBondContact OG-NZ 2.92Å
108	D	62.8	Low	55.5	Low	18 Å²	18	68 Å²	68	10%	0.096	36%	0.358	C	S	.	.	H	α-helix	trans	-73.1	-39.1	-178.8	-80.2	11.5	0	0	0	111.1	W104 L105 L106 Q110 K111 Y112	W104-D108 HydrophobicContact CZ2-CB 4.49Å; W104-D108 WeakPolarHBondContact CZ2-OD2 3.45Å; W104-D108 PolarHBondContact NE1-OD2 2.73Å; W104-D108 VanDerWaalsContact NE1-OD2 3.09Å; W104-D108 PolarHBondContact O-N 3.12Å; L105-D108 PolarHBondContact O-N 2.74Å; L106-D108 PolarHBondContact O-N 3.12Å; D108-Q110 VanDerWaalsContact C-N 3.33Å; D108-Q110 PolarHBondContact O-N 3.49Å; D108-K111 WeakPolarHBondContact O-CB 3.19Å; D108-K111 PolarHBondContact O-N 3.09Å; D108-K111 VanDerWaalsContact O-N 3.15Å; D108-K111 IonicContact OD1-NZ 3.51Å; D108-K111 PolarHBondContact OD1-NZ 2.8Å; D108-Y112 HydrophobicContact CB-CE2 4.01Å; D108-Y112 WeakPolarHBondContact O-CD2 3.48Å; D108-Y112 VanDerWaalsContact O-CE2 3.32Å; D108-Y112 WeakPolarHBondContact O-CE2 3.42Å; D108-Y112 PolarHBondContact O-N 3.45Å
109	L	67.1	Low	55.4	Low	63 Å²	63	68.1 Å²	68.1	33%	0.33	36%	0.364	S	S	.	.	H	α-helix	trans	-63	-38.5	174	-167.4	62.6	0	0	0	112.5	L105 L106 Y112 A113 L168 M170	L105-L109 WeakPolarHBondContact O-CB 2.86Å; L105-L109 PolarHBondContact O-N 2.96Å; L106-L109 PolarHBondContact O-N 3.48Å; L109-Y112 PolarHBondContact O-N 2.9Å; L109-A113 WeakPolarHBondContact O-CB 3.34Å; L109-A113 PolarHBondContact O-N 2.98Å; L109-L168 HydrophobicContact CD2-CD2 4.35Å; L109-M170 HydrophobicContact CB-CE 4.24Å; L109-M170 HydrophobicContact CD1-CE 4.34Å; L109-M170 HydrophobicContact CD2-CB 4.49Å; L109-M170 HydrophobicContact CD2-CE 3.35Å; L109-M170 HydrophobicContact CD2-CG 3.71Å; L109-M170 HydrophobicContact CD2-SD 3.54Å; L109-M170 VanDerWaalsContact CD2-SD 3.54Å; L109-M170 HydrophobicContact CG-CE 3.32Å; L109-M170 HydrophobicContact CG-SD 4.04Å
110	Q	56.8	Low	55.1	Low	96 Å²	96	70.2 Å²	70.2	45%	0.449	37%	0.372	S	S	.	.	H	α-helix	trans	-62.3	-42.2	171.6	-76.9	172.5	-16.3	0	0	112.3	L106 S107 D108 Y112 A113 L114	L106-Q110 WeakPolarHBondContact O-CB 2.92Å; L106-Q110 VanDerWaalsContact O-CG 3.23Å; L106-Q110 WeakPolarHBondContact O-CG 3.42Å; L106-Q110 PolarHBondContact O-N 3.34Å; S107-Q110 PolarHBondContact O-N 3.42Å; D108-Q110 VanDerWaalsContact C-N 3.33Å; D108-Q110 PolarHBondContact O-N 3.49Å; Q110-Y112 VanDerWaalsContact C-N 3.33Å; Q110-Y112 PolarHBondContact O-N 3.15Å; Q110-A113 PolarHBondContact O-N 3.05Å; Q110-L114 WeakPolarHBondContact O-CB 2.88Å; Q110-L114 PolarHBondContact O-N 2.93Å
111	K	63.1	Low	54.8	Low	118 Å²	118	69.5 Å²	69.5	51%	0.513	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-40.5	175.4	-70.4	167.3	-159.4	156.8	0	111.8	S107 D108 L114 G115	S107-K111 VanDerWaalsContact O-CG 3.3Å; S107-K111 WeakPolarHBondContact O-CG 3.1Å; S107-K111 PolarHBondContact O-N 2.89Å; S107-K111 WeakPolarHBondContact OG-CE 3.44Å; S107-K111 PolarHBondContact OG-NZ 2.92Å; D108-K111 WeakPolarHBondContact O-CB 3.19Å; D108-K111 PolarHBondContact O-N 3.09Å; D108-K111 VanDerWaalsContact O-N 3.15Å; D108-K111 IonicContact OD1-NZ 3.51Å; D108-K111 PolarHBondContact OD1-NZ 2.8Å; K111-L114 PolarHBondContact O-N 3.34Å; K111-G115 PolarHBondContact O-N 2.95Å
112	Y	58.1	Low	54.6	Low	101 Å²	101	73.7 Å²	73.7	40%	0.396	40%	0.395	S	S	.	.	H	α-helix	trans	-65.5	-46.5	175.5	-63.6	-54.3	0	0	0	111.3	L90 D108 L109 Q110 L114 G115 F116	L90-Y112 HydrophobicContact CD1-CE1 4.21Å; L90-Y112 HydrophobicContact CD1-CE2 4.41Å; L90-Y112 WeakPolarHBondContact CD1-OH 3.46Å; D108-Y112 HydrophobicContact CB-CE2 4.01Å; D108-Y112 WeakPolarHBondContact O-CD2 3.48Å; D108-Y112 VanDerWaalsContact O-CE2 3.32Å; D108-Y112 WeakPolarHBondContact O-CE2 3.42Å; D108-Y112 PolarHBondContact O-N 3.45Å; L109-Y112 PolarHBondContact O-N 2.9Å; Q110-Y112 VanDerWaalsContact C-N 3.33Å; Q110-Y112 PolarHBondContact O-N 3.15Å; Y112-L114 VanDerWaalsContact C-N 3.28Å; Y112-L114 PolarHBondContact O-N 3.48Å; Y112-G115 CarbonylContact O-C 3.6Å; Y112-G115 WeakPolarHBondContact O-CA 3.3Å; Y112-G115 PolarHBondContact O-N 3.45Å; Y112-G115 VanDerWaalsContact O-N 3.08Å; Y112-F116 VanDerWaalsContact C-CD2 3.49Å; Y112-F116 WeakPolarHBondContact O-CD2 3.4Å; Y112-F116 WeakPolarHBondContact O-CG 3.26Å; Y112-F116 PolarHBondContact O-N 2.99Å
113	A	53.3	Low	54	Low	15 Å²	15	73.6 Å²	73.6	12%	0.124	40%	0.398	C	S	.	.	H	α-helix	trans	-55.6	-43.7	176.1	0	0	0	0	0	112.2	L109 Q110 F116 Q117 V149	L109-A113 WeakPolarHBondContact O-CB 3.34Å; L109-A113 PolarHBondContact O-N 2.98Å; Q110-A113 PolarHBondContact O-N 3.05Å; A113-F116 PolarHBondContact O-N 3.02Å; A113-Q117 PolarHBondContact O-N 2.87Å; A113-V149 HydrophobicContact CB-CB 4.02Å; A113-V149 HydrophobicContact CB-CG1 3.79Å; A113-V149 HydrophobicContact CB-CG2 4.33Å
114	L	53.3	Low	53.4	Low	92 Å²	92	76.3 Å²	76.3	48%	0.482	42%	0.419	S	S	.	.	H	α-helix	trans	-64.5	-43	175.2	-174.4	67.8	0	0	0	111.9	Q110 K111 Y112 F116 Q117 H118	Q110-L114 WeakPolarHBondContact O-CB 2.88Å; Q110-L114 PolarHBondContact O-N 2.93Å; K111-L114 PolarHBondContact O-N 3.34Å; Y112-L114 VanDerWaalsContact C-N 3.28Å; Y112-L114 PolarHBondContact O-N 3.48Å; L114-F116 VanDerWaalsContact C-N 3.33Å; L114-F116 PolarHBondContact O-N 3.22Å; L114-Q117 WeakPolarHBondContact O-CB 3.43Å; L114-Q117 PolarHBondContact O-N 2.88Å; L114-H118 PolarHBondContact O-CD2 3.46Å; L114-H118 VanDerWaalsContact O-CD2 3.23Å; L114-H118 PolarHBondContact O-N 3.43Å
115	G	49.9	Very low	52.6	Low	40 Å²	40	78 Å²	78	41%	0.412	44%	0.438	S	S	.	.	H	α-helix	trans	-60.9	-40.7	174.9	0	0	0	0	0	112.7	K111 Y112 H118 A119	K111-G115 PolarHBondContact O-N 2.95Å; Y112-G115 CarbonylContact O-C 3.6Å; Y112-G115 WeakPolarHBondContact O-CA 3.3Å; Y112-G115 PolarHBondContact O-N 3.45Å; Y112-G115 VanDerWaalsContact O-N 3.08Å; G115-H118 PolarHBondContact O-N 3.4Å; G115-A119 PolarHBondContact O-N 2.81Å
116	F	51.5	Low	51.9	Low	130 Å²	130	80.3 Å²	80.3	57%	0.57	46%	0.456	S	S	*	.	H	α-helix	trans	-66.8	-40.5	174.6	-70.5	-60.1	0	0	0	111.8	Y112 A113 L114 H118 A119 L120	Y112-F116 VanDerWaalsContact C-CD2 3.49Å; Y112-F116 WeakPolarHBondContact O-CD2 3.4Å; Y112-F116 WeakPolarHBondContact O-CG 3.26Å; Y112-F116 PolarHBondContact O-N 2.99Å; A113-F116 PolarHBondContact O-N 3.02Å; L114-F116 VanDerWaalsContact C-N 3.33Å; L114-F116 PolarHBondContact O-N 3.22Å; F116-H118 VanDerWaalsContact C-N 3.31Å; F116-H118 PolarHBondContact O-N 2.75Å; F116-A119 PolarHBondContact O-N 2.85Å; F116-L120 VanDerWaalsContact O-CB 3.29Å; F116-L120 WeakPolarHBondContact O-CB 3.4Å; F116-L120 WeakPolarHBondContact O-CG 3.35Å; F116-L120 PolarHBondContact O-N 3.27Å
117	Q	51.8	Low	51	Low	50 Å²	50	83.3 Å²	83.3	23%	0.234	48%	0.479	C	S	.	.	H	α-helix	trans	-59.8	-43	174	-171.4	-179.4	-1.7	0	0	111.3	A113 L114 A119 L120 S121 Y147	A113-Q117 PolarHBondContact O-N 2.87Å; L114-Q117 WeakPolarHBondContact O-CB 3.43Å; L114-Q117 PolarHBondContact O-N 2.88Å; Q117-A119 VanDerWaalsContact C-N 3.35Å; Q117-A119 PolarHBondContact O-N 3.45Å; Q117-L120 PolarHBondContact O-N 3.1Å; Q117-S121 WeakPolarHBondContact O-CB 3.39Å; Q117-S121 PolarHBondContact O-N 3.18Å; Q117-Y147 WeakPolarHBondContact CG-O 3.23Å; Q117-Y147 PolarHBondContact NE2-O 3.37Å; Q117-Y147 PolarHBondContact OE1-O 3.39Å
118	H	49.1	Very low	49.6	Very low	112 Å²	112	88.6 Å²	88.6	52%	0.519	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-35.5	174.9	-82.4	-65.7	0	0	0	113.5	L114 G115 F116	L114-H118 PolarHBondContact O-CD2 3.46Å; L114-H118 VanDerWaalsContact O-CD2 3.23Å; L114-H118 PolarHBondContact O-N 3.43Å; G115-H118 PolarHBondContact O-N 3.4Å; F116-H118 VanDerWaalsContact C-N 3.31Å; F116-H118 PolarHBondContact O-N 2.75Å
119	A	44.8	Very low	48.5	Very low	73 Å²	73	95.8 Å²	95.8	60%	0.603	53%	0.529	S	S	*	.	H	α-helix	trans	-75.3	-35.4	178.2	0	0	0	0	0	113.1	G115 F116 Q117	G115-A119 PolarHBondContact O-N 2.81Å; F116-A119 PolarHBondContact O-N 2.85Å; Q117-A119 VanDerWaalsContact C-N 3.35Å; Q117-A119 PolarHBondContact O-N 3.45Å
120	L	44.5	Very low	47.1	Very low	134 Å²	134	100.9 Å²	100.9	70%	0.702	55%	0.549	S	S	*	.	H	α-helix	trans	-89.8	-21.4	-175.9	-64	174.2	0	0	0	113.3	F116 Q117 P122	F116-L120 VanDerWaalsContact O-CB 3.29Å; F116-L120 WeakPolarHBondContact O-CB 3.4Å; F116-L120 WeakPolarHBondContact O-CG 3.35Å; F116-L120 PolarHBondContact O-N 3.27Å; Q117-L120 PolarHBondContact O-N 3.1Å; L120-P122 VanDerWaalsContact C-CD 3.4Å; L120-P122 WeakPolarHBondContact O-CD 3.31Å
121	S	45.1	Very low	46.4	Very low	35 Å²	35	103 Å²	103	25%	0.245	57%	0.568	C	S	.	*			trans	-120.8	75.7	170.5	-59.5	0	0	0	0	109.3	Q117 S123	Q117-S121 WeakPolarHBondContact O-CB 3.39Å; Q117-S121 PolarHBondContact O-N 3.18Å; S121-S123 PolarHBondContact O-N 2.9Å
122	P	45.1	Very low	45	Very low	111 Å²	111	100.3 Å²	100.3	72%	0.721	57%	0.574	S	S	*	*			trans	-74.3	47.8	172.6	33.4	-34.2	0	0	0	110.2	L120	L120-P122 VanDerWaalsContact C-CD 3.4Å; L120-P122 WeakPolarHBondContact O-CD 3.31Å
123	S	42.1	Very low	43.8	Very low	52 Å²	52	103.1 Å²	103.1	36%	0.364	60%	0.596	S	S	.	*			trans	-81.3	133.5	172	-70.8	0	0	0	0	108.5	S121 S125 E144	S121-S123 PolarHBondContact O-N 2.9Å; S123-S125 VanDerWaalsContact C-N 3.28Å; S123-S125 PolarHBondContact O-N 3.26Å; S123-E144 WeakPolarHBondContact CB-OE2 3.43Å; S123-E144 PolarHBondContact OG-OE2 3.02Å
124	T	43.5	Very low	43.4	Very low	152 Å²	152	107.2 Å²	107.2	93%	0.933	62%	0.619	S	S	*	*			trans	-59.1	79	-175.7	54.2	0	0	0	0	112.3
125	S	44.9	Very low	42.7	Very low	88 Å²	88	111.6 Å²	111.6	62%	0.615	64%	0.637	S	S	*	*			trans	-118.7	96.5	163.8	70	0	0	0	0	107.7	S123 C127	S123-S125 VanDerWaalsContact C-N 3.28Å; S123-S125 PolarHBondContact O-N 3.26Å; S125-C127 VanDerWaalsContact C-N 3.33Å; S125-C127 PolarHBondContact O-N 3.48Å
126	T	42	Very low	42.1	Very low	122 Å²	122	113.2 Å²	113.2	75%	0.748	65%	0.654	S	S	*	*			trans	-52.6	104.5	158.2	52.2	0	0	0	0	106.7	K128	T126-K128 PolarHBondContact O-N 3.19Å
127	C	36	Very low	41.1	Very low	104 Å²	104	116.3 Å²	116.3	70%	0.703	67%	0.67	S	S	*	*			trans	-69.9	77.9	168.2	-172.8	0	0	0	0	106.8	S125 H129	S125-C127 VanDerWaalsContact C-N 3.33Å; S125-C127 PolarHBondContact O-N 3.48Å; C127-H129 VanDerWaalsContact C-N 3.32Å; C127-H129 PolarHBondContact O-N 3.2Å; C127-H129 VanDerWaalsContact O-N 3.12Å
128	K	37.7	Very low	40.1	Very low	155 Å²	155	123.4 Å²	123.4	67%	0.674	70%	0.696	S	S	*	*			trans	-69.6	100.5	160.7	-72.4	-89.6	-178.1	174.7	0	104	T126 K130	T126-K128 PolarHBondContact O-N 3.19Å; K128-K130 VanDerWaalsContact C-N 3.27Å; K128-K130 HydrophobicContact CB-CG 4.28Å; K128-K130 PolarHBondContact O-N 2.99Å
129	H	39.1	Very low	39.5	Very low	168 Å²	168	126.5 Å²	126.5	78%	0.778	71%	0.71	S	S	*	*			trans	-55.4	102.7	155.4	-116.4	96	0	0	0	106.5	C127	C127-H129 VanDerWaalsContact C-N 3.32Å; C127-H129 PolarHBondContact O-N 3.2Å; C127-H129 VanDerWaalsContact O-N 3.12Å
130	K	36.6	Very low	38.9	Very low	171 Å²	171	134.4 Å²	134.4	74%	0.743	73%	0.725	S	S	*	*			trans	-119.2	93	164.9	-76.8	-77.9	-178.7	172.5	0	105.7	K128 G132	K128-K130 VanDerWaalsContact C-N 3.27Å; K128-K130 HydrophobicContact CB-CG 4.28Å; K128-K130 PolarHBondContact O-N 2.99Å; K130-G132 PolarHBondContact O-N 3.42Å
131	V	42	Very low	38.7	Very low	139 Å²	139	132.9 Å²	132.9	84%	0.842	73%	0.732	S	S	*	*			trans	-57.4	122.4	151.1	172	0	0	0	0	106.2
132	G	35	Very low	38.4	Very low	62 Å²	62	135.4 Å²	135.4	64%	0.639	75%	0.749	S	S	*	*			trans	125.8	106.7	164.4	0	0	0	0	0	115.8	K130	K130-G132 PolarHBondContact O-N 3.42Å
133	D	32.6	Very low	38.4	Very low	160 Å²	160	136 Å²	136	86%	0.856	76%	0.756	S	S	*	*			trans	75.2	150.5	144.7	-95.6	-18.3	0	0	0	123.2
134	T	44.8	Very low	38	Very low	102 Å²	102	139.2 Å²	139.2	63%	0.626	77%	0.766	S	S	*	*			trans	-63.2	171.2	-159.2	31.4	0	0	0	0	117.5
135	E	39.6	Very low	37.8	Very low	183 Å²	183	137.9 Å²	137.9	86%	0.855	75%	0.753	S	S	*	*			trans	74.2	115.1	143.9	68.6	-156.4	129.1	0	0	121.3
136	G	35.9	Very low	37.1	Very low	74 Å²	74	138.3 Å²	138.3	76%	0.763	75%	0.754	S	S	*	*			trans	127.3	112	145.3	0	0	0	0	0	117.3
137	E	30	Very low	36.9	Very low	196 Å²	196	139.3 Å²	139.3	92%	0.916	75%	0.746	S	S	*	*			trans	93.2	142.6	133.3	-141.8	165.6	173.8	0	0	120.2
138	Y	32.4	Very low	36.9	Very low	199 Å²	199	137.1 Å²	137.1	78%	0.78	73%	0.731	S	S	*	*			trans	-92.2	157.9	-152.4	-71.9	-99.9	0	0	0	115
139	H	36.5	Very low	36.9	Very low	176 Å²	176	133 Å²	133	82%	0.815	72%	0.719	S	S	*	*			trans	74.4	95.1	155.9	-53	-52.8	0	0	0	119
140	R	31.4	Very low	36.9	Very low	239 Å²	239	132.7 Å²	132.7	90%	0.902	71%	0.712	S	S	*	*				-133.1	107.4	128.6	-155.7	175.1	-151.6	-159.7	4.6	108.8	S142	R140-S142 PolarHBondContact O-N 3.25Å
141	A	39.5	Very low	37.1	Very low	103 Å²	103	126.6 Å²	126.6	85%	0.851	69%	0.693	S	S	*	*			trans	-67.9	83.5	170.2	0	0	0	0	0	108.9	S143	A141-S143 VanDerWaalsContact C-N 3.29Å; A141-S143 PolarHBondContact O-N 3.01Å
142	S	38.7	Very low	36.8	Very low	88 Å²	88	126.4 Å²	126.4	62%	0.615	69%	0.688	S	S	*	*			trans	-83.8	85.5	158.2	54.5	0	0	0	0	107	R140 E144	R140-S142 PolarHBondContact O-N 3.25Å; S142-E144 PolarHBondContact O-N 2.96Å
143	S	45.2	Very low	37	Very low	123 Å²	123	131 Å²	131	86%	0.86	69%	0.692	S	S	*	*			trans	-65.1	70.2	158.2	163.2	0	0	0	0	108.1	A141	A141-S143 VanDerWaalsContact C-N 3.29Å; A141-S143 PolarHBondContact O-N 3.01Å
144	E	35.3	Very low	37.3	Very low	120 Å²	120	126.3 Å²	126.3	56%	0.561	67%	0.669	S	S	*	*			trans	-113	125.7	170.4	-74.6	-177.5	170.3	0	0	107.6	S123 S142 C146	S123-E144 WeakPolarHBondContact CB-OE2 3.43Å; S123-E144 PolarHBondContact OG-OE2 3.02Å; S142-E144 PolarHBondContact O-N 2.96Å; E144-C146 VanDerWaalsContact C-N 3.29Å; E144-C146 PolarHBondContact O-N 3.24Å
145	N	37.8	Very low	37	Very low	124 Å²	124	125.9 Å²	125.9	66%	0.663	66%	0.664	S	S	*	*			trans	-54.9	87.4	-174.6	-142.5	24.8	0	0	0	109.5	Y147	N145-Y147 HydrophobicContact CB-CE2 4.49Å; N145-Y147 PolarHBondContact ND2-OH 3.21Å; N145-Y147 WeakPolarHBondContact O-CD2 3.39Å; N145-Y147 PolarHBondContact O-N 3.42Å
146	C	31.5	Very low	37.1	Very low	96 Å²	96	120.5 Å²	120.5	65%	0.649	64%	0.64	S	S	*	*			trans	-83.3	101	-174.6	-169.5	0	0	0	0	108.4	E144 S148	E144-C146 VanDerWaalsContact C-N 3.29Å; E144-C146 PolarHBondContact O-N 3.24Å; C146-S148 VanDerWaalsContact C-N 3.35Å; C146-S148 PolarHBondContact O-N 3.48Å
147	Y	36.3	Very low	37.4	Very low	144 Å²	144	122.3 Å²	122.3	57%	0.565	63%	0.632	S	S	*	*			trans	-73.9	88.2	172.4	-62.9	-82	0	0	0	109.4	Q117 N145 V149	Q117-Y147 WeakPolarHBondContact CG-O 3.23Å; Q117-Y147 PolarHBondContact NE2-O 3.37Å; Q117-Y147 PolarHBondContact OE1-O 3.39Å; N145-Y147 HydrophobicContact CB-CE2 4.49Å; N145-Y147 PolarHBondContact ND2-OH 3.21Å; N145-Y147 WeakPolarHBondContact O-CD2 3.39Å; N145-Y147 PolarHBondContact O-N 3.42Å; Y147-V149 PolarHBondContact O-N 2.78Å
148	S	37.8	Very low	38	Very low	58 Å²	58	118.9 Å²	118.9	41%	0.406	61%	0.612	S	S	.	*			trans	-80.9	111.4	171.9	61.3	0	0	0	0	110.1	C146 Y150	C146-S148 VanDerWaalsContact C-N 3.35Å; C146-S148 PolarHBondContact O-N 3.48Å; S148-Y150 PolarHBondContact O-N 3.36Å; S148-Y150 VanDerWaalsContact OG-CE2 3.31Å; S148-Y150 WeakPolarHBondContact OG-CE2 3.31Å
149	V	35.9	Very low	38.5	Very low	69 Å²	69	116.7 Å²	116.7	42%	0.418	61%	0.613	S	S	.	*			trans	-85.4	90.6	173.2	-174.6	0	0	0	0	108.4	A113 Y147	A113-V149 HydrophobicContact CB-CB 4.02Å; A113-V149 HydrophobicContact CB-CG1 3.79Å; A113-V149 HydrophobicContact CB-CG2 4.33Å; Y147-V149 PolarHBondContact O-N 2.78Å
150	Y	39.9	Very low	38.6	Very low	161 Å²	161	114.7 Å²	114.7	63%	0.631	61%	0.605	S	S	*	*			trans	-93.8	132.8	166.7	-63.7	-72.5	0	0	0	109.3	S148 D152	S148-Y150 PolarHBondContact O-N 3.36Å; S148-Y150 VanDerWaalsContact OG-CE2 3.31Å; S148-Y150 WeakPolarHBondContact OG-CE2 3.31Å; Y150-D152 PolarHBondContact O-N 2.97Å
151	A	39.9	Very low	39.1	Very low	42 Å²	42	111.3 Å²	111.3	35%	0.347	61%	0.605	S	S	.	*			trans	-79	76.6	172	0	0	0	0	0	108.8	Q153 M170	A151-Q153 VanDerWaalsContact C-N 3.26Å; A151-Q153 PolarHBondContact O-N 3.44Å; A151-M170 HydrophobicContact CB-SD 4.05Å
152	D	37.7	Very low	38.9	Very low	135 Å²	135	116.5 Å²	116.5	72%	0.722	60%	0.603	S	S	*	*			trans	-71.4	-24	179.6	-90.8	1	0	0	0	112.2	Y150	Y150-D152 PolarHBondContact O-N 2.97Å
153	Q	39	Very low	38.8	Very low	158 Å²	158	117.7 Å²	117.7	74%	0.738	61%	0.608	S	S	*	*			trans	-153.1	128	180	-152.6	149.1	27.3	0	0	112.2	A151	A151-Q153 VanDerWaalsContact C-N 3.26Å; A151-Q153 PolarHBondContact O-N 3.44Å
154	V	38.3	Very low	38.4	Very low	62 Å²	62	119.2 Å²	119.2	38%	0.376	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.5	115.7	176.6	-125.3	0	0	0	0	107.8	L106 L168	L106-V154 HydrophobicContact CD1-CG1 4.43Å; V154-L168 HydrophobicContact CG1-CD1 3.49Å; V154-L168 VanDerWaalsContact CG1-CD1 3.49Å; V154-L168 HydrophobicContact CG1-CG 4.14Å
155	N	37.3	Very low	38.3	Very low	94 Å²	94	120.9 Å²	120.9	50%	0.503	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91	127.5	175.4	-170.8	10.7	0	0	0	109.7
156	I	42.5	Very low	38.3	Very low	69 Å²	69	119.6 Å²	119.6	35%	0.354	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.8	100.1	-179.9	-57.1	177.9	0	0	0	108.3	L102 Y158 L168	L102-I156 HydrophobicContact CD1-CD1 3.86Å; L102-I156 HydrophobicContact CD2-CD1 3.5Å; L102-I156 HydrophobicContact CG-CD1 4.31Å; I156-Y158 HydrophobicContact CG2-CD2 4.17Å; I156-Y158 PolarHBondContact O-N 3.16Å; I156-L168 HydrophobicContact CG1-CD1 4.2Å
157	D	42.3	Very low	38.7	Very low	113 Å²	113	123.5 Å²	123.5	60%	0.604	61%	0.608	S	S	*	*			trans	-85.7	100.7	173.8	-78.4	-36.1	0	0	0	110.3	L159	D157-L159 PolarHBondContact O-N 3.07Å; D157-L159 VanDerWaalsContact O-N 3.1Å
158	Y	41.8	Very low	38.7	Very low	123 Å²	123	119 Å²	119	48%	0.482	59%	0.593	S	S	.	*			trans	-79.5	84.6	168.7	-118.8	-89.8	0	0	0	109.1	I156 M160 L166	I156-Y158 HydrophobicContact CG2-CD2 4.17Å; I156-Y158 PolarHBondContact O-N 3.16Å; Y158-M160 VanDerWaalsContact C-N 3.27Å; Y158-M160 HydrophobicContact CD1-CE 3.57Å; Y158-M160 HydrophobicContact CD1-SD 3.94Å; Y158-M160 HydrophobicContact CE1-CE 4.31Å; Y158-M160 HydrophobicContact CG-CE 4.19Å; Y158-M160 PolarHBondContact O-N 3.12Å; Y158-L166 HydrophobicContact CE2-CD2 4.25Å
159	L	43.6	Very low	38.8	Very low	154 Å²	154	120.6 Å²	120.6	81%	0.806	60%	0.595	S	S	*	*			trans	-74.3	86.1	174.4	-165.4	70	0	0	0	109.5	D157 N161	D157-L159 PolarHBondContact O-N 3.07Å; D157-L159 VanDerWaalsContact O-N 3.1Å; L159-N161 PolarHBondContact O-N 3.11Å; L159-N161 VanDerWaalsContact O-N 3.16Å
160	M	39.4	Very low	38.9	Very low	134 Å²	134	119.7 Å²	119.7	66%	0.66	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	117.8	174.7	-62.1	-66.4	-179.7	0	0	109	Y158	Y158-M160 VanDerWaalsContact C-N 3.27Å; Y158-M160 HydrophobicContact CD1-CE 3.57Å; Y158-M160 HydrophobicContact CD1-SD 3.94Å; Y158-M160 HydrophobicContact CE1-CE 4.31Å; Y158-M160 HydrophobicContact CG-CE 4.19Å; Y158-M160 PolarHBondContact O-N 3.12Å
161	N	41.5	Very low	38.9	Very low	167 Å²	167	116.9 Å²	116.9	89%	0.893	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	118.5	20.5	166	-53.5	-36.2	0	0	0	119.2	L159	L159-N161 PolarHBondContact O-N 3.11Å; L159-N161 VanDerWaalsContact O-N 3.16Å
162	R	35.8	Very low	38.9	Very low	213 Å²	213	118.8 Å²	118.8	80%	0.804	60%	0.602	S	S	*	*	S	Bend	trans	-143.9	160.7	163	-117.6	-164.5	171.6	172.5	-1.9	112.6	Q164	R162-Q164 PolarHBondContact O-N 2.91Å
163	P	36.7	Very low	39.2	Very low	113 Å²	113	115.9 Å²	115.9	73%	0.734	60%	0.597	S	S	*	*	S	Bend	trans	-51.2	126	174.2	-19.4	30.2	0	0	0	109.2	N165	P163-N165 PolarHBondContact O-N 3.01Å
164	Q	36.2	Very low	39.2	Very low	154 Å²	154	116.8 Å²	116.8	72%	0.72	60%	0.599	S	S	*	*			trans	-72.1	115.7	-148.3	-60.3	165.9	8.1	0	0	111.9	R162	R162-Q164 PolarHBondContact O-N 2.91Å
165	N	33.2	Very low	39.4	Very low	155 Å²	155	120.4 Å²	120.4	83%	0.829	62%	0.616	S	S	*	*			trans	-100.6	96.2	162.8	-72	-66.5	0	0	0	107.6	P163 R167	P163-N165 PolarHBondContact O-N 3.01Å; N165-R167 PolarHBondContact O-N 3.38Å
166	L	38.5	Very low	39.3	Very low	98 Å²	98	119.9 Å²	119.9	51%	0.513	62%	0.616	S	S	.	*			trans	-74.1	114.6	169.6	-82.1	147.8	0	0	0	108.1	Y158	Y158-L166 HydrophobicContact CE2-CD2 4.25Å
167	R	37.9	Very low	39.1	Very low	178 Å²	178	121.6 Å²	121.6	67%	0.672	63%	0.626	S	S	*	*			trans	-105.1	117.2	175	-178.8	176.2	165.2	174.3	-5.9	108.7	N165 E169	N165-R167 PolarHBondContact O-N 3.38Å; R167-E169 IonicContact CZ-OE2 3.55Å; R167-E169 IonicContact NE-OE2 3.84Å; R167-E169 IonicContact NH2-OE2 2.81Å; R167-E169 PolarHBondContact NH2-OE2 3.39Å
168	L	37.7	Very low	38.8	Very low	48 Å²	48	122.5 Å²	122.5	25%	0.251	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.1	121.9	175.5	-166	69.5	0	0	0	108.9	L102 L105 L109 V154 I156	L102-L168 HydrophobicContact CD1-CD1 3.91Å; L105-L168 HydrophobicContact CB-CD2 4.42Å; L109-L168 HydrophobicContact CD2-CD2 4.35Å; V154-L168 HydrophobicContact CG1-CD1 3.49Å; V154-L168 VanDerWaalsContact CG1-CD1 3.49Å; V154-L168 HydrophobicContact CG1-CG 4.14Å; I156-L168 HydrophobicContact CG1-CD1 4.2Å
169	E	39	Very low	38.8	Very low	92 Å²	92	122.7 Å²	122.7	43%	0.43	64%	0.64	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121	127.4	-179.3	-168.3	166.5	158.3	0	0	109.2	R167	R167-E169 IonicContact CZ-OE2 3.55Å; R167-E169 IonicContact NE-OE2 3.84Å; R167-E169 IonicContact NH2-OE2 2.81Å; R167-E169 PolarHBondContact NH2-OE2 3.39Å
170	M	39	Very low	38.3	Very low	50 Å²	50	123.6 Å²	123.6	25%	0.246	64%	0.64	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	125.2	172.9	-66.2	-165	-38.1	0	0	109.2	L106 L109 A151	L106-M170 HydrophobicContact CD1-SD 4.12Å; L109-M170 HydrophobicContact CB-CE 4.24Å; L109-M170 HydrophobicContact CD1-CE 4.34Å; L109-M170 HydrophobicContact CD2-CB 4.49Å; L109-M170 HydrophobicContact CD2-CE 3.35Å; L109-M170 HydrophobicContact CD2-CG 3.71Å; L109-M170 HydrophobicContact CD2-SD 3.54Å; L109-M170 VanDerWaalsContact CD2-SD 3.54Å; L109-M170 HydrophobicContact CG-CE 3.32Å; L109-M170 HydrophobicContact CG-SD 4.04Å; A151-M170 HydrophobicContact CB-SD 4.05Å
171	T	39	Very low	37.9	Very low	102 Å²	102	124 Å²	124	63%	0.626	65%	0.645	S	S	*	*			trans	-102.6	131.6	-177.7	-16.6	0	0	0	0	109.7	A173	T171-A173 PolarHBondContact O-N 3.31Å
172	A	40.4	Very low	37.2	Very low	83 Å²	83	122.4 Å²	122.4	69%	0.686	64%	0.642	S	S	*	*			trans	-76.1	123.8	174	0	0	0	0	0	110.1	K174	A172-K174 PolarHBondContact O-N 2.98Å
173	A	43.3	Very low	36.9	Very low	74 Å²	74	118.4 Å²	118.4	61%	0.612	65%	0.645	S	S	*	*			trans	-73.1	107.5	168.6	0	0	0	0	0	109.1	T171 N175	T171-A173 PolarHBondContact O-N 3.31Å; A173-N175 PolarHBondContact O-N 3.47Å
174	K	40	Very low	36.5	Very low	177 Å²	177	122.1 Å²	122.1	77%	0.77	65%	0.652	S	S	*	*			trans	-72.2	107.1	168.8	-175.1	-178.1	-179.6	-178.7	0	108	A172 T176	A172-K174 PolarHBondContact O-N 2.98Å; K174-T176 VanDerWaalsContact C-N 3.35Å; K174-T176 HydrophobicContact CD-CG2 4.09Å; K174-T176 HydrophobicContact CG-CG2 4.27Å; K174-T176 PolarHBondContact O-N 2.91Å
175	N	42.2	Very low	36.3	Very low	137 Å²	137	123.6 Å²	123.6	73%	0.733	66%	0.659	S	S	*	*			trans	-72	92.6	167.3	-167.7	-16.4	0	0	0	108.7	A173 N177	A173-N175 PolarHBondContact O-N 3.47Å; N175-N177 VanDerWaalsContact C-N 3.31Å; N175-N177 PolarHBondContact O-N 2.65Å; N175-N177 PolarHBondContact OD1-N 2.98Å
176	T	35.8	Very low	35.9	Very low	83 Å²	83	123.6 Å²	123.6	51%	0.509	66%	0.659	S	S	.	*			trans	-80.1	83.6	162.6	34.5	0	0	0	0	108.5	K174 N178	K174-T176 VanDerWaalsContact C-N 3.35Å; K174-T176 HydrophobicContact CD-CG2 4.09Å; K174-T176 HydrophobicContact CG-CG2 4.27Å; K174-T176 PolarHBondContact O-N 2.91Å; T176-N178 PolarHBondContact O-N 3.25Å
177	N	37.4	Very low	35.5	Very low	106 Å²	106	124.7 Å²	124.7	57%	0.567	67%	0.673	S	S	*	*			trans	-76.1	73.1	159.5	77.2	-29.7	0	0	0	108.3	N175 N179	N175-N177 VanDerWaalsContact C-N 3.31Å; N175-N177 PolarHBondContact O-N 2.65Å; N175-N177 PolarHBondContact OD1-N 2.98Å; N177-N179 WeakPolarHBondContact CB-OD1 3.31Å; N177-N179 PolarHBondContact O-N 2.9Å; N177-N179 PolarHBondContact O-OD1 3.08Å
178	N	36.9	Very low	35.6	Very low	132 Å²	132	122.4 Å²	122.4	71%	0.706	68%	0.682	S	S	*	*			trans	-72.6	73.2	166.1	-66.4	-3	0	0	0	107.5	T176 Q180	T176-N178 PolarHBondContact O-N 3.25Å; N178-Q180 PolarHBondContact O-N 3.1Å
179	N	40.5	Very low	35.2	Very low	126 Å²	126	123.9 Å²	123.9	67%	0.674	71%	0.709	S	S	*	*			trans	-77.7	69.2	171	-54.5	2.4	0	0	0	106.9	N177 N181	N177-N179 WeakPolarHBondContact CB-OD1 3.31Å; N177-N179 PolarHBondContact O-N 2.9Å; N177-N179 PolarHBondContact O-OD1 3.08Å; N179-N181 PolarHBondContact O-N 2.88Å
180	Q	34.4	Very low	35	Very low	173 Å²	173	125.6 Å²	125.6	81%	0.808	73%	0.731	S	S	*	*			trans	-67.7	93.7	154.5	-90.4	178	-44	0	0	106.6	N178 T182	N178-Q180 PolarHBondContact O-N 3.1Å; Q180-T182 PolarHBondContact O-N 3.36Å; Q180-T182 VanDerWaalsContact O-N 3.08Å
181	N	30.8	Very low	34.9	Very low	144 Å²	144	129.2 Å²	129.2	77%	0.77	76%	0.756	S	S	*	*			trans	-28.7	101.5	146.9	47.7	-12.5	0	0	0	113.5	N179	N179-N181 PolarHBondContact O-N 2.88Å
182	T	26.1	Very low	34.7	Very low	133 Å²	133	132.3 Å²	132.3	82%	0.816	77%	0.765	S	S	*	*			trans	-131.4	104.2	142.1	46.2	0	0	0	0	107.7	Q180 E184	Q180-T182 PolarHBondContact O-N 3.36Å; Q180-T182 VanDerWaalsContact O-N 3.08Å; T182-E184 PolarHBondContact O-N 3.39Å
183	C	30.5	Very low	34.3	Very low	129 Å²	129	131.3 Å²	131.3	87%	0.872	76%	0.763	S	S	*	*			trans	-67	113.7	163.6	-60.3	0	0	0	0	108.1
184	E	26.7	Very low	33.6	Very low	191 Å²	191	136.9 Å²	136.9	89%	0.893	77%	0.77	S	S	*	*			trans	-137	126.1	150.8	-69.5	-166.4	160.8	0	0	108.4	T182	T182-E184 PolarHBondContact O-N 3.39Å
185	E	32.3	Very low	33.4	Very low	185 Å²	185	136.7 Å²	136.7	86%	0.864	77%	0.774	S	S	*	*			trans	-53	132.8	172.6	-95.6	174.5	128.8	0	0	112.3
186	D	26.1	Very low	33.1	Very low	155 Å²	155	134.7 Å²	134.7	83%	0.829	78%	0.776	S	S	*	*				161.1	118.6	121.3	-95.1	-29.3	0	0	0	111.4
187	C	29.9	Very low	33.1	Very low	120 Å²	120	139.7 Å²	139.7	81%	0.811	79%	0.794	S	S	*	*			trans	-84.6	159.7	155.5	-76.5	0	0	0	0	108.3
188	P	40.5	Very low	32.8	Very low	131 Å²	131	139.4 Å²	139.4	85%	0.851	80%	0.8	S	S	*	*			cis	-144.6	168.9	24	36.7	-14.9	0	0	0	117.3
189	G	27.8	Very low	32.6	Very low	79 Å²	79	139.7 Å²	139.7	81%	0.814	81%	0.807	S	S	*	*			trans	105.9	111.6	145.6	0	0	0	0	0	118
190	S	35.1	Very low	32.1	Very low	127 Å²	127	142.3 Å²	142.3	89%	0.888	82%	0.815	S	S	*	*			trans	-170.2	150.9	131	-159.4	0	0	0	0	111.9
191	T	36.8	Very low	32	Very low	127 Å²	127	145.4 Å²	145.4	78%	0.779	82%	0.821	S	S	*	*			trans	-103.7	166.5	-157.7	-60.2	0	0	0	0	112.1
192	M	34.7	Very low	31.9	Very low	166 Å²	166	146.8 Å²	146.8	82%	0.818	82%	0.822	S	S	*	*			trans	89	133.8	169.7	-64.4	-176.2	70.2	0	0	115.7
193	G	32.3	Very low	32.7	Very low	62 Å²	62	150.1 Å²	150.1	64%	0.639	83%	0.826	S	S	*	*			cis	-168.8	154.6	9	0	0	0	0	0	112.2
194	Y	28.9	Very low	32.8	Very low	192 Å²	192	149.2 Å²	149.2	75%	0.753	82%	0.819	S	S	*	*			trans	-47.2	147.5	176.9	45.6	-89.3	0	0	0	116.5
195	M	35.1	Very low	33	Very low	173 Å²	173	144 Å²	144	85%	0.852	82%	0.818	S	S	*	*				-164.2	110.7	110.5	-93.5	-153	-79.6	0	0	110
196	A	36.6	Very low	32.9	Very low	95 Å²	95	139.4 Å²	139.4	79%	0.785	82%	0.82	S	S	*	*			trans	-78.9	131	165.2	0	0	0	0	0	109
197	Q	36	Very low	33.2	Very low	188 Å²	188	135.3 Å²	135.3	88%	0.879	81%	0.814	S	S	*	*			trans	-99.6	103.3	163.8	-73.6	-172.5	19.9	0	0	108.8
198	S	30.6	Very low	33.6	Very low	100 Å²	100	139 Å²	139	70%	0.699	82%	0.819	S	S	*	*			trans	-85.3	118.4	165.1	-60.1	0	0	0	0	108.6
199	T	33.5	Very low	33.3	Very low	138 Å²	138	137.9 Å²	137.9	85%	0.847	81%	0.814	S	S	*	*			trans	-106.7	107.6	157.9	44.4	0	0	0	0	108.3
200	Q	30.4	Very low	33.9	Very low	180 Å²	180	138 Å²	138	84%	0.841	81%	0.808	S	S	*	*			trans	-76.3	138.2	173.5	-56.9	179	4.8	0	0	108.6
201	Y	30.9	Very low	34.1	Very low	239 Å²	239	141.8 Å²	141.8	94%	0.937	81%	0.808	S	S	*	*			trans	-112.1	117.6	163.5	-119.6	-86.5	0	0	0	109
202	E	29.9	Very low	34.2	Very low	172 Å²	172	140.2 Å²	140.2	80%	0.804	81%	0.808	S	S	*	*			trans	-78.8	130.1	173.5	-170.5	170.6	155	0	0	108.9
203	K	41.4	Very low	34.4	Very low	203 Å²	203	144.2 Å²	144.2	88%	0.883	83%	0.832	S	S	*	*			trans	-119.1	109.7	167.1	-168.5	173.8	-177.9	-178.5	0	108.5
204	C	32.4	Very low	34.5	Very low	110 Å²	110	148.4 Å²	148.4	74%	0.743	84%	0.841	S	S	*	*			trans	-55.6	142.4	175.5	-61	0	0	0	0	112.2
205	G	31.3	Very low	34.8	Very low	83 Å²	83	146.1 Å²	146.1	86%	0.856	85%	0.846	S	S	*	*			trans	-91	179.5	-177.2	0	0	0	0	0	116.1
206	G	30.7	Very low	34.8	Very low	88 Å²	88	144.6 Å²	144.6	91%	0.907	85%	0.846	S	S	*	*			trans	120.2	118.4	168.2	0	0	0	0	0	112.1
207	G	32.6	Very low	34.7	Very low	68 Å²	68	147.5 Å²	147.5	70%	0.701	85%	0.849	S	S	*	*			cis	172.5	160.2	-2.3	0	0	0	0	0	109.8
208	Q	38.2	Very low	34.6	Very low	199 Å²	199	144.9 Å²	144.9	93%	0.93	85%	0.847	S	S	*	*			trans	71	142.7	156.8	-58.7	-171.9	73.2	0	0	117.6
209	S	35.3	Very low	34.9	Very low	106 Å²	106	147.9 Å²	147.9	74%	0.741	86%	0.857	S	S	*	*			cis	-166.6	149.5	-0.3	178.3	0	0	0	0	109.2
210	A	39.5	Very low	35	Very low	83 Å²	83	148.6 Å²	148.6	69%	0.686	86%	0.858	S	S	*	*			trans	14.3	136.9	154.2	0	0	0	0	0	121.8
211	K	39.9	Very low	35.4	Very low	206 Å²	206	146.2 Å²	146.2	90%	0.896	86%	0.859	S	S	*	*				-178.4	145.8	82	-98.3	-172.1	177.4	177.8	0	111.3
212	A	37.4	Very low	35.7	Very low	94 Å²	94	138.5 Å²	138.5	78%	0.777	85%	0.853	S	S	*	*			trans	-72.7	149.5	168.2	0	0	0	0	0	112
213	L	40.6	Very low	36.3	Very low	250 Å²	250	135.5 Å²	135.5	100%	1.309	86%	0.857	S	S	*	*			trans	-159.2	0	140.7	-111.2	149.4	0	0	0	108.7

Retrieved 213 of 213 residues in 76.3 ms (Link to these results)

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