A0A075B6R4_HUMAN Loading...

A-kinase anchoring protein 4

AlphaFold DB , UniProt , Accession A0A075B6R4, Species HUMAN (Homo sapiens, Human), Gene AKAP4, Length 254 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	28.8	Very low	42.2	Very low	232 Å²	232	134 Å²	134	100%	1.143	67%	0.672	S	S	*	*				0	113.2	0	-76.1	169.6	137.7	0	0	104.5	D3	M1-D3 PolarHBondContact O-N 3.47Å
2	S	33.8	Very low	42.2	Very low	125 Å²	125	134.8 Å²	134.8	87%	0.874	66%	0.662	S	S	*	*			trans	-72.2	112.9	-177.9	-58.2	0	0	0	0	107.4	D4	S2-D4 PolarHBondContact O-N 3.34Å
3	D	39.5	Very low	42.1	Very low	147 Å²	147	129.5 Å²	129.5	79%	0.786	66%	0.663	S	S	*	*			trans	-68.5	116.4	172.5	-69.3	-31.3	0	0	0	107.5	M1 I5	M1-D3 PolarHBondContact O-N 3.47Å; D3-I5 PolarHBondContact O-N 3.31Å; D3-I5 VanDerWaalsContact O-N 3.11Å
4	D	40.4	Very low	42	Very low	163 Å²	163	123.9 Å²	123.9	87%	0.872	64%	0.638	S	S	*	*			trans	-59.6	112.4	172.2	-96.7	-26.9	0	0	0	108.3	S2 D6	S2-D4 PolarHBondContact O-N 3.34Å; D4-D6 PolarHBondContact O-N 3.38Å; D4-D6 VanDerWaalsContact O-N 3.16Å
5	I	42.7	Very low	41.8	Very low	112 Å²	112	117.9 Å²	117.9	57%	0.574	61%	0.61	S	S	*	*			trans	-73.3	109.1	178.8	-64.3	169.7	0	0	0	107.9	D3 W7	D3-I5 PolarHBondContact O-N 3.31Å; D3-I5 VanDerWaalsContact O-N 3.11Å; I5-W7 HydrophobicContact CB-CZ2 4.48Å; I5-W7 HydrophobicContact CG2-CD2 3.89Å; I5-W7 HydrophobicContact CG2-CE3 4.44Å; I5-W7 HydrophobicContact CG2-CG 4.23Å; I5-W7 HydrophobicContact CG2-CH2 4.48Å; I5-W7 HydrophobicContact CG2-CZ2 3.92Å; I5-W7 PolarHBondContact O-N 3.16Å; I5-W7 VanDerWaalsContact O-N 3.14Å; I5-W7 PolarHBondContact O-NE1 2.97Å
6	D	50.6	Low	41.8	Very low	82 Å²	82	120.8 Å²	120.8	44%	0.439	62%	0.617	S	S	.	*			trans	-80.6	89.6	173.1	-174.7	4.1	0	0	0	110.3	D4 L8 R9 S10	D4-D6 PolarHBondContact O-N 3.38Å; D4-D6 VanDerWaalsContact O-N 3.16Å; D6-L8 PolarHBondContact O-N 2.89Å; D6-L8 VanDerWaalsContact O-N 3.16Å; D6-L8 WeakPolarHBondContact OD1-CB 3.46Å; D6-L8 PolarHBondContact OD1-N 2.94Å; D6-R9 PolarHBondContact O-N 2.92Å; D6-R9 VanDerWaalsContact O-N 3.16Å; D6-R9 WeakPolarHBondContact OD2-CD 3.42Å; D6-S10 PolarHBondContact O-N 3.2Å
7	W	49	Very low	41.9	Very low	146 Å²	146	116.6 Å²	116.6	55%	0.553	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-21.3	-179.8	-62.3	93	0	0	0	113.7	I5 R9	I5-W7 HydrophobicContact CB-CZ2 4.48Å; I5-W7 HydrophobicContact CG2-CD2 3.89Å; I5-W7 HydrophobicContact CG2-CE3 4.44Å; I5-W7 HydrophobicContact CG2-CG 4.23Å; I5-W7 HydrophobicContact CG2-CH2 4.48Å; I5-W7 HydrophobicContact CG2-CZ2 3.92Å; I5-W7 PolarHBondContact O-N 3.16Å; I5-W7 VanDerWaalsContact O-N 3.14Å; I5-W7 PolarHBondContact O-NE1 2.97Å; W7-R9 VanDerWaalsContact C-N 3.33Å
8	L	46.8	Very low	41.7	Very low	83 Å²	83	117.2 Å²	117.2	44%	0.435	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.4	-23.1	179.5	-66.8	168.5	0	0	0	112.8	D6 V17 Y20	D6-L8 PolarHBondContact O-N 2.89Å; D6-L8 VanDerWaalsContact O-N 3.16Å; D6-L8 WeakPolarHBondContact OD1-CB 3.46Å; D6-L8 PolarHBondContact OD1-N 2.94Å; L8-V17 HydrophobicContact CD2-CG2 3.85Å; L8-Y20 HydrophobicContact CD1-CE2 4.23Å
9	R	46	Very low	41.8	Very low	179 Å²	179	119.1 Å²	119.1	68%	0.675	61%	0.613	S	S	*	*	S	Bend	trans	-115.8	10.2	-176.6	-66.9	-175.5	169.2	-164.2	-1.8	113.3	D6 W7 H11	D6-R9 PolarHBondContact O-N 2.92Å; D6-R9 VanDerWaalsContact O-N 3.16Å; D6-R9 WeakPolarHBondContact OD2-CD 3.42Å; W7-R9 VanDerWaalsContact C-N 3.33Å; R9-H11 PolarHBondContact O-N 3.07Å
10	S	44.6	Very low	41.7	Very low	41 Å²	41	120 Å²	120	29%	0.287	61%	0.609	S	S	.	*			trans	-65.1	118.7	-178.8	-175.5	0	0	0	0	111.2	D6 R12 G13	D6-S10 PolarHBondContact O-N 3.2Å; S10-R12 PolarHBondContact O-N 2.95Å; S10-G13 PolarHBondContact O-N 2.8Å
11	H	41.8	Very low	41.7	Very low	164 Å²	164	118.8 Å²	118.8	76%	0.759	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-9.4	179.2	62.6	-85.7	0	0	0	114.1	R9 G13	R9-H11 PolarHBondContact O-N 3.07Å; H11-G13 VanDerWaalsContact C-N 3.28Å; H11-G13 PolarHBondContact O-N 3.45Å
12	R	42.5	Very low	42.4	Very low	144 Å²	144	111.6 Å²	111.6	54%	0.543	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	4.2	-177.2	-66.2	-171.9	-177.3	-124.4	5.4	114.1	S10 V14 G58	S10-R12 PolarHBondContact O-N 2.95Å; R12-V14 HydrophobicContact CB-CG2 3.58Å; R12-V14 PolarHBondContact O-N 3.32Å; R12-V14 VanDerWaalsContact O-N 3.13Å; R12-G58 PolarHBondContact NH2-O 3.43Å
13	G	41.2	Very low	42.7	Very low	66 Å²	66	114.3 Å²	114.3	68%	0.68	57%	0.574	S	S	*	*			trans	66.8	14	173.7	0	0	0	0	0	115	S10 H11 C15	S10-G13 PolarHBondContact O-N 2.8Å; H11-G13 VanDerWaalsContact C-N 3.28Å; H11-G13 PolarHBondContact O-N 3.45Å; G13-C15 VanDerWaalsContact C-N 3.26Å; G13-C15 PolarHBondContact O-N 3.15Å
14	V	40.7	Very low	42.8	Very low	51 Å²	51	109.2 Å²	109.2	31%	0.309	56%	0.556	S	S	.	*			trans	-70.6	-21.9	-170.5	-162.8	0	0	0	0	112.7	R12 V36	R12-V14 HydrophobicContact CB-CG2 3.58Å; R12-V14 PolarHBondContact O-N 3.32Å; R12-V14 VanDerWaalsContact O-N 3.13Å; V14-V36 HydrophobicContact CG1-CG1 4.02Å
15	C	38.3	Very low	42.8	Very low	33 Å²	33	110.5 Å²	110.5	22%	0.223	56%	0.557	C	S	.	*			trans	-128.2	115.9	176.5	-70.7	0	0	0	0	109.5	G13 V17	G13-C15 VanDerWaalsContact C-N 3.26Å; G13-C15 PolarHBondContact O-N 3.15Å; C15-V17 HydrophobicContact CB-CG2 4.35Å; C15-V17 PolarHBondContact O-N 3.19Å
16	K	42.2	Very low	42.9	Very low	165 Å²	165	113.5 Å²	113.5	72%	0.717	57%	0.568	S	S	*	*			trans	-87.8	106	167.5	-168.6	176.2	177.6	-174.7	0	108.1	D18	K16-D18 WeakPolarHBondContact CE-OD1 3.47Å
17	V	43.8	Very low	42.3	Very low	49 Å²	49	115.7 Å²	115.7	30%	0.297	58%	0.58	S	S	.	*			trans	-98.8	100.9	179.6	-175.7	0	0	0	0	108	L8 C15 L19	L8-V17 HydrophobicContact CD2-CG2 3.85Å; C15-V17 HydrophobicContact CB-CG2 4.35Å; C15-V17 PolarHBondContact O-N 3.19Å; V17-L19 VanDerWaalsContact C-N 3.27Å; V17-L19 PolarHBondContact O-N 3.1Å
18	D	38.8	Very low	41.8	Very low	128 Å²	128	116 Å²	116	68%	0.684	59%	0.588	S	S	*	*	S	Bend	trans	-76.6	-11.2	-174.7	-68.5	-39.8	0	0	0	113.5	K16	K16-D18 WeakPolarHBondContact CE-OD1 3.47Å
19	L	42.3	Very low	41.6	Very low	153 Å²	153	119 Å²	119	80%	0.801	60%	0.604	S	S	*	*			trans	-142.7	106.4	171.1	-95.3	107.5	0	0	0	111.8	V17	V17-L19 VanDerWaalsContact C-N 3.27Å; V17-L19 PolarHBondContact O-N 3.1Å
20	Y	40.6	Very low	41.1	Very low	137 Å²	137	118.2 Å²	118.2	54%	0.537	60%	0.601	S	S	.	*			trans	-140.7	121.4	166.6	-175.8	-102.6	0	0	0	109.8	L8 P22	L8-Y20 HydrophobicContact CD1-CE2 4.23Å; Y20-P22 HydrophobicContact CE1-CB 3.8Å; Y20-P22 HydrophobicContact CE1-CG 4.09Å
21	N	41.5	Very low	40.8	Very low	95 Å²	95	124.5 Å²	124.5	51%	0.508	62%	0.623	S	S	.	*			trans	-126.6	110	172.1	-174.4	0.6	0	0	0	108.3	E23	N21-E23 VanDerWaalsContact C-N 3.31Å; N21-E23 PolarHBondContact O-N 2.63Å; N21-E23 PolarHBondContact OD1-N 3.24Å
22	P	42.8	Very low	40.5	Very low	80 Å²	80	121.4 Å²	121.4	52%	0.519	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.2	-13	-175.2	28.3	-31.7	0	0	0	114.2	Y20	Y20-P22 HydrophobicContact CE1-CB 3.8Å; Y20-P22 HydrophobicContact CE1-CG 4.09Å
23	E	41.2	Very low	40.2	Very low	182 Å²	182	120.5 Å²	120.5	85%	0.85	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	5.3	-172.4	-66.4	179.4	175.5	0	0	113.8	N21	N21-E23 VanDerWaalsContact C-N 3.31Å; N21-E23 PolarHBondContact O-N 2.63Å; N21-E23 PolarHBondContact OD1-N 3.24Å
24	G	41.8	Very low	40	Very low	40 Å²	40	120.8 Å²	120.8	41%	0.412	61%	0.611	S	S	.	*	S	Bend	trans	-81.5	138	175	0	0	0	0	0	111.9	Q26	G24-Q26 PolarHBondContact O-N 3.46Å
25	Q	40.5	Very low	39.7	Very low	190 Å²	190	126.3 Å²	126.3	89%	0.888	63%	0.631	S	S	*	*			trans	-45	139.2	174.6	-80.4	-171.8	-47.3	0	0	111.9	D27	Q25-D27 VanDerWaalsContact C-N 3.27Å; Q25-D27 PolarHBondContact O-N 2.76Å
26	Q	43.7	Very low	39.8	Very low	175 Å²	175	128.7 Å²	128.7	82%	0.818	65%	0.645	S	S	*	*			trans	-57.5	78.4	-177.3	-166.8	176.1	33.6	0	0	111.9	G24	G24-Q26 PolarHBondContact O-N 3.46Å
27	D	37.8	Very low	39.5	Very low	128 Å²	128	125.5 Å²	125.5	68%	0.684	64%	0.636	S	S	*	*			trans	-96	113.1	173.6	-145.8	2.6	0	0	0	108.2	Q25 D29	Q25-D27 VanDerWaalsContact C-N 3.27Å; Q25-D27 PolarHBondContact O-N 2.76Å; D27-D29 PolarHBondContact O-N 3.04Å
28	Q	39.7	Very low	39.2	Very low	152 Å²	152	128 Å²	128	71%	0.71	65%	0.651	S	S	*	*	S	Bend	trans	-76.5	19.3	-161.1	-79.7	-84.7	-11.8	0	0	115.6
29	D	41.1	Very low	39	Very low	147 Å²	147	126.6 Å²	126.6	79%	0.786	65%	0.651	S	S	*	*			trans	-133.1	51.8	-172.6	-78.1	-36	0	0	0	113.7	D27	D27-D29 PolarHBondContact O-N 3.04Å
30	R	35.8	Very low	38.8	Very low	162 Å²	162	124.5 Å²	124.5	61%	0.611	65%	0.645	S	S	*	*			trans	-107.8	107.8	170.8	-64.2	-170.9	-177.4	-169	2.1	111.5	V32	R30-V32 PolarHBondContact O-N 3.29Å
31	K	38	Very low	38.8	Very low	173 Å²	173	124.2 Å²	124.2	75%	0.752	65%	0.652	S	S	*	*			trans	-71.7	115.8	169.8	-64.8	179.3	-179.6	-179.2	0	108.7
32	V	35.5	Very low	38.8	Very low	100 Å²	100	125.5 Å²	125.5	61%	0.606	66%	0.659	S	S	*	*			trans	-90.7	116.4	170.4	-175.9	0	0	0	0	107.6	R30 C34	R30-V32 PolarHBondContact O-N 3.29Å; V32-C34 VanDerWaalsContact CG1-SG 3.59Å
33	I	37.5	Very low	38.9	Very low	125 Å²	125	127.9 Å²	127.9	64%	0.641	67%	0.671	S	S	*	*			trans	-103.5	106.8	171.6	-56.9	175.6	0	0	0	106.3	F35	I33-F35 HydrophobicContact CB-CE2 4.41Å; I33-F35 HydrophobicContact CG2-CD2 4.12Å; I33-F35 HydrophobicContact CG2-CE1 4.45Å; I33-F35 HydrophobicContact CG2-CE2 3.44Å; I33-F35 VanDerWaalsContact CG2-CE2 3.44Å; I33-F35 HydrophobicContact CG2-CZ 3.64Å
34	C	36.2	Very low	38.7	Very low	71 Å²	71	126.6 Å²	126.6	48%	0.48	67%	0.665	S	S	.	*			trans	-92.7	120.9	175.3	-65.1	0	0	0	0	109.6	V32	V32-C34 VanDerWaalsContact CG1-SG 3.59Å
35	F	33.7	Very low	39	Very low	167 Å²	167	131.7 Å²	131.7	73%	0.732	68%	0.683	S	S	*	*			trans	-98.3	118.5	163.8	-63.1	-84.1	0	0	0	107.6	I33	I33-F35 HydrophobicContact CB-CE2 4.41Å; I33-F35 HydrophobicContact CG2-CD2 4.12Å; I33-F35 HydrophobicContact CG2-CE1 4.45Å; I33-F35 HydrophobicContact CG2-CE2 3.44Å; I33-F35 VanDerWaalsContact CG2-CE2 3.44Å; I33-F35 HydrophobicContact CG2-CZ 3.64Å
36	V	40.6	Very low	39	Very low	84 Å²	84	131.4 Å²	131.4	51%	0.509	68%	0.679	S	S	.	*			trans	-94.5	111.2	173.7	-178.9	0	0	0	0	107.4	V14 V38	V14-V36 HydrophobicContact CG1-CG1 4.02Å; V36-V38 HydrophobicContact CG1-CG1 4.29Å; V36-V38 PolarHBondContact O-N 2.69Å
37	D	35.8	Very low	38.8	Very low	98 Å²	98	130.6 Å²	130.6	52%	0.524	68%	0.68	S	S	.	*			trans	-84.3	96.3	174.3	-174.3	5	0	0	0	109.9	S39 T40	D37-S39 VanDerWaalsContact CG-OG 3.23Å; D37-S39 PolarHBondContact O-N 3.21Å; D37-S39 VanDerWaalsContact OD1-CB 3.29Å; D37-S39 WeakPolarHBondContact OD1-CB 3.49Å; D37-S39 PolarHBondContact OD1-N 2.95Å; D37-S39 PolarHBondContact OD1-OG 3.24Å; D37-S39 PolarHBondContact OD2-OG 3.1Å; D37-T40 PolarHBondContact O-OG1 3.39Å
38	V	38	Very low	39.2	Very low	101 Å²	101	134.1 Å²	134.1	61%	0.612	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-75.2	-5.3	178.1	-87.1	0	0	0	0	113.4	V36 T40 L41	V36-V38 HydrophobicContact CG1-CG1 4.29Å; V36-V38 PolarHBondContact O-N 2.69Å; V38-T40 PolarHBondContact O-N 2.85Å; V38-L41 HydrophobicContact CB-CD1 4.38Å; V38-L41 HydrophobicContact CG1-CD1 3.89Å; V38-L41 PolarHBondContact O-N 3.29Å
39	S	35.7	Very low	39.1	Very low	99 Å²	99	135.3 Å²	135.3	69%	0.692	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-74.2	-11.5	-178.7	68.3	0	0	0	0	114.2	D37	D37-S39 VanDerWaalsContact CG-OG 3.23Å; D37-S39 PolarHBondContact O-N 3.21Å; D37-S39 VanDerWaalsContact OD1-CB 3.29Å; D37-S39 WeakPolarHBondContact OD1-CB 3.49Å; D37-S39 PolarHBondContact OD1-N 2.95Å; D37-S39 PolarHBondContact OD1-OG 3.24Å; D37-S39 PolarHBondContact OD2-OG 3.1Å
40	T	36.9	Very low	38.9	Very low	108 Å²	108	134.5 Å²	134.5	66%	0.663	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-100.1	-0.1	178.3	55.8	0	0	0	0	114.2	D37 V38 N42	D37-T40 PolarHBondContact O-OG1 3.39Å; V38-T40 PolarHBondContact O-N 2.85Å; T40-N42 PolarHBondContact O-N 2.9Å
41	L	42	Very low	39	Very low	131 Å²	131	131.4 Å²	131.4	69%	0.686	69%	0.693	S	S	*	*			trans	-72.3	77.4	170.7	-76.9	164.3	0	0	0	109.2	V38 V43	V38-L41 HydrophobicContact CB-CD1 4.38Å; V38-L41 HydrophobicContact CG1-CD1 3.89Å; V38-L41 PolarHBondContact O-N 3.29Å; L41-V43 PolarHBondContact O-N 3.46Å; L41-V43 VanDerWaalsContact O-N 3.14Å
42	N	40	Very low	39.1	Very low	122 Å²	122	128 Å²	128	65%	0.652	70%	0.698	S	S	*	*			trans	-68.8	108.7	169.4	-162.7	27.2	0	0	0	107.7	T40 E44	T40-N42 PolarHBondContact O-N 2.9Å; N42-E44 HydrophobicContact CB-CG 4.48Å; N42-E44 WeakPolarHBondContact ND2-CG 3.49Å; N42-E44 PolarHBondContact ND2-OE1 3.24Å; N42-E44 PolarHBondContact O-N 3.11Å
43	V	44.9	Very low	38.9	Very low	130 Å²	130	129.1 Å²	129.1	79%	0.788	71%	0.71	S	S	*	*			trans	-77.1	83.1	168.6	-175.2	0	0	0	0	106	L41 D45	L41-V43 PolarHBondContact O-N 3.46Å; L41-V43 VanDerWaalsContact O-N 3.14Å; V43-D45 VanDerWaalsContact C-N 3.32Å; V43-D45 PolarHBondContact O-N 3.19Å
44	E	38.6	Very low	38.6	Very low	155 Å²	155	127.8 Å²	127.8	72%	0.724	71%	0.711	S	S	*	*			trans	-71.8	95.3	170	-72.7	-167.6	145.8	0	0	108.7	N42 K46	N42-E44 HydrophobicContact CB-CG 4.48Å; N42-E44 WeakPolarHBondContact ND2-CG 3.49Å; N42-E44 PolarHBondContact ND2-OE1 3.24Å; N42-E44 PolarHBondContact O-N 3.11Å; E44-K46 PolarHBondContact O-N 3.16Å
45	D	47.3	Very low	38.4	Very low	147 Å²	147	128.9 Å²	128.9	79%	0.786	72%	0.72	S	S	*	*			trans	-79.7	98.5	165.2	-155.9	17.4	0	0	0	107.3	V43	V43-D45 VanDerWaalsContact C-N 3.32Å; V43-D45 PolarHBondContact O-N 3.19Å
46	K	39.5	Very low	38.7	Very low	184 Å²	184	127.2 Å²	127.2	80%	0.8	73%	0.729	S	S	*	*			trans	-137.9	116	169	-76	-156.8	175.5	179.1	0	112.6	E44	E44-K46 PolarHBondContact O-N 3.16Å
47	D	41.3	Very low	38.2	Very low	158 Å²	158	131.6 Å²	131.6	85%	0.845	74%	0.744	S	S	*	*			trans	-51.5	136.1	171.4	-69.5	-57.7	0	0	0	113.5
48	Y	45.1	Very low	38	Very low	202 Å²	202	129.4 Å²	129.4	79%	0.792	74%	0.744	S	S	*	*			trans	-63.1	138.1	177.1	-75.6	-98.4	0	0	0	112.3
49	K	37.6	Very low	37.7	Very low	178 Å²	178	130.4 Å²	130.4	77%	0.774	75%	0.746	S	S	*	*			trans	-167.8	108.6	136.8	-95.6	-106.4	153.6	-152.2	0	112.8
50	D	37.5	Very low	37.6	Very low	129 Å²	129	131.8 Å²	131.8	69%	0.69	75%	0.745	S	S	*	*			trans	53.8	107	144.3	-54.2	-26	0	0	0	120.4
51	A	37.3	Very low	37.4	Very low	97 Å²	97	133 Å²	133	80%	0.802	75%	0.747	S	S	*	*				162.9	123.1	101.3	0	0	0	0	0	113.4
52	A	39.4	Very low	37.3	Very low	103 Å²	103	133.9 Å²	133.9	85%	0.851	75%	0.752	S	S	*	*			trans	53.7	108.4	151.3	0	0	0	0	0	120.1
53	S	32	Very low	36.9	Very low	123 Å²	123	131.3 Å²	131.3	86%	0.86	75%	0.754	S	S	*	*			trans	117.7	125.7	141.1	-158.7	0	0	0	0	116.3
54	S	30.9	Very low	36.4	Very low	97 Å²	97	129.9 Å²	129.9	68%	0.678	75%	0.75	S	S	*	*			trans	99.5	112.1	157.5	-155.7	0	0	0	0	119.2
55	S	32.4	Very low	36.5	Very low	94 Å²	94	129.1 Å²	129.1	66%	0.657	75%	0.75	S	S	*	*			trans	58	89.6	144.7	59.6	0	0	0	0	120.4	E57	S55-E57 PolarHBondContact O-N 3.14Å; S55-E57 VanDerWaalsContact O-N 3.13Å
56	S	40.8	Very low	36	Very low	131 Å²	131	130.3 Å²	130.3	92%	0.916	75%	0.751	S	S	*	*			trans	21.5	73.6	144.8	-168.8	0	0	0	0	117.2	G58	S56-G58 PolarHBondContact O-N 3.41Å
57	E	29.8	Very low	36.1	Very low	177 Å²	177	128.4 Å²	128.4	83%	0.827	75%	0.745	S	S	*	*			trans	-80.9	110.6	171.1	-63.1	-177.5	152.8	0	0	109.8	S55 N59	S55-E57 PolarHBondContact O-N 3.14Å; S55-E57 VanDerWaalsContact O-N 3.13Å; E57-N59 PolarHBondContact O-N 3.01Å
58	G	31.1	Very low	36.2	Very low	51 Å²	51	128.9 Å²	128.9	53%	0.526	74%	0.74	S	S	.	*			trans	-65.9	97.5	171.6	0	0	0	0	0	110.4	R12 S56 L60	R12-G58 PolarHBondContact NH2-O 3.43Å; S56-G58 PolarHBondContact O-N 3.41Å; G58-L60 PolarHBondContact O-N 3.11Å
59	N	31.5	Very low	35.9	Very low	122 Å²	122	127 Å²	127	65%	0.652	74%	0.738	S	S	*	*			trans	-68.2	99.8	171.2	-171.3	-13.3	0	0	0	108.9	E57 N61	E57-N59 PolarHBondContact O-N 3.01Å; N59-N61 PolarHBondContact O-N 2.95Å
60	L	33.5	Very low	35.7	Very low	129 Å²	129	124.5 Å²	124.5	68%	0.675	73%	0.732	S	S	*	*			trans	-82.6	98	174.3	-63.7	176.5	0	0	0	107.8	G58 L62	G58-L60 PolarHBondContact O-N 3.11Å; L60-L62 PolarHBondContact O-N 2.96Å
61	N	32.5	Very low	36	Very low	133 Å²	133	123.1 Å²	123.1	71%	0.711	72%	0.723	S	S	*	*			trans	-65.1	99.2	175.1	-156.2	-45.1	0	0	0	109.1	N59 G63	N59-N61 PolarHBondContact O-N 2.95Å; N61-G63 PolarHBondContact O-N 3.1Å
62	L	41.3	Very low	35.9	Very low	150 Å²	150	123.3 Å²	123.3	79%	0.785	71%	0.714	S	S	*	*			trans	-85.6	18.1	-178.3	-149.2	73.4	0	0	0	112.5	L60 S64	L60-L62 PolarHBondContact O-N 2.96Å; L62-S64 VanDerWaalsContact C-N 3.29Å; L62-S64 PolarHBondContact O-N 3.13Å
63	G	30	Very low	35.9	Very low	68 Å²	68	123.4 Å²	123.4	70%	0.701	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	4.9	-176.7	0	0	0	0	0	115.4	N61	N61-G63 PolarHBondContact O-N 3.1Å
64	S	34.3	Very low	36.2	Very low	100 Å²	100	126 Å²	126	70%	0.699	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.3	24.7	-172.6	76.9	0	0	0	0	115.2	L62 E66	L62-S64 VanDerWaalsContact C-N 3.29Å; L62-S64 PolarHBondContact O-N 3.13Å; S64-E66 PolarHBondContact O-N 3.19Å
65	L	41.3	Very low	36.5	Very low	139 Å²	139	126.4 Å²	126.4	73%	0.728	69%	0.69	S	S	*	*			trans	-80.1	49.4	174.5	-154.3	74.5	0	0	0	111.1
66	E	37.9	Very low	37	Very low	172 Å²	172	127.8 Å²	127.8	80%	0.804	69%	0.694	S	S	*	*			trans	-84.1	118.9	163.7	-67.9	-176.1	-176.3	0	0	107.1	S64	S64-E66 PolarHBondContact O-N 3.19Å
67	E	41.7	Very low	37.2	Very low	143 Å²	143	127.9 Å²	127.9	67%	0.668	68%	0.68	S	S	*	*	S	Bend	trans	78.4	130.8	174.9	-47.9	-178.6	162.2	0	0	117.2
68	K	43.2	Very low	37.6	Very low	169 Å²	169	126.7 Å²	126.7	74%	0.735	67%	0.673	S	S	*	*			trans	82.9	87	154.6	-56.9	140.1	175.5	149.9	0	116.5
69	E	37.6	Very low	38.3	Very low	163 Å²	163	134.2 Å²	134.2	76%	0.762	69%	0.691	S	S	*	*			trans	-128.5	110	137.5	-149.7	170.3	-167.1	0	0	109.2
70	I	34.7	Very low	38.7	Very low	125 Å²	125	134.7 Å²	134.7	64%	0.641	69%	0.693	S	S	*	*			trans	-109.7	111.4	176.1	-61.3	171.3	0	0	0	105.8	V72 L90	I70-V72 HydrophobicContact CG2-CG2 3.94Å; I70-L90 HydrophobicContact CG2-CD2 4.27Å
71	I	42.2	Very low	39.2	Very low	99 Å²	99	138.6 Å²	138.6	51%	0.508	71%	0.708	S	S	.	*			trans	-98.4	113.5	175.8	-55.9	174.7	0	0	0	108	I73	I71-I73 HydrophobicContact CG2-CG1 4.46Å
72	V	35.2	Very low	39.8	Very low	101 Å²	101	136.9 Å²	136.9	61%	0.612	71%	0.707	S	S	*	*			trans	-99.4	113.9	177.4	-177.9	0	0	0	0	108.8	I70 V88	I70-V72 HydrophobicContact CG2-CG2 3.94Å; V72-V88 HydrophobicContact CG1-CG2 4.46Å
73	I	40.9	Very low	39.9	Very low	106 Å²	106	139.4 Å²	139.4	54%	0.544	71%	0.711	S	S	.	*			trans	-95.1	118.2	173.1	-55.9	175.2	0	0	0	107.8	I71	I71-I73 HydrophobicContact CG2-CG1 4.46Å
74	K	37.8	Very low	40.2	Very low	176 Å²	176	142 Å²	142	77%	0.765	71%	0.714	S	S	*	*			trans	-108.4	121.9	179.5	-160.3	177.4	-175.4	-178.2	0	109.4
75	D	37.9	Very low	40.4	Very low	106 Å²	106	146.7 Å²	146.7	57%	0.567	73%	0.725	S	S	*	*			trans	-79	123.5	170.8	-170	4.2	0	0	0	109.2	E77	D75-E77 PolarHBondContact OD1-N 3.41Å
76	T	42.9	Very low	40.2	Very low	123 Å²	123	142.6 Å²	142.6	76%	0.755	72%	0.715	S	S	*	*			trans	-103.7	7	-179.4	50.4	0	0	0	0	113.2	K78	T76-K78 PolarHBondContact O-N 3.04Å
77	E	44	Very low	40.1	Very low	133 Å²	133	139.6 Å²	139.6	62%	0.621	71%	0.714	S	S	*	*			trans	-79.8	-3.4	-168.7	-153.7	-165.7	119.8	0	0	116.2	D75	D75-E77 PolarHBondContact OD1-N 3.41Å
78	K	39	Very low	39.9	Very low	153 Å²	153	136.1 Å²	136.1	67%	0.665	70%	0.702	S	S	*	*			trans	-115.3	100.3	-177	-58.7	-79.1	174	168.2	0	111.7	T76 D80	T76-K78 PolarHBondContact O-N 3.04Å; K78-D80 PolarHBondContact O-N 2.97Å
79	K	44.6	Very low	39.6	Very low	209 Å²	209	131.4 Å²	131.4	91%	0.909	69%	0.689	S	S	*	*			trans	-74.7	51.2	166.5	-162.6	-176.4	-179.3	178.4	0	111.2
80	D	39.8	Very low	39.7	Very low	131 Å²	131	129.5 Å²	129.5	70%	0.701	68%	0.684	S	S	*	*			trans	-142.2	112.2	166.6	-82.3	-43.4	0	0	0	108.2	K78 S82	K78-D80 PolarHBondContact O-N 2.97Å; D80-S82 PolarHBondContact O-N 3.29Å
81	Q	44.8	Very low	40	Very low	211 Å²	211	131.9 Å²	131.9	99%	0.986	69%	0.69	S	S	*	*			trans	-75.3	36.2	-171.3	-66.5	-177.3	3.8	0	0	114.2
82	S	44.1	Very low	40	Very low	98 Å²	98	134.5 Å²	134.5	69%	0.685	70%	0.698	S	S	*	*	S	Bend	trans	-132.2	106.4	175	64.5	0	0	0	0	111.8	D80	D80-S82 PolarHBondContact O-N 3.29Å
83	K	43.6	Very low	40.2	Very low	203 Å²	203	138 Å²	138	88%	0.883	71%	0.707	S	S	*	*			trans	73.9	70	170.7	-58.1	-179.1	177.7	-179.2	0	115.7	E85	K83-E85 VanDerWaalsContact C-N 3.35Å; K83-E85 PolarHBondContact O-N 3.32Å; K83-E85 VanDerWaalsContact O-N 3.15Å
84	T	36.8	Very low	40.4	Very low	123 Å²	123	136.2 Å²	136.2	76%	0.755	71%	0.708	S	S	*	*			trans	-75.6	86.6	156.4	41.6	0	0	0	0	109.7	G86	T84-G86 PolarHBondContact O-N 3.48Å
85	E	38	Very low	40.9	Very low	198 Å²	198	130 Å²	130	93%	0.925	69%	0.686	S	S	*	*			trans	-80	78.4	155.1	-170	172.5	-177.6	0	0	106.8	K83	K83-E85 VanDerWaalsContact C-N 3.35Å; K83-E85 PolarHBondContact O-N 3.32Å; K83-E85 VanDerWaalsContact O-N 3.15Å
86	G	38.3	Very low	41.4	Very low	52 Å²	52	131.1 Å²	131.1	54%	0.536	70%	0.702	S	S	.	*			trans	-84.3	122.7	174.8	0	0	0	0	0	109.5	T84 V88	T84-G86 PolarHBondContact O-N 3.48Å; G86-V88 PolarHBondContact O-N 3.48Å
87	S	36.3	Very low	42	Very low	109 Å²	109	128.9 Å²	128.9	76%	0.762	69%	0.686	S	S	*	*			trans	-76.2	114.5	175.5	38.8	0	0	0	0	110.4
88	V	37.3	Very low	42.2	Very low	70 Å²	70	127.4 Å²	127.4	42%	0.424	69%	0.687	S	S	.	*			trans	-85.8	115.2	171.5	178.6	0	0	0	0	108	V72 G86 L90	V72-V88 HydrophobicContact CG1-CG2 4.46Å; G86-V88 PolarHBondContact O-N 3.48Å; V88-L90 HydrophobicContact CG1-CD2 4.04Å; V88-L90 HydrophobicContact CG1-CG 4.26Å; V88-L90 PolarHBondContact O-N 2.86Å
89	C	37	Very low	43.3	Very low	70 Å²	70	122.8 Å²	122.8	47%	0.473	67%	0.672	S	S	.	*			trans	-85	107	172.7	-66.9	0	0	0	0	109.5	F91	C89-F91 HydrophobicContact CB-CE2 4.12Å
90	L	38.5	Very low	43.9	Very low	123 Å²	123	114.5 Å²	114.5	64%	0.644	64%	0.641	S	S	*	*			trans	-87.3	107.2	174.6	-64.5	169.4	0	0	0	108.9	I70 V88 K92	I70-L90 HydrophobicContact CG2-CD2 4.27Å; V88-L90 HydrophobicContact CG1-CD2 4.04Å; V88-L90 HydrophobicContact CG1-CG 4.26Å; V88-L90 PolarHBondContact O-N 2.86Å; L90-K92 PolarHBondContact O-N 2.86Å
91	F	40.8	Very low	44.7	Very low	176 Å²	176	110.4 Å²	110.4	77%	0.772	62%	0.62	S	S	*	*			trans	-82.9	99.3	169.5	-68.8	-81.4	0	0	0	108.6	C89	C89-F91 HydrophobicContact CB-CE2 4.12Å
92	K	42.5	Very low	45.7	Very low	153 Å²	153	104.8 Å²	104.8	67%	0.665	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-83.3	126.2	169.9	-167.1	172.1	179.9	177.2	0	107.7	L90 A94	L90-K92 PolarHBondContact O-N 2.86Å; K92-A94 PolarHBondContact O-N 3.36Å
93	Q	39.1	Very low	46.7	Very low	175 Å²	175	104 Å²	104	82%	0.818	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-52.6	125	171.3	-172.3	173.5	17.4	0	0	108.7
94	A	44.6	Very low	47.9	Very low	68 Å²	68	98.7 Å²	98.7	56%	0.562	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-62.6	131.6	177.9	0	0	0	0	0	108.3	K92 S96	K92-A94 PolarHBondContact O-N 3.36Å; A94-S96 PolarHBondContact O-N 2.98Å
95	P	49	Very low	49.3	Very low	46 Å²	46	97.3 Å²	97.3	30%	0.299	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-52.7	139.6	172.6	-21.3	30	0	0	0	109.9	D97 S100 V101	P95-D97 PolarHBondContact O-N 3.16Å; P95-S100 WeakPolarHBondContact CB-OG 3.3Å; P95-V101 HydrophobicContact CB-CG2 4.19Å; P95-V101 HydrophobicContact CG-CG2 4.49Å; P95-V101 WeakPolarHBondContact O-CG2 3.43Å
96	S	48.7	Very low	50.6	Low	130 Å²	130	90.3 Å²	90.3	91%	0.909	52%	0.515	S	S	*	.	S	Bend	trans	-75.3	-12.8	175.1	54.9	0	0	0	0	112.7	A94	A94-S96 PolarHBondContact O-N 2.98Å
97	D	54.8	Low	52.3	Low	76 Å²	76	90 Å²	90	41%	0.406	51%	0.505	S	S	.	.	S	Bend	trans	-87.4	123.6	178.6	160	61.8	0	0	0	111.5	P95 V99 S100 V101	P95-D97 PolarHBondContact O-N 3.16Å; D97-V99 PolarHBondContact O-N 3.16Å; D97-V99 VanDerWaalsContact O-N 3.15Å; D97-V99 PolarHBondContact OD2-N 3.26Å; D97-S100 VanDerWaalsContact CB-OG 3.27Å; D97-S100 WeakPolarHBondContact CB-OG 3.48Å; D97-S100 PolarHBondContact O-N 3.38Å; D97-S100 PolarHBondContact O-OG 2.91Å; D97-S100 WeakPolarHBondContact OD2-CB 3.31Å; D97-S100 PolarHBondContact OD2-N 2.78Å; D97-S100 PolarHBondContact OD2-OG 3.35Å; D97-V101 WeakPolarHBondContact O-CG2 3.13Å; D97-V101 PolarHBondContact O-N 3.42Å
98	P	49.6	Very low	53.8	Low	101 Å²	101	86.2 Å²	86.2	66%	0.656	48%	0.476	S	S	*	.	H	α-helix	trans	-56.8	-31.9	-176.7	-26.8	34.3	0	0	0	114.9	L102	P98-L102 WeakPolarHBondContact O-CB 3.49Å; P98-L102 PolarHBondContact O-N 3.39Å; P98-L102 VanDerWaalsContact O-N 3.11Å
99	V	60.9	Low	55.7	Low	56 Å²	56	88.4 Å²	88.4	34%	0.339	49%	0.485	S	S	.	.	H	α-helix	trans	-73.5	-41.3	-178.7	179.9	0	0	0	0	110.7	D97 L102 N103	D97-V99 PolarHBondContact O-N 3.16Å; D97-V99 VanDerWaalsContact O-N 3.15Å; D97-V99 PolarHBondContact OD2-N 3.26Å; V99-L102 PolarHBondContact O-N 3.11Å; V99-N103 PolarHBondContact O-N 3.05Å; V99-N103 PolarHBondContact O-ND2 3.35Å
100	S	57	Low	57.1	Low	36 Å²	36	89 Å²	89	25%	0.252	48%	0.48	S	S	.	.	H	α-helix	trans	-70	-33.7	175.6	49.7	0	0	0	0	113.1	P95 D97 N103 W104	P95-S100 WeakPolarHBondContact CB-OG 3.3Å; D97-S100 VanDerWaalsContact CB-OG 3.27Å; D97-S100 WeakPolarHBondContact CB-OG 3.48Å; D97-S100 PolarHBondContact O-N 3.38Å; D97-S100 PolarHBondContact O-OG 2.91Å; D97-S100 WeakPolarHBondContact OD2-CB 3.31Å; D97-S100 PolarHBondContact OD2-N 2.78Å; D97-S100 PolarHBondContact OD2-OG 3.35Å; S100-N103 PolarHBondContact O-N 2.93Å; S100-W104 WeakPolarHBondContact O-CB 3.47Å; S100-W104 PolarHBondContact O-N 3.43Å
101	V	57.9	Low	58.6	Low	44 Å²	44	88.9 Å²	88.9	27%	0.267	48%	0.475	S	S	.	.	H	α-helix	trans	-61	-46.5	169.1	175.5	0	0	0	0	111	P95 D97 W104 L105	P95-V101 HydrophobicContact CB-CG2 4.19Å; P95-V101 HydrophobicContact CG-CG2 4.49Å; P95-V101 WeakPolarHBondContact O-CG2 3.43Å; D97-V101 WeakPolarHBondContact O-CG2 3.13Å; D97-V101 PolarHBondContact O-N 3.42Å; V101-W104 PolarHBondContact O-N 2.97Å; V101-L105 HydrophobicContact CG1-CD1 3.79Å; V101-L105 HydrophobicContact CG1-CG 4.47Å; V101-L105 WeakPolarHBondContact O-CB 3.35Å; V101-L105 WeakPolarHBondContact O-CG 3.44Å; V101-L105 PolarHBondContact O-N 2.83Å
102	L	65	Low	59.8	Low	93 Å²	93	87.6 Å²	87.6	49%	0.487	47%	0.466	S	S	.	.	H	α-helix	trans	-62.9	-43.6	179.4	-176	63.1	0	0	0	111.9	P98 V99 W104 L105 L106	P98-L102 WeakPolarHBondContact O-CB 3.49Å; P98-L102 PolarHBondContact O-N 3.39Å; P98-L102 VanDerWaalsContact O-N 3.11Å; V99-L102 PolarHBondContact O-N 3.11Å; L102-W104 VanDerWaalsContact C-N 3.33Å; L102-W104 PolarHBondContact O-N 3.34Å; L102-L105 PolarHBondContact O-N 3.48Å; L102-L106 VanDerWaalsContact O-CB 3.31Å; L102-L106 WeakPolarHBondContact O-CB 2.98Å; L102-L106 PolarHBondContact O-N 3.35Å
103	N	65.1	Low	60.8	Low	83 Å²	83	82.2 Å²	82.2	44%	0.444	45%	0.45	S	S	.	.	H	α-helix	trans	-63.9	-37.5	176.4	-74.9	-32.8	0	0	0	112.4	V99 S100 L106 S107	V99-N103 PolarHBondContact O-N 3.05Å; V99-N103 PolarHBondContact O-ND2 3.35Å; S100-N103 PolarHBondContact O-N 2.93Å; N103-L106 PolarHBondContact O-N 2.96Å; N103-S107 WeakPolarHBondContact O-CB 3.18Å; N103-S107 PolarHBondContact O-N 2.86Å
104	W	68.1	Low	61.8	Low	91 Å²	91	77.2 Å²	77.2	35%	0.345	43%	0.428	S	S	.	.	H	α-helix	trans	-68.6	-47.3	177.6	-174	73.3	0	0	0	112	S100 V101 L102 L106 S107 D108	S100-W104 WeakPolarHBondContact O-CB 3.47Å; S100-W104 PolarHBondContact O-N 3.43Å; V101-W104 PolarHBondContact O-N 2.97Å; L102-W104 VanDerWaalsContact C-N 3.33Å; L102-W104 PolarHBondContact O-N 3.34Å; W104-L106 VanDerWaalsContact C-N 3.27Å; W104-L106 PolarHBondContact O-N 3.35Å; W104-S107 PolarHBondContact O-N 2.89Å; W104-D108 WeakPolarHBondContact CH2-OD2 3.21Å; W104-D108 WeakPolarHBondContact CZ2-OD2 3.45Å; W104-D108 PolarHBondContact O-N 2.87Å
105	L	66.8	Low	62.4	Low	94 Å²	94	75.9 Å²	75.9	49%	0.492	42%	0.421	S	S	.	.	H	α-helix	trans	-57.6	-41.2	173.7	-76.8	163.8	0	0	0	111.7	V101 L102 D108 L109	V101-L105 HydrophobicContact CG1-CD1 3.79Å; V101-L105 HydrophobicContact CG1-CG 4.47Å; V101-L105 WeakPolarHBondContact O-CB 3.35Å; V101-L105 WeakPolarHBondContact O-CG 3.44Å; V101-L105 PolarHBondContact O-N 2.83Å; L102-L105 PolarHBondContact O-N 3.48Å; L105-D108 PolarHBondContact O-N 3.29Å; L105-L109 VanDerWaalsContact O-CB 3.24Å; L105-L109 WeakPolarHBondContact O-CB 3.41Å; L105-L109 PolarHBondContact O-N 2.81Å
106	L	66.5	Low	62.8	Low	50 Å²	50	79.7 Å²	79.7	26%	0.262	43%	0.433	S	S	.	.	H	α-helix	trans	-64.7	-45.2	177.4	-175	64	0	0	0	111.6	L102 N103 W104 D108 L109 Q110 M170	L102-L106 VanDerWaalsContact O-CB 3.31Å; L102-L106 WeakPolarHBondContact O-CB 2.98Å; L102-L106 PolarHBondContact O-N 3.35Å; N103-L106 PolarHBondContact O-N 2.96Å; W104-L106 VanDerWaalsContact C-N 3.27Å; W104-L106 PolarHBondContact O-N 3.35Å; L106-D108 VanDerWaalsContact C-N 3.34Å; L106-D108 PolarHBondContact O-N 3.11Å; L106-L109 PolarHBondContact O-N 2.78Å; L106-Q110 WeakPolarHBondContact O-CB 2.93Å; L106-Q110 VanDerWaalsContact O-CG 3.27Å; L106-Q110 WeakPolarHBondContact O-CG 3.44Å; L106-Q110 PolarHBondContact O-N 2.96Å; L106-M170 HydrophobicContact CD1-CE 4.46Å
107	S	72.4	Confident	63.3	Low	46 Å²	46	76.7 Å²	76.7	32%	0.322	41%	0.405	S	S	.	.	H	α-helix	trans	-61.7	-42.1	177.3	-175.7	0	0	0	0	112	N103 W104 Q110 K111	N103-S107 WeakPolarHBondContact O-CB 3.18Å; N103-S107 PolarHBondContact O-N 2.86Å; W104-S107 PolarHBondContact O-N 2.89Å; S107-Q110 PolarHBondContact O-N 3.04Å; S107-K111 WeakPolarHBondContact O-CG 3.35Å; S107-K111 PolarHBondContact O-N 3.21Å
108	D	68.9	Low	63.2	Low	29 Å²	29	79.6 Å²	79.6	16%	0.155	42%	0.415	C	S	.	.	H	α-helix	trans	-71.5	-41.7	179.5	-81	4.4	0	0	0	111.5	W104 L105 L106 Q110 K111 Y112	W104-D108 WeakPolarHBondContact CH2-OD2 3.21Å; W104-D108 WeakPolarHBondContact CZ2-OD2 3.45Å; W104-D108 PolarHBondContact O-N 2.87Å; L105-D108 PolarHBondContact O-N 3.29Å; L106-D108 VanDerWaalsContact C-N 3.34Å; L106-D108 PolarHBondContact O-N 3.11Å; D108-Q110 VanDerWaalsContact C-N 3.28Å; D108-Q110 PolarHBondContact O-N 3.33Å; D108-K111 WeakPolarHBondContact O-CB 3.2Å; D108-K111 PolarHBondContact O-N 3.37Å; D108-K111 VanDerWaalsContact O-N 3.11Å; D108-K111 IonicContact OD1-NZ 2.78Å; D108-K111 PolarHBondContact OD1-NZ 2.9Å; D108-Y112 HydrophobicContact CB-CE2 4.25Å; D108-Y112 WeakPolarHBondContact O-CD2 3.27Å; D108-Y112 PolarHBondContact O-N 3Å
109	L	75.6	Confident	63.4	Low	116 Å²	116	78.3 Å²	78.3	61%	0.607	41%	0.413	S	S	*	.	H	α-helix	trans	-58.7	-40.2	173.1	-174.7	63.8	0	0	0	111.9	L105 L106 Y112 A113	L105-L109 VanDerWaalsContact O-CB 3.24Å; L105-L109 WeakPolarHBondContact O-CB 3.41Å; L105-L109 PolarHBondContact O-N 2.81Å; L106-L109 PolarHBondContact O-N 2.78Å; L109-Y112 PolarHBondContact O-N 3.44Å; L109-A113 WeakPolarHBondContact O-CB 3.33Å; L109-A113 PolarHBondContact O-N 3.49Å
110	Q	67.3	Low	62.9	Low	83 Å²	83	82.3 Å²	82.3	39%	0.388	43%	0.432	S	S	.	.	H	α-helix	trans	-61.7	-43.6	173.7	-76.5	172.8	-16.9	0	0	112.1	L106 S107 D108 Y112 A113 L114	L106-Q110 WeakPolarHBondContact O-CB 2.93Å; L106-Q110 VanDerWaalsContact O-CG 3.27Å; L106-Q110 WeakPolarHBondContact O-CG 3.44Å; L106-Q110 PolarHBondContact O-N 2.96Å; S107-Q110 PolarHBondContact O-N 3.04Å; D108-Q110 VanDerWaalsContact C-N 3.28Å; D108-Q110 PolarHBondContact O-N 3.33Å; Q110-Y112 VanDerWaalsContact C-N 3.34Å; Q110-Y112 PolarHBondContact O-N 3.46Å; Q110-A113 PolarHBondContact O-N 3.32Å; Q110-L114 PolarHBondContact O-N 3.24Å
111	K	70.2	Confident	62.6	Low	121 Å²	121	84.2 Å²	84.2	53%	0.526	45%	0.446	S	S	.	.	H	α-helix	trans	-61.6	-42.5	175.5	-69.2	169	-160.8	156.3	0	111.8	S107 D108 L114 G115	S107-K111 WeakPolarHBondContact O-CG 3.35Å; S107-K111 PolarHBondContact O-N 3.21Å; D108-K111 WeakPolarHBondContact O-CB 3.2Å; D108-K111 PolarHBondContact O-N 3.37Å; D108-K111 VanDerWaalsContact O-N 3.11Å; D108-K111 IonicContact OD1-NZ 2.78Å; D108-K111 PolarHBondContact OD1-NZ 2.9Å; K111-L114 PolarHBondContact O-N 2.98Å; K111-G115 PolarHBondContact O-N 3.19Å
112	Y	66	Low	62.1	Low	149 Å²	149	87.1 Å²	87.1	58%	0.584	47%	0.465	S	S	*	.	H	α-helix	trans	-66.2	-43.6	176.8	-70.7	-63	0	0	0	111.5	D108 L109 Q110 L114 G115 F116	D108-Y112 HydrophobicContact CB-CE2 4.25Å; D108-Y112 WeakPolarHBondContact O-CD2 3.27Å; D108-Y112 PolarHBondContact O-N 3Å; L109-Y112 PolarHBondContact O-N 3.44Å; Q110-Y112 VanDerWaalsContact C-N 3.34Å; Q110-Y112 PolarHBondContact O-N 3.46Å; Y112-L114 VanDerWaalsContact C-N 3.28Å; Y112-L114 PolarHBondContact O-N 3.17Å; Y112-G115 CarbonylContact O-C 3.6Å; Y112-G115 PolarHBondContact O-N 3.5Å; Y112-G115 VanDerWaalsContact O-N 3.1Å; Y112-F116 WeakPolarHBondContact O-CD2 3.24Å; Y112-F116 WeakPolarHBondContact O-CG 3.2Å; Y112-F116 PolarHBondContact O-N 3.01Å
113	A	62.6	Low	61.1	Low	39 Å²	39	87.2 Å²	87.2	32%	0.322	47%	0.473	S	S	.	.	H	α-helix	trans	-57	-42.2	175.2	0	0	0	0	0	111.9	L109 Q110 F116 Q117	L109-A113 WeakPolarHBondContact O-CB 3.33Å; L109-A113 PolarHBondContact O-N 3.49Å; Q110-A113 PolarHBondContact O-N 3.32Å; A113-F116 PolarHBondContact O-N 2.98Å; A113-Q117 WeakPolarHBondContact O-CG 3.47Å; A113-Q117 PolarHBondContact O-N 3.2Å
114	L	60.6	Low	60	Low	71 Å²	71	89.8 Å²	89.8	37%	0.372	49%	0.492	S	S	.	.	H	α-helix	trans	-62.6	-46	173.9	-175.2	68.1	0	0	0	111.6	Q110 K111 Y112 F116 Q117 H118	Q110-L114 PolarHBondContact O-N 3.24Å; K111-L114 PolarHBondContact O-N 2.98Å; Y112-L114 VanDerWaalsContact C-N 3.28Å; Y112-L114 PolarHBondContact O-N 3.17Å; L114-F116 VanDerWaalsContact C-N 3.32Å; L114-F116 PolarHBondContact O-N 3.44Å; L114-Q117 WeakPolarHBondContact O-CB 3.45Å; L114-Q117 PolarHBondContact O-N 3Å; L114-H118 PolarHBondContact O-CD2 3.38Å; L114-H118 PolarHBondContact O-N 3.32Å
115	G	56.8	Low	58.8	Low	39 Å²	39	90.4 Å²	90.4	40%	0.402	51%	0.511	S	S	.	.	H	α-helix	trans	-59.2	-40.8	175.3	0	0	0	0	0	112.9	K111 Y112 H118 A119	K111-G115 PolarHBondContact O-N 3.19Å; Y112-G115 CarbonylContact O-C 3.6Å; Y112-G115 PolarHBondContact O-N 3.5Å; Y112-G115 VanDerWaalsContact O-N 3.1Å; G115-H118 PolarHBondContact O-N 3.49Å; G115-A119 WeakPolarHBondContact O-CB 2.93Å; G115-A119 PolarHBondContact O-N 3.49Å
116	F	58.9	Low	57.3	Low	126 Å²	126	90.6 Å²	90.6	55%	0.553	52%	0.516	S	S	*	.	H	α-helix	trans	-66.6	-38.3	175.2	-70.6	-60.3	0	0	0	112.1	Y112 A113 L114 H118 A119 L120	Y112-F116 WeakPolarHBondContact O-CD2 3.24Å; Y112-F116 WeakPolarHBondContact O-CG 3.2Å; Y112-F116 PolarHBondContact O-N 3.01Å; A113-F116 PolarHBondContact O-N 2.98Å; L114-F116 VanDerWaalsContact C-N 3.32Å; L114-F116 PolarHBondContact O-N 3.44Å; F116-H118 VanDerWaalsContact C-N 3.33Å; F116-H118 PolarHBondContact O-N 2.94Å; F116-A119 PolarHBondContact O-N 2.94Å; F116-L120 HydrophobicContact CB-CD1 4.37Å; F116-L120 WeakPolarHBondContact O-CB 3.39Å; F116-L120 WeakPolarHBondContact O-CG 3.11Å; F116-L120 PolarHBondContact O-N 3.47Å
117	Q	58.2	Low	55.7	Low	68 Å²	68	94.2 Å²	94.2	32%	0.318	54%	0.544	S	S	.	.	H	α-helix	trans	-60.9	-43.2	173.2	-73.3	-176.3	-14	0	0	111.5	A113 L114 A119 S121 Y147	A113-Q117 WeakPolarHBondContact O-CG 3.47Å; A113-Q117 PolarHBondContact O-N 3.2Å; L114-Q117 WeakPolarHBondContact O-CB 3.45Å; L114-Q117 PolarHBondContact O-N 3Å; Q117-A119 PolarHBondContact O-N 2.93Å; Q117-S121 WeakPolarHBondContact O-CA 3.34Å; Q117-S121 VanDerWaalsContact O-CB 3.31Å; Q117-S121 WeakPolarHBondContact O-CB 3.34Å; Q117-S121 PolarHBondContact O-N 2.97Å; Q117-Y147 PolarHBondContact NE2-O 3.36Å
118	H	53.5	Low	54	Low	136 Å²	136	100.2 Å²	100.2	63%	0.63	56%	0.564	S	S	*	*	H	α-helix	trans	-66.3	-34.8	176.2	-75	-67.3	0	0	0	113.5	L114 G115 F116	L114-H118 PolarHBondContact O-CD2 3.38Å; L114-H118 PolarHBondContact O-N 3.32Å; G115-H118 PolarHBondContact O-N 3.49Å; F116-H118 VanDerWaalsContact C-N 3.33Å; F116-H118 PolarHBondContact O-N 2.94Å
119	A	52.9	Low	52.2	Low	74 Å²	74	107.1 Å²	107.1	61%	0.612	60%	0.595	S	S	*	*	H	α-helix	trans	-76.4	-36.1	178	0	0	0	0	0	113.1	G115 F116 Q117	G115-A119 WeakPolarHBondContact O-CB 2.93Å; G115-A119 PolarHBondContact O-N 3.49Å; F116-A119 PolarHBondContact O-N 2.94Å; Q117-A119 PolarHBondContact O-N 2.93Å
120	L	51	Low	50.4	Low	140 Å²	140	110.8 Å²	110.8	73%	0.733	61%	0.606	S	S	*	*	H	α-helix	trans	-92.6	-22.2	-174.4	-62.4	174.5	0	0	0	113.3	F116 P122	F116-L120 HydrophobicContact CB-CD1 4.37Å; F116-L120 WeakPolarHBondContact O-CB 3.39Å; F116-L120 WeakPolarHBondContact O-CG 3.11Å; F116-L120 PolarHBondContact O-N 3.47Å; L120-P122 VanDerWaalsContact O-CD 3.3Å; L120-P122 WeakPolarHBondContact O-CD 3.03Å
121	S	50.9	Low	48.8	Very low	77 Å²	77	113.8 Å²	113.8	54%	0.538	63%	0.63	S	S	.	*			trans	-111.6	83	165.2	-61.4	0	0	0	0	108.1	Q117 S123	Q117-S121 WeakPolarHBondContact O-CA 3.34Å; Q117-S121 VanDerWaalsContact O-CB 3.31Å; Q117-S121 WeakPolarHBondContact O-CB 3.34Å; Q117-S121 PolarHBondContact O-N 2.97Å; S121-S123 PolarHBondContact O-N 3.28Å
122	P	46.1	Very low	47	Very low	105 Å²	105	111.5 Å²	111.5	68%	0.682	64%	0.641	S	S	*	*			trans	-67.6	74.2	161.7	29.9	-31.5	0	0	0	106.8	L120 T124	L120-P122 VanDerWaalsContact O-CD 3.3Å; L120-P122 WeakPolarHBondContact O-CD 3.03Å; P122-T124 PolarHBondContact O-N 2.93Å
123	S	44	Very low	45.6	Very low	94 Å²	94	111.8 Å²	111.8	66%	0.657	65%	0.652	S	S	*	*			trans	-53.9	130.4	163.1	-85.3	0	0	0	0	105.3	S121 S125	S121-S123 PolarHBondContact O-N 3.28Å; S123-S125 PolarHBondContact O-N 3.43Å
124	T	42.1	Very low	44.3	Very low	137 Å²	137	116.8 Å²	116.8	84%	0.84	68%	0.679	S	S	*	*			trans	-59.4	60.6	173.1	50.3	0	0	0	0	110.4	P122 T126	P122-T124 PolarHBondContact O-N 2.93Å; T124-T126 PolarHBondContact O-N 2.88Å
125	S	44.2	Very low	43.3	Very low	105 Å²	105	123 Å²	123	73%	0.734	71%	0.706	S	S	*	*			trans	-79.5	88	164.8	59.8	0	0	0	0	105	S123 C127	S123-S125 PolarHBondContact O-N 3.43Å; S125-C127 PolarHBondContact O-N 3.47Å
126	T	34.8	Very low	42.1	Very low	98 Å²	98	124.5 Å²	124.5	60%	0.601	72%	0.722	S	S	*	*			trans	-53.4	109.8	164.1	54.5	0	0	0	0	107	T124 K128	T124-T126 PolarHBondContact O-N 2.88Å; T126-K128 PolarHBondContact O-N 3.47Å; T126-K128 WeakPolarHBondContact OG1-CG 3.42Å
127	C	33.3	Very low	40.9	Very low	126 Å²	126	125.8 Å²	125.8	85%	0.851	73%	0.73	S	S	*	*			trans	-60.2	87.8	153.2	-178.8	0	0	0	0	106.1	S125 H129	S125-C127 PolarHBondContact O-N 3.47Å; C127-H129 PolarHBondContact O-N 3.13Å
128	K	35.6	Very low	39.6	Very low	172 Å²	172	133.4 Å²	133.4	75%	0.748	76%	0.757	S	S	*	*			trans	-80.8	95.2	172.6	-76.1	-84.8	-177.9	170.6	0	106.8	T126 K130	T126-K128 PolarHBondContact O-N 3.47Å; T126-K128 WeakPolarHBondContact OG1-CG 3.42Å; K128-K130 PolarHBondContact O-N 3.48Å
129	H	31.2	Very low	38.7	Very low	173 Å²	173	135.3 Å²	135.3	80%	0.801	77%	0.766	S	S	*	*			trans	-44.7	129	139.3	-118.4	96.6	0	0	0	107.7	C127 V131	C127-H129 PolarHBondContact O-N 3.13Å; H129-V131 PolarHBondContact O-N 2.86Å
130	K	39	Very low	37.5	Very low	193 Å²	193	142.8 Å²	142.8	84%	0.839	78%	0.778	S	S	*	*	S	Bend	trans	-54.4	127	169.7	-65.1	-100.3	-180	175.6	0	107.9	K128	K128-K130 PolarHBondContact O-N 3.48Å
131	V	33.8	Very low	36.8	Very low	147 Å²	147	141.2 Å²	141.2	89%	0.891	79%	0.785	S	S	*	*			trans	175	126.2	137.5	164.7	0	0	0	0	108.2	H129	H129-V131 PolarHBondContact O-N 2.86Å
132	G	30.8	Very low	36	Very low	72 Å²	72	142 Å²	142	74%	0.742	79%	0.791	S	S	*	*			trans	95.6	117.7	147.2	0	0	0	0	0	117.9
133	D	37.1	Very low	35.8	Very low	156 Å²	156	142.5 Å²	142.5	83%	0.834	80%	0.797	S	S	*	*			trans	-41.1	144.4	167.2	-88.5	-42.6	0	0	0	115
134	T	35	Very low	35.5	Very low	144 Å²	144	146.3 Å²	146.3	88%	0.883	80%	0.804	S	S	*	*				-178.3	135.1	116.9	22.9	0	0	0	0	111.6
135	E	39.9	Very low	35.2	Very low	200 Å²	200	144.7 Å²	144.7	94%	0.935	79%	0.79	S	S	*	*			trans	-61.6	148.1	177	-63.1	168.2	153.3	0	0	112.4
136	G	31.1	Very low	34.5	Very low	71 Å²	71	144.7 Å²	144.7	73%	0.732	79%	0.789	S	S	*	*			trans	171.2	84	175.7	0	0	0	0	0	113.3
137	E	35	Very low	34.6	Very low	154 Å²	154	147.7 Å²	147.7	72%	0.72	79%	0.791	S	S	*	*			trans	-58.5	123.9	169.5	-179.2	-179.1	-174.7	0	0	112.1	H139	E137-H139 IonicContact OE1-NE2 3.89Å
138	Y	29.4	Very low	34.9	Very low	228 Å²	228	144.8 Å²	144.8	89%	0.894	77%	0.772	S	S	*	*			trans	-150.4	118.6	149.5	-77.1	-67.6	0	0	0	110.5	R140	Y138-R140 PolarHBondContact O-N 3.31Å
139	H	35.3	Very low	35	Very low	175 Å²	175	141.1 Å²	141.1	81%	0.81	76%	0.764	S	S	*	*			trans	-61.3	126.6	171.2	-65.5	-75.6	0	0	0	111.4	E137	E137-H139 IonicContact OE1-NE2 3.89Å
140	R	27.2	Very low	35.4	Very low	231 Å²	231	139.8 Å²	139.8	87%	0.872	75%	0.753	S	S	*	*			trans	-131.4	107.4	155.4	-157.9	176.2	-154.2	-159.6	5	108.3	Y138 S142	Y138-R140 PolarHBondContact O-N 3.31Å; R140-S142 VanDerWaalsContact C-N 3.35Å; R140-S142 PolarHBondContact O-N 2.88Å
141	A	37	Very low	35.6	Very low	107 Å²	107	131.9 Å²	131.9	88%	0.884	72%	0.724	S	S	*	*			trans	-59.3	97.4	169.2	0	0	0	0	0	108.9
142	S	34.8	Very low	36	Very low	93 Å²	93	130.4 Å²	130.4	65%	0.65	71%	0.711	S	S	*	*			trans	-86.2	114.8	162.5	49.2	0	0	0	0	107.4	R140 E144	R140-S142 VanDerWaalsContact C-N 3.35Å; R140-S142 PolarHBondContact O-N 2.88Å; S142-E144 VanDerWaalsContact C-N 3.29Å; S142-E144 PolarHBondContact O-N 3.32Å
143	S	42	Very low	36.5	Very low	117 Å²	117	133.4 Å²	133.4	82%	0.818	71%	0.705	S	S	*	*			trans	-54.5	94.9	164.4	168.2	0	0	0	0	108.8	N145	S143-N145 PolarHBondContact O-N 3.4Å
144	E	37.7	Very low	36.7	Very low	173 Å²	173	129 Å²	129	81%	0.808	68%	0.684	S	S	*	*			trans	-72.6	81.8	169.5	-75.8	-179.6	155.6	0	0	108.3	S142 C146	S142-E144 VanDerWaalsContact C-N 3.29Å; S142-E144 PolarHBondContact O-N 3.32Å; E144-C146 PolarHBondContact O-N 2.88Å
145	N	35	Very low	36.9	Very low	103 Å²	103	126.3 Å²	126.3	55%	0.551	66%	0.664	S	S	*	*			trans	-93.1	66.2	160.5	-149.7	14.8	0	0	0	107.9	S143 Y147	S143-N145 PolarHBondContact O-N 3.4Å; N145-Y147 HydrophobicContact CB-CE2 4.37Å; N145-Y147 VanDerWaalsContact ND2-CE2 3.33Å; N145-Y147 WeakPolarHBondContact ND2-CE2 3.23Å; N145-Y147 VanDerWaalsContact ND2-CZ 3.32Å; N145-Y147 PolarHBondContact ND2-OH 3.39Å; N145-Y147 PolarHBondContact O-N 3.33Å
146	C	29.7	Very low	37	Very low	105 Å²	105	119.7 Å²	119.7	71%	0.709	63%	0.634	S	S	*	*			trans	-82	98.2	175	-169.3	0	0	0	0	107.7	E144 S148	E144-C146 PolarHBondContact O-N 2.88Å; C146-S148 PolarHBondContact O-N 2.89Å; C146-S148 VanDerWaalsContact O-N 3.11Å
147	Y	35.9	Very low	37.5	Very low	161 Å²	161	121.7 Å²	121.7	63%	0.631	63%	0.629	S	S	*	*			trans	-76.2	97	171.8	-66.6	-80.4	0	0	0	108.6	Q117 N145 V149	Q117-Y147 PolarHBondContact NE2-O 3.36Å; N145-Y147 HydrophobicContact CB-CE2 4.37Å; N145-Y147 VanDerWaalsContact ND2-CE2 3.33Å; N145-Y147 WeakPolarHBondContact ND2-CE2 3.23Å; N145-Y147 VanDerWaalsContact ND2-CZ 3.32Å; N145-Y147 PolarHBondContact ND2-OH 3.39Å; N145-Y147 PolarHBondContact O-N 3.33Å; Y147-V149 PolarHBondContact O-N 3.44Å
148	S	41	Very low	37.9	Very low	66 Å²	66	120.6 Å²	120.6	46%	0.462	62%	0.619	S	S	.	*			trans	-74.7	108.9	168.8	63.6	0	0	0	0	108.9	C146 Y150	C146-S148 PolarHBondContact O-N 2.89Å; C146-S148 VanDerWaalsContact O-N 3.11Å; S148-Y150 PolarHBondContact O-N 3.13Å
149	V	37	Very low	38.6	Very low	95 Å²	95	116.4 Å²	116.4	58%	0.576	61%	0.611	S	S	*	*			trans	-84.7	62.2	176.4	-171.1	0	0	0	0	108.5	Y147	Y147-V149 PolarHBondContact O-N 3.44Å
150	Y	39.8	Very low	38.9	Very low	145 Å²	145	115.4 Å²	115.4	57%	0.569	61%	0.609	S	S	*	*			trans	-99.2	124.5	166.9	-63.3	-71.3	0	0	0	107.9	S148	S148-Y150 PolarHBondContact O-N 3.13Å
151	A	43.3	Very low	39.6	Very low	27 Å²	27	112 Å²	112	22%	0.223	61%	0.607	C	S	.	*			trans	-96.3	112.3	162.9	0	0	0	0	0	107	Q153 M170	A151-Q153 VanDerWaalsContact C-N 3.32Å; A151-M170 HydrophobicContact CB-CE 3.29Å; A151-M170 HydrophobicContact CB-CG 3.5Å; A151-M170 HydrophobicContact CB-SD 4.17Å
152	D	41.9	Very low	39.7	Very low	116 Å²	116	116.3 Å²	116.3	62%	0.62	60%	0.601	S	S	*	*	S	Bend	trans	-77.7	-22.7	179.6	-76.3	-20.8	0	0	0	111.7	A173	D152-A173 WeakPolarHBondContact OD2-CB 3.43Å
153	Q	40.8	Very low	40.2	Very low	134 Å²	134	117.9 Å²	117.9	63%	0.626	61%	0.609	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-148.2	128.9	-179.3	-158.7	81.7	40.3	0	0	110.9	A151	A151-Q153 VanDerWaalsContact C-N 3.32Å
154	V	41.3	Very low	40.3	Very low	63 Å²	63	119.1 Å²	119.1	38%	0.382	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.7	118.6	166.5	-97.5	0	0	0	0	107.8	M170	V154-M170 HydrophobicContact CG1-CG 4.25Å
155	N	39.8	Very low	40.4	Very low	88 Å²	88	117.6 Å²	117.6	47%	0.471	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.7	123.9	173.3	-171.1	21.5	0	0	0	108.9
156	I	43.2	Very low	40.7	Very low	61 Å²	61	118.9 Å²	118.9	31%	0.313	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.4	96.1	176.7	-56.4	-178.8	0	0	0	107.1	Y158 L168	I156-Y158 HydrophobicContact CG2-CD2 3.8Å; I156-Y158 HydrophobicContact CG2-CE2 3.52Å; I156-Y158 PolarHBondContact O-N 3.42Å; I156-L168 HydrophobicContact CD1-CD1 4.27Å; I156-L168 HydrophobicContact CG1-CD1 4.06Å
157	D	40.3	Very low	41.2	Very low	114 Å²	114	122.3 Å²	122.3	61%	0.61	60%	0.603	S	S	*	*			trans	-80.7	104.1	175.1	-91.9	-36.4	0	0	0	110.2	L159	D157-L159 PolarHBondContact O-N 3.13Å
158	Y	43.9	Very low	41.4	Very low	130 Å²	130	120 Å²	120	51%	0.51	60%	0.602	S	S	.	*			trans	-81.6	84.7	162.6	-80.9	-91.2	0	0	0	108.9	I156 M160 L166	I156-Y158 HydrophobicContact CG2-CD2 3.8Å; I156-Y158 HydrophobicContact CG2-CE2 3.52Å; I156-Y158 PolarHBondContact O-N 3.42Å; Y158-M160 PolarHBondContact O-N 3.38Å; Y158-L166 HydrophobicContact CE1-CD2 4.15Å
159	L	44.7	Very low	41.4	Very low	141 Å²	141	121.1 Å²	121.1	74%	0.738	60%	0.599	S	S	*	*			trans	-73.4	95.4	172.5	-163.5	73.1	0	0	0	108.8	D157 N161	D157-L159 PolarHBondContact O-N 3.13Å; L159-N161 PolarHBondContact O-N 3.35Å
160	M	40.2	Very low	41.5	Very low	154 Å²	154	120.9 Å²	120.9	76%	0.759	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	17.1	-172.1	-71.6	-64.4	-177.9	0	0	116.5	Y158	Y158-M160 PolarHBondContact O-N 3.38Å
161	N	42.7	Very low	41.6	Very low	158 Å²	158	117.6 Å²	117.6	85%	0.845	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.2	23.8	-176.9	-78	-49.2	0	0	0	115.5	L159	L159-N161 PolarHBondContact O-N 3.35Å
162	R	38.1	Very low	41.5	Very low	198 Å²	198	119.5 Å²	119.5	75%	0.747	60%	0.604	S	S	*	*			trans	-152.5	137.2	169	-144	178.1	-161	-147.9	3.6	113.4	Q164	R162-Q164 PolarHBondContact O-N 3.3Å
163	P	46.2	Very low	41.7	Very low	127 Å²	127	117 Å²	117	83%	0.825	60%	0.599	S	S	*	*	S	Bend	trans	-78.5	20.9	-169	-11.2	28.3	0	0	0	115.7
164	Q	44.5	Very low	41.8	Very low	142 Å²	142	119 Å²	119	66%	0.664	61%	0.606	S	S	*	*	S	Bend	trans	-144.4	124.9	-168.3	-59.6	-177.5	8.9	0	0	112.1	R162	R162-Q164 PolarHBondContact O-N 3.3Å
165	N	38.8	Very low	42	Very low	141 Å²	141	123.2 Å²	123.2	75%	0.754	63%	0.627	S	S	*	*			trans	90.8	88.7	165.6	-47	-69.9	0	0	0	115.6	R167	N165-R167 VanDerWaalsContact C-N 3.33Å; N165-R167 PolarHBondContact O-N 3.43Å
166	L	41.9	Very low	41.9	Very low	130 Å²	130	123.2 Å²	123.2	68%	0.681	63%	0.63	S	S	*	*			trans	-64.3	99.1	149.9	-77.7	160.7	0	0	0	107.1	Y158 L168	Y158-L166 HydrophobicContact CE1-CD2 4.15Å; L166-L168 PolarHBondContact O-N 3.42Å
167	R	40.3	Very low	41.8	Very low	177 Å²	177	126.9 Å²	126.9	67%	0.668	65%	0.65	S	S	*	*			trans	-89.7	98.4	175.8	-179.5	177	162.9	168.4	-4.2	107.9	N165 E169	N165-R167 VanDerWaalsContact C-N 3.33Å; N165-R167 PolarHBondContact O-N 3.43Å; R167-E169 IonicContact CZ-OE2 3.34Å; R167-E169 IonicContact NE-OE2 3.16Å; R167-E169 PolarHBondContact NE-OE2 3.19Å; R167-E169 VanDerWaalsContact NE-OE2 3.16Å; R167-E169 IonicContact NH2-OE1 3.97Å; R167-E169 IonicContact NH2-OE2 2.76Å; R167-E169 PolarHBondContact NH2-OE2 3.15Å; R167-E169 PolarHBondContact O-N 3.05Å
168	L	39.9	Very low	41.8	Very low	114 Å²	114	128.2 Å²	128.2	60%	0.597	66%	0.657	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.1	110.6	172.9	-169.6	70.8	0	0	0	108.9	I156 L166	I156-L168 HydrophobicContact CD1-CD1 4.27Å; I156-L168 HydrophobicContact CG1-CD1 4.06Å; L166-L168 PolarHBondContact O-N 3.42Å
169	E	41.6	Very low	41.8	Very low	88 Å²	88	129.9 Å²	129.9	41%	0.411	68%	0.675	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.7	121.5	177.5	-166.2	162.3	163.1	0	0	109.2	R167	R167-E169 IonicContact CZ-OE2 3.34Å; R167-E169 IonicContact NE-OE2 3.16Å; R167-E169 PolarHBondContact NE-OE2 3.19Å; R167-E169 VanDerWaalsContact NE-OE2 3.16Å; R167-E169 IonicContact NH2-OE1 3.97Å; R167-E169 IonicContact NH2-OE2 2.76Å; R167-E169 PolarHBondContact NH2-OE2 3.15Å; R167-E169 PolarHBondContact O-N 3.05Å
170	M	38.9	Very low	41.5	Very low	90 Å²	90	132.1 Å²	132.1	44%	0.443	68%	0.682	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.4	108.6	-176.3	-163.9	159.2	174.9	0	0	108.1	L106 A151 V154	L106-M170 HydrophobicContact CD1-CE 4.46Å; A151-M170 HydrophobicContact CB-CE 3.29Å; A151-M170 HydrophobicContact CB-CG 3.5Å; A151-M170 HydrophobicContact CB-SD 4.17Å; V154-M170 HydrophobicContact CG1-CG 4.25Å
171	T	41.6	Very low	41.3	Very low	76 Å²	76	130.3 Å²	130.3	47%	0.466	68%	0.684	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.5	119.7	178.5	46	0	0	0	0	109.1
172	A	40.7	Very low	41.2	Very low	67 Å²	67	129.1 Å²	129.1	55%	0.554	69%	0.685	S	S	*	*			trans	-86.8	128.6	166	0	0	0	0	0	107.9	K174	A172-K174 PolarHBondContact O-N 2.83Å
173	A	45.5	Very low	41.2	Very low	63 Å²	63	125 Å²	125	52%	0.521	69%	0.687	S	S	.	*			trans	-64.5	101.2	169.2	0	0	0	0	0	107.8	D152 N175	D152-A173 WeakPolarHBondContact OD2-CB 3.43Å; A173-N175 PolarHBondContact O-N 2.81Å
174	K	44.1	Very low	40.7	Very low	177 Å²	177	123.3 Å²	123.3	77%	0.77	68%	0.683	S	S	*	*			trans	-67.4	104.4	168.5	-148.8	-178.7	-177.1	177.6	0	105.6	A172 T176	A172-K174 PolarHBondContact O-N 2.83Å; K174-T176 HydrophobicContact CD-CG2 4.13Å; K174-T176 HydrophobicContact CG-CG2 4.09Å; K174-T176 PolarHBondContact O-N 2.86Å
175	N	45.8	Very low	40.5	Very low	152 Å²	152	122.3 Å²	122.3	81%	0.813	69%	0.689	S	S	*	*			trans	-67	86.9	165	-175.3	-11.8	0	0	0	107.4	A173	A173-N175 PolarHBondContact O-N 2.81Å
176	T	37.4	Very low	40.4	Very low	87 Å²	87	121.9 Å²	121.9	53%	0.534	69%	0.694	S	S	.	*			trans	-110.6	108.2	158.1	53.6	0	0	0	0	106.2	K174 N178	K174-T176 HydrophobicContact CD-CG2 4.13Å; K174-T176 HydrophobicContact CG-CG2 4.09Å; K174-T176 PolarHBondContact O-N 2.86Å; T176-N178 PolarHBondContact O-N 3.46Å
177	N	40.2	Very low	40	Very low	139 Å²	139	120.4 Å²	120.4	74%	0.743	70%	0.701	S	S	*	*			trans	-59.4	71.3	160.7	66.1	-18.2	0	0	0	110.5
178	N	40.2	Very low	40	Very low	141 Å²	141	121.8 Å²	121.8	75%	0.754	71%	0.711	S	S	*	*			trans	-148.6	122.5	156.1	-96.4	-29.9	0	0	0	109.7	T176 Q180	T176-N178 PolarHBondContact O-N 3.46Å; N178-Q180 PolarHBondContact O-N 3.2Å
179	N	43.6	Very low	39.6	Very low	166 Å²	166	122 Å²	122	89%	0.888	72%	0.72	S	S	*	*			trans	-61	98.1	177.6	-57.3	-57.2	0	0	0	109.5
180	Q	39.8	Very low	39.4	Very low	188 Å²	188	123.9 Å²	123.9	88%	0.879	74%	0.74	S	S	*	*			trans	-155.1	108.2	156.2	-127.9	165.2	-5.8	0	0	110.4	N178	N178-Q180 PolarHBondContact O-N 3.2Å
181	S	36.3	Very low	39.5	Very low	116 Å²	116	124.8 Å²	124.8	81%	0.811	76%	0.755	S	S	*	*			trans	-55.3	137.9	172.6	-46.3	0	0	0	0	110.7	S183	S181-S183 PolarHBondContact O-N 2.97Å
182	P	39.2	Very low	39.2	Very low	132 Å²	132	126.9 Å²	126.9	86%	0.857	77%	0.767	S	S	*	*			trans	-87.4	111.5	172.8	26.3	-17.9	0	0	0	110
183	S	39.1	Very low	38.9	Very low	113 Å²	113	133 Å²	133	79%	0.79	79%	0.785	S	S	*	*			trans	-89.6	147.2	155	80.4	0	0	0	0	109.4	S181	S181-S183 PolarHBondContact O-N 2.97Å
184	A	35.7	Very low	38.8	Very low	91 Å²	91	142.1 Å²	142.1	75%	0.752	81%	0.805	S	S	*	*			trans	94.3	129.8	169.7	0	0	0	0	0	118.6
185	P	39.6	Very low	38.2	Very low	121 Å²	121	138.1 Å²	138.1	79%	0.786	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-87.4	146.6	178.2	33.9	-32.1	0	0	0	112.7
186	P	37.1	Very low	37.7	Very low	131 Å²	131	137.7 Å²	137.7	85%	0.851	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-83.1	147.1	174.7	31.3	-30.5	0	0	0	112.9
187	A	32.7	Very low	37.6	Very low	100 Å²	100	141 Å²	141	83%	0.826	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-71.8	156.3	-168.9	0	0	0	0	0	115.7
188	K	40.8	Very low	37.3	Very low	206 Å²	206	139.6 Å²	139.6	90%	0.896	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-57.2	143.2	175.3	-67.9	172.1	175.8	173.9	0	113
189	P	31.5	Very low	37.8	Very low	118 Å²	118	137.5 Å²	137.5	77%	0.766	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-84.8	157.6	162.6	33.5	-30.5	0	0	0	112
190	P	36.9	Very low	37.4	Very low	128 Å²	128	137.3 Å²	137.3	83%	0.831	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-80.2	140.9	-166.1	31	-32.9	0	0	0	113.8
191	S	42.4	Very low	38.1	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-58	134.3	163.8	165.9	0	0	0	0	111.4
192	T	34.7	Very low	38.3	Very low	119 Å²	119	135.1 Å²	135.1	73%	0.73	81%	0.811	S	S	*	*				160.8	109	121.9	-63.9	0	0	0	0	109.7
193	Q	34.8	Very low	38.6	Very low	197 Å²	197	135.1 Å²	135.1	92%	0.921	81%	0.813	S	S	*	*			trans	-158.9	123.6	135.9	-107.5	173.2	47.5	0	0	109.1	A195	Q193-A195 PolarHBondContact O-N 3.35Å
194	R	42.4	Very low	39.2	Very low	253 Å²	253	132.2 Å²	132.2	96%	0.955	79%	0.793	S	S	*	*			trans	-76.3	114.4	-176.2	-154.2	-177.2	-152.1	162.9	3.2	107.1
195	A	32.2	Very low	40.1	Very low	94 Å²	94	134.4 Å²	134.4	78%	0.777	79%	0.791	S	S	*	*			trans	-122.2	131	166.2	0	0	0	0	0	108.7	Q193	Q193-A195 PolarHBondContact O-N 3.35Å
196	V	34.7	Very low	41.2	Very low	143 Å²	143	134.3 Å²	134.3	87%	0.867	78%	0.783	S	S	*	*			trans	-61.9	134.9	-167.6	171.6	0	0	0	0	110.8	S198	V196-S198 PolarHBondContact O-N 3.11Å
197	I	36.8	Very low	42.8	Very low	156 Å²	156	132.1 Å²	132.1	80%	0.8	77%	0.765	S	S	*	*			trans	-69.5	123.7	173.7	-59.4	165.7	0	0	0	107.6
198	S	33.5	Very low	45.1	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	76%	0.755	S	S	*	*			trans	-119	125.7	153	-155.5	0	0	0	0	107.1	V196	V196-S198 PolarHBondContact O-N 3.11Å
199	P	50.2	Low	46.7	Very low	96 Å²	96	125.9 Å²	125.9	62%	0.623	73%	0.73	S	S	*	*			trans	-81.7	126.8	172.6	32.9	-26	0	0	0	107.4
200	D	35.8	Very low	49.1	Very low	163 Å²	163	125.7 Å²	125.7	87%	0.872	72%	0.718	S	S	*	*				176.1	132.3	129.9	-84.7	-23.3	0	0	0	108.4
201	G	53	Low	51.2	Low	72 Å²	72	126.5 Å²	126.5	74%	0.742	71%	0.705	S	S	*	*			trans	-74.8	129.5	-170.7	0	0	0	0	0	111.8
202	E	41.9	Very low	53	Low	185 Å²	185	125.2 Å²	125.2	86%	0.864	69%	0.693	S	S	*	*			trans	-179.4	120.2	148.3	-99	160.8	-159.6	0	0	105.8	S204	E202-S204 VanDerWaalsContact C-N 3.31Å; E202-S204 PolarHBondContact O-N 3.46Å
203	C	44.8	Very low	55.3	Low	133 Å²	133	124.4 Å²	124.4	90%	0.899	68%	0.684	S	S	*	*			trans	-68.8	96.4	168.6	-79.2	0	0	0	0	107.1
204	S	52.5	Low	57.8	Low	52 Å²	52	123 Å²	123	36%	0.364	67%	0.67	S	S	.	*			trans	-67.4	146.1	-177.6	71.8	0	0	0	0	110.2	E202 D206 D207	E202-S204 VanDerWaalsContact C-N 3.31Å; E202-S204 PolarHBondContact O-N 3.46Å; S204-D206 PolarHBondContact O-N 3.29Å; S204-D207 PolarHBondContact O-N 2.84Å
205	I	53.8	Low	59.8	Low	137 Å²	137	116.4 Å²	116.4	70%	0.703	65%	0.653	S	S	*	*	H	α-helix	trans	-52.7	-24	176.3	-78	157.4	0	0	0	112.2	S209	I205-S209 WeakPolarHBondContact O-CB 3.27Å; I205-S209 PolarHBondContact O-N 2.84Å; I205-S209 PolarHBondContact O-OG 2.91Å
206	D	62.3	Low	62	Low	119 Å²	119	114.7 Å²	114.7	64%	0.636	64%	0.636	S	S	*	*	H	α-helix	trans	-67.3	-33.9	177.5	-64	-35.1	0	0	0	112.8	S204 F210	S204-D206 PolarHBondContact O-N 3.29Å; D206-F210 VanDerWaalsContact O-CB 3.31Å; D206-F210 WeakPolarHBondContact O-CB 3.49Å; D206-F210 PolarHBondContact O-N 3.35Å
207	D	71.9	Confident	64.6	Low	85 Å²	85	110.7 Å²	110.7	46%	0.455	61%	0.614	S	S	.	*	H	α-helix	trans	-71	-44.2	177.5	-77	-21.4	0	0	0	111	S204 S209 F210 Y211	S204-D207 PolarHBondContact O-N 2.84Å; D207-S209 VanDerWaalsContact C-N 3.34Å; D207-S209 PolarHBondContact O-N 3.43Å; D207-F210 WeakPolarHBondContact O-CB 3.31Å; D207-F210 PolarHBondContact O-N 2.84Å; D207-Y211 HydrophobicContact CB-CE2 4.49Å; D207-Y211 WeakPolarHBondContact O-CD2 3.48Å; D207-Y211 PolarHBondContact O-N 2.82Å
208	L	79.8	Confident	67	Low	121 Å²	121	107.4 Å²	107.4	63%	0.634	60%	0.598	S	S	*	*	H	α-helix	trans	-62.8	-43.6	176.2	-176.1	61.4	0	0	0	111	F210 Y211 V212	L208-F210 VanDerWaalsContact C-N 3.3Å; L208-F210 PolarHBondContact O-N 3.29Å; L208-Y211 PolarHBondContact O-N 2.85Å; L208-V212 HydrophobicContact CD1-CG2 4.35Å; L208-V212 HydrophobicContact CG-CG2 4.43Å; L208-V212 WeakPolarHBondContact O-CB 3.43Å; L208-V212 VanDerWaalsContact O-CG2 3.27Å; L208-V212 WeakPolarHBondContact O-CG2 3.31Å; L208-V212 PolarHBondContact O-N 3.31Å
209	S	74.9	Confident	69.5	Low	53 Å²	53	106 Å²	106	37%	0.371	58%	0.584	S	S	.	*	H	α-helix	trans	-61.8	-38.4	176.2	-59.3	0	0	0	0	111.8	I205 D207 N213	I205-S209 WeakPolarHBondContact O-CB 3.27Å; I205-S209 PolarHBondContact O-N 2.84Å; I205-S209 PolarHBondContact O-OG 2.91Å; D207-S209 VanDerWaalsContact C-N 3.34Å; D207-S209 PolarHBondContact O-N 3.43Å; S209-N213 WeakPolarHBondContact O-CB 3.35Å; S209-N213 VanDerWaalsContact O-CG 3.29Å; S209-N213 PolarHBondContact O-N 3Å; S209-N213 PolarHBondContact O-ND2 3.35Å
210	F	81.2	Confident	71.2	Confident	114 Å²	114	105.4 Å²	105.4	50%	0.5	58%	0.575	S	S	.	*	H	α-helix	trans	-62.5	-46.7	174.4	173.4	-97.9	0	0	0	112.2	D206 D207 L208 N213 R214	D206-F210 VanDerWaalsContact O-CB 3.31Å; D206-F210 WeakPolarHBondContact O-CB 3.49Å; D206-F210 PolarHBondContact O-N 3.35Å; D207-F210 WeakPolarHBondContact O-CB 3.31Å; D207-F210 PolarHBondContact O-N 2.84Å; L208-F210 VanDerWaalsContact C-N 3.3Å; L208-F210 PolarHBondContact O-N 3.29Å; F210-N213 PolarHBondContact O-N 3.32Å; F210-R214 VanDerWaalsContact O-CB 3.28Å; F210-R214 WeakPolarHBondContact O-CB 3.39Å; F210-R214 PolarHBondContact O-N 3.44Å
211	Y	81.3	Confident	73.5	Confident	146 Å²	146	103.9 Å²	103.9	57%	0.573	56%	0.563	S	S	*	*	H	α-helix	trans	-67.7	-41.2	178.6	-71.1	-67.9	0	0	0	112.4	D207 L208 R214 L215	D207-Y211 HydrophobicContact CB-CE2 4.49Å; D207-Y211 WeakPolarHBondContact O-CD2 3.48Å; D207-Y211 PolarHBondContact O-N 2.82Å; L208-Y211 PolarHBondContact O-N 2.85Å; Y211-R214 PolarHBondContact O-N 3.34Å; Y211-L215 WeakPolarHBondContact O-CB 3.2Å; Y211-L215 PolarHBondContact O-N 2.92Å
212	V	80.3	Confident	75	Confident	82 Å²	82	105.4 Å²	105.4	50%	0.497	55%	0.552	S	S	.	*	H	α-helix	trans	-62.8	-45.7	175.8	171.1	0	0	0	0	110.7	L208 R214 L215 S216	L208-V212 HydrophobicContact CD1-CG2 4.35Å; L208-V212 HydrophobicContact CG-CG2 4.43Å; L208-V212 WeakPolarHBondContact O-CB 3.43Å; L208-V212 VanDerWaalsContact O-CG2 3.27Å; L208-V212 WeakPolarHBondContact O-CG2 3.31Å; L208-V212 PolarHBondContact O-N 3.31Å; V212-R214 VanDerWaalsContact C-N 3.32Å; V212-R214 PolarHBondContact O-N 3.26Å; V212-L215 PolarHBondContact O-N 2.55Å; V212-S216 WeakPolarHBondContact O-CB 3.14Å; V212-S216 PolarHBondContact O-N 3.01Å
213	N	83.7	Confident	76.7	Confident	102 Å²	102	98.6 Å²	98.6	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-63.9	-38.2	177.2	-81.1	-27.4	0	0	0	112.3	S209 F210 S217	S209-N213 WeakPolarHBondContact O-CB 3.35Å; S209-N213 VanDerWaalsContact O-CG 3.29Å; S209-N213 PolarHBondContact O-N 3Å; S209-N213 PolarHBondContact O-ND2 3.35Å; F210-N213 PolarHBondContact O-N 3.32Å; N213-S217 VanDerWaalsContact O-CB 3.26Å; N213-S217 WeakPolarHBondContact O-CB 3.34Å; N213-S217 PolarHBondContact O-N 2.99Å; N213-S217 PolarHBondContact O-OG 3.14Å
214	R	86.6	Confident	78.2	Confident	166 Å²	166	98.2 Å²	98.2	63%	0.626	51%	0.512	S	S	*	.	H	α-helix	trans	-68.9	-41.4	177.7	-170.8	170.7	177.5	-158.4	-2	112	F210 Y211 V212 L218	F210-R214 VanDerWaalsContact O-CB 3.28Å; F210-R214 WeakPolarHBondContact O-CB 3.39Å; F210-R214 PolarHBondContact O-N 3.44Å; Y211-R214 PolarHBondContact O-N 3.34Å; V212-R214 VanDerWaalsContact C-N 3.32Å; V212-R214 PolarHBondContact O-N 3.26Å; R214-L218 WeakPolarHBondContact O-CB 3.26Å; R214-L218 PolarHBondContact O-N 3.31Å
215	L	84.4	Confident	79.7	Confident	115 Å²	115	101.9 Å²	101.9	60%	0.602	52%	0.521	S	S	*	.	H	α-helix	trans	-67.4	-45.4	176.2	-168.3	71	0	0	0	111	Y211 V212 S217 L218 V219	Y211-L215 WeakPolarHBondContact O-CB 3.2Å; Y211-L215 PolarHBondContact O-N 2.92Å; V212-L215 PolarHBondContact O-N 2.55Å; L215-S217 VanDerWaalsContact C-N 3.35Å; L215-S217 PolarHBondContact O-N 2.92Å; L215-L218 PolarHBondContact O-N 3.25Å; L215-V219 WeakPolarHBondContact O-CG2 3.25Å; L215-V219 PolarHBondContact O-N 3.43Å
216	S	79.5	Confident	80.8	Confident	58 Å²	58	100.7 Å²	100.7	41%	0.406	51%	0.513	S	S	.	.	H	α-helix	trans	-56	-49	174.2	-179.9	0	0	0	0	111.3	V212 L218 V219 I220	V212-S216 WeakPolarHBondContact O-CB 3.14Å; V212-S216 PolarHBondContact O-N 3.01Å; S216-L218 VanDerWaalsContact C-N 3.31Å; S216-L218 PolarHBondContact O-N 2.86Å; S216-V219 PolarHBondContact O-N 3.39Å; S216-I220 VanDerWaalsContact O-CG1 3.26Å; S216-I220 WeakPolarHBondContact O-CG1 3.35Å; S216-I220 PolarHBondContact O-N 3.17Å
217	S	88.2	Confident	81.4	Confident	60 Å²	60	100.2 Å²	100.2	42%	0.42	51%	0.509	S	S	.	.	H	α-helix	trans	-59.6	-40.4	177.1	-62.5	0	0	0	0	112.5	N213 L215 Q221	N213-S217 VanDerWaalsContact O-CB 3.26Å; N213-S217 WeakPolarHBondContact O-CB 3.34Å; N213-S217 PolarHBondContact O-N 2.99Å; N213-S217 PolarHBondContact O-OG 3.14Å; L215-S217 VanDerWaalsContact C-N 3.35Å; L215-S217 PolarHBondContact O-N 2.92Å; S217-Q221 WeakPolarHBondContact O-CB 2.87Å; S217-Q221 VanDerWaalsContact O-CG 3.27Å; S217-Q221 WeakPolarHBondContact O-CG 3.29Å; S217-Q221 PolarHBondContact O-N 3.45Å
218	L	88.4	Confident	81.7	Confident	87 Å²	87	102.4 Å²	102.4	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-67.7	-43.5	178.2	-177.3	63.3	0	0	0	111.8	R214 L215 S216 Q221 M222	R214-L218 WeakPolarHBondContact O-CB 3.26Å; R214-L218 PolarHBondContact O-N 3.31Å; L215-L218 PolarHBondContact O-N 3.25Å; S216-L218 VanDerWaalsContact C-N 3.31Å; S216-L218 PolarHBondContact O-N 2.86Å; L218-Q221 PolarHBondContact O-N 3.45Å; L218-M222 HydrophobicContact CD1-CG 4.48Å; L218-M222 HydrophobicContact CG-CE 4.28Å; L218-M222 WeakPolarHBondContact O-CG 3.37Å; L218-M222 PolarHBondContact O-N 2.88Å
219	V	84.4	Confident	81.3	Confident	79 Å²	79	102.2 Å²	102.2	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-43.7	176.9	172.3	0	0	0	0	110.7	L215 S216 Q221 M222 A223	L215-V219 WeakPolarHBondContact O-CG2 3.25Å; L215-V219 PolarHBondContact O-N 3.43Å; S216-V219 PolarHBondContact O-N 3.39Å; V219-Q221 VanDerWaalsContact C-N 3.33Å; V219-Q221 PolarHBondContact O-N 3.25Å; V219-M222 HydrophobicContact CG2-CE 4.47Å; V219-M222 PolarHBondContact O-N 2.93Å; V219-A223 VanDerWaalsContact O-CB 3.31Å; V219-A223 WeakPolarHBondContact O-CB 3.13Å; V219-A223 PolarHBondContact O-N 3.39Å
220	I	87.4	Confident	81	Confident	84 Å²	84	106.1 Å²	106.1	43%	0.431	52%	0.521	S	S	.	.	H	α-helix	trans	-60	-44.4	175	-67.3	164.3	0	0	0	110.6	S216 A223 H224	S216-I220 VanDerWaalsContact O-CG1 3.26Å; S216-I220 WeakPolarHBondContact O-CG1 3.35Å; S216-I220 PolarHBondContact O-N 3.17Å; I220-A223 PolarHBondContact O-N 2.99Å; I220-H224 WeakPolarHBondContact O-CB 3.37Å; I220-H224 PolarHBondContact O-CD2 2.74Å; I220-H224 PolarHBondContact O-N 3.3Å
221	Q	83.4	Confident	80	Confident	131 Å²	131	106.5 Å²	106.5	61%	0.612	53%	0.527	S	S	*	.	H	α-helix	trans	-64.5	-42.1	178.2	-76.3	179.1	20.9	0	0	112.5	S217 L218 V219 K225	S217-Q221 WeakPolarHBondContact O-CB 2.87Å; S217-Q221 VanDerWaalsContact O-CG 3.27Å; S217-Q221 WeakPolarHBondContact O-CG 3.29Å; S217-Q221 PolarHBondContact O-N 3.45Å; L218-Q221 PolarHBondContact O-N 3.45Å; V219-Q221 VanDerWaalsContact C-N 3.33Å; V219-Q221 PolarHBondContact O-N 3.25Å; Q221-K225 VanDerWaalsContact O-CB 3.3Å; Q221-K225 WeakPolarHBondContact O-CB 3.3Å; Q221-K225 PolarHBondContact O-N 3.42Å
222	M	83.9	Confident	78.7	Confident	104 Å²	104	106.3 Å²	106.3	51%	0.512	53%	0.532	S	S	.	.	H	α-helix	trans	-66	-42.6	176.1	-70.2	-168.7	-56.1	0	0	111.5	L218 V219 K225 E226	L218-M222 HydrophobicContact CD1-CG 4.48Å; L218-M222 HydrophobicContact CG-CE 4.28Å; L218-M222 WeakPolarHBondContact O-CG 3.37Å; L218-M222 PolarHBondContact O-N 2.88Å; V219-M222 HydrophobicContact CG2-CE 4.47Å; V219-M222 PolarHBondContact O-N 2.93Å; M222-K225 PolarHBondContact O-N 2.76Å; M222-E226 WeakPolarHBondContact O-CB 3.26Å; M222-E226 PolarHBondContact O-N 3.16Å
223	A	78.5	Confident	77.4	Confident	42 Å²	42	105.4 Å²	105.4	35%	0.347	54%	0.539	S	S	.	.	H	α-helix	trans	-63.3	-44.6	176.5	0	0	0	0	0	111.8	V219 I220 K225 E226 I227	V219-A223 VanDerWaalsContact O-CB 3.31Å; V219-A223 WeakPolarHBondContact O-CB 3.13Å; V219-A223 PolarHBondContact O-N 3.39Å; I220-A223 PolarHBondContact O-N 2.99Å; A223-K225 VanDerWaalsContact C-N 3.33Å; A223-K225 PolarHBondContact O-N 2.9Å; A223-E226 PolarHBondContact O-N 3.42Å; A223-I227 WeakPolarHBondContact O-CB 3.37Å; A223-I227 VanDerWaalsContact O-CG1 3.23Å; A223-I227 WeakPolarHBondContact O-CG1 3.45Å; A223-I227 PolarHBondContact O-N 3.26Å
224	H	76.5	Confident	75.9	Confident	125 Å²	125	108.6 Å²	108.6	58%	0.579	55%	0.548	S	S	*	.	H	α-helix	trans	-61.8	-42.2	175.3	-78.3	-164.8	0	0	0	111.8	I220 K228	I220-H224 WeakPolarHBondContact O-CB 3.37Å; I220-H224 PolarHBondContact O-CD2 2.74Å; I220-H224 PolarHBondContact O-N 3.3Å; H224-K228 WeakPolarHBondContact O-CB 3.27Å; H224-K228 PolarHBondContact O-N 2.88Å
225	K	83	Confident	74.1	Confident	129 Å²	129	105.8 Å²	105.8	56%	0.561	55%	0.554	S	S	*	*	H	α-helix	trans	-62	-45.8	175.7	-177.6	-179.1	171.6	-175.8	0	111	Q221 M222 A223 K228 E229	Q221-K225 VanDerWaalsContact O-CB 3.3Å; Q221-K225 WeakPolarHBondContact O-CB 3.3Å; Q221-K225 PolarHBondContact O-N 3.42Å; M222-K225 PolarHBondContact O-N 2.76Å; A223-K225 VanDerWaalsContact C-N 3.33Å; A223-K225 PolarHBondContact O-N 2.9Å; K225-K228 PolarHBondContact O-N 2.82Å; K225-E229 WeakPolarHBondContact CE-OE1 3.46Å; K225-E229 HydrophobicContact CG-CG 4.43Å; K225-E229 IonicContact NZ-OE1 3.86Å; K225-E229 WeakPolarHBondContact O-CB 3.45Å; K225-E229 WeakPolarHBondContact O-CG 3.19Å; K225-E229 PolarHBondContact O-N 2.89Å
226	E	76.4	Confident	72.8	Confident	113 Å²	113	109.3 Å²	109.3	53%	0.528	56%	0.564	S	S	.	*	H	α-helix	trans	-67.5	-43.5	-179.9	-177	150.2	-165.1	0	0	112.2	M222 A223 K228 E229 K230	M222-E226 WeakPolarHBondContact O-CB 3.26Å; M222-E226 PolarHBondContact O-N 3.16Å; A223-E226 PolarHBondContact O-N 3.42Å; E226-K228 VanDerWaalsContact C-N 3.32Å; E226-K228 PolarHBondContact O-N 3.36Å; E226-E229 PolarHBondContact O-N 3.49Å; E226-K230 HydrophobicContact CG-CG 4.17Å; E226-K230 WeakPolarHBondContact O-CB 3.36Å; E226-K230 WeakPolarHBondContact O-CG 3.31Å; E226-K230 PolarHBondContact O-N 3.43Å
227	I	76	Confident	70.8	Confident	109 Å²	109	110.9 Å²	110.9	56%	0.559	57%	0.574	S	S	*	*	H	α-helix	trans	-58.5	-46.8	173.3	-68.6	165	0	0	0	110.1	A223 K230 L231	A223-I227 WeakPolarHBondContact O-CB 3.37Å; A223-I227 VanDerWaalsContact O-CG1 3.23Å; A223-I227 WeakPolarHBondContact O-CG1 3.45Å; A223-I227 PolarHBondContact O-N 3.26Å; I227-K230 PolarHBondContact O-N 3.45Å; I227-L231 WeakPolarHBondContact O-CB 3.42Å; I227-L231 PolarHBondContact O-N 2.93Å
228	K	78.1	Confident	68.7	Low	130 Å²	130	115.1 Å²	115.1	57%	0.565	59%	0.591	S	S	*	*	H	α-helix	trans	-61.5	-48.7	178.6	-173.3	178.7	178.1	-175.9	0	111.4	H224 K225 E226 K230 L231 E232	H224-K228 WeakPolarHBondContact O-CB 3.27Å; H224-K228 PolarHBondContact O-N 2.88Å; K225-K228 PolarHBondContact O-N 2.82Å; E226-K228 VanDerWaalsContact C-N 3.32Å; E226-K228 PolarHBondContact O-N 3.36Å; K228-K230 VanDerWaalsContact C-N 3.33Å; K228-K230 PolarHBondContact O-N 2.89Å; K228-L231 PolarHBondContact O-N 3.03Å; K228-E232 VanDerWaalsContact CE-OE2 3.25Å; K228-E232 WeakPolarHBondContact CE-OE2 3.22Å; K228-E232 WeakPolarHBondContact O-CB 3.27Å; K228-E232 PolarHBondContact O-N 2.95Å
229	E	71.3	Confident	66.5	Low	117 Å²	117	119 Å²	119	55%	0.547	61%	0.607	S	S	.	*	H	α-helix	trans	-62.7	-38.2	178.9	-76.2	178.9	177.1	0	0	112.5	K225 E226 G233	K225-E229 WeakPolarHBondContact CE-OE1 3.46Å; K225-E229 HydrophobicContact CG-CG 4.43Å; K225-E229 IonicContact NZ-OE1 3.86Å; K225-E229 WeakPolarHBondContact O-CB 3.45Å; K225-E229 WeakPolarHBondContact O-CG 3.19Å; K225-E229 PolarHBondContact O-N 2.89Å; E226-E229 PolarHBondContact O-N 3.49Å; E229-G233 PolarHBondContact O-N 3.21Å; E229-G233 VanDerWaalsContact O-N 3.13Å
230	K	68.8	Low	64.2	Low	136 Å²	136	122.9 Å²	122.9	59%	0.591	62%	0.619	S	S	*	*	H	α-helix	trans	-74.7	-33.4	178.2	-63.7	-72.8	179.7	-179.3	0	112.6	E226 I227 K228 K234	E226-K230 HydrophobicContact CG-CG 4.17Å; E226-K230 WeakPolarHBondContact O-CB 3.36Å; E226-K230 WeakPolarHBondContact O-CG 3.31Å; E226-K230 PolarHBondContact O-N 3.43Å; I227-K230 PolarHBondContact O-N 3.45Å; K228-K230 VanDerWaalsContact C-N 3.33Å; K228-K230 PolarHBondContact O-N 2.89Å; K230-K234 WeakPolarHBondContact O-CB 2.96Å; K230-K234 PolarHBondContact O-N 3.33Å
231	L	60.1	Low	61.8	Low	122 Å²	122	123.4 Å²	123.4	64%	0.639	63%	0.631	S	S	*	*	H	α-helix	trans	-77	-42	178.3	-161.4	83.6	0	0	0	111.5	I227 K228 G233 K234	I227-L231 WeakPolarHBondContact O-CB 3.42Å; I227-L231 PolarHBondContact O-N 2.93Å; K228-L231 PolarHBondContact O-N 3.03Å; L231-G233 VanDerWaalsContact C-N 3.31Å; L231-G233 PolarHBondContact O-N 3.04Å; L231-K234 CarbonylContact O-C 3.52Å; L231-K234 PolarHBondContact O-N 2.79Å
232	E	55	Low	59.5	Low	142 Å²	142	124.8 Å²	124.8	66%	0.664	64%	0.64	S	S	*	*	H	α-helix	trans	-73.2	-24.9	-179.3	-150.8	157.1	-144.9	0	0	111.3	K228	K228-E232 VanDerWaalsContact CE-OE2 3.25Å; K228-E232 WeakPolarHBondContact CE-OE2 3.22Å; K228-E232 WeakPolarHBondContact O-CB 3.27Å; K228-E232 PolarHBondContact O-N 2.95Å
233	G	52.3	Low	57.2	Low	63 Å²	63	124.6 Å²	124.6	65%	0.649	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-12.1	171.5	0	0	0	0	0	116.4	E229 L231	E229-G233 PolarHBondContact O-N 3.21Å; E229-G233 VanDerWaalsContact O-N 3.13Å; L231-G233 VanDerWaalsContact C-N 3.31Å; L231-G233 PolarHBondContact O-N 3.04Å
234	K	52.6	Low	55.2	Low	168 Å²	168	128.2 Å²	128.2	73%	0.73	67%	0.668	S	S	*	*			trans	-127.6	60.8	178.7	-81.5	-179	168.4	177.1	0	111.3	K230 L231 K236	K230-K234 WeakPolarHBondContact O-CB 2.96Å; K230-K234 PolarHBondContact O-N 3.33Å; L231-K234 CarbonylContact O-C 3.52Å; L231-K234 PolarHBondContact O-N 2.79Å; K234-K236 PolarHBondContact O-N 2.97Å
235	S	48.8	Very low	53.4	Low	107 Å²	107	127.3 Å²	127.3	75%	0.748	68%	0.676	S	S	*	*			trans	-70.7	28.5	172.3	56.2	0	0	0	0	114.8
236	K	56.3	Low	51.6	Low	189 Å²	189	127 Å²	127	82%	0.822	69%	0.687	S	S	*	*			trans	-129.7	70.8	172.3	-64.5	-175.1	-175.5	179.2	0	109.4	K234 L238	K234-K236 PolarHBondContact O-N 2.97Å; K236-L238 PolarHBondContact O-N 3Å; K236-L238 VanDerWaalsContact O-N 3.11Å
237	C	38.7	Very low	49.8	Very low	91 Å²	91	124.5 Å²	124.5	62%	0.615	69%	0.692	S	S	*	*			trans	-63.3	106.9	164	-49.9	0	0	0	0	107.5	H239	C237-H239 VanDerWaalsContact C-N 3.29Å; C237-H239 PolarHBondContact O-N 3.03Å
238	L	43.8	Very low	48.1	Very low	150 Å²	150	126.6 Å²	126.6	79%	0.785	70%	0.704	S	S	*	*			trans	-69.8	90.9	167.7	-82.8	158.1	0	0	0	107.7	K236 H240	K236-L238 PolarHBondContact O-N 3Å; K236-L238 VanDerWaalsContact O-N 3.11Å; L238-H240 VanDerWaalsContact C-N 3.32Å; L238-H240 PolarHBondContact O-N 2.91Å
239	H	41.5	Very low	46.6	Very low	169 Å²	169	130.3 Å²	130.3	78%	0.782	72%	0.72	S	S	*	*			trans	-66.7	95.8	160.2	-76	-89.5	0	0	0	107.5	C237 S241	C237-H239 VanDerWaalsContact C-N 3.29Å; C237-H239 PolarHBondContact O-N 3.03Å; H239-S241 PolarHBondContact O-N 3.23Å; H239-S241 VanDerWaalsContact O-N 3.1Å
240	H	35.7	Very low	45.2	Very low	160 Å²	160	133.6 Å²	133.6	74%	0.741	74%	0.736	S	S	*	*			trans	-76.8	83.4	156.9	-80.8	21.8	0	0	0	107.1	L238 I242	L238-H240 VanDerWaalsContact C-N 3.32Å; L238-H240 PolarHBondContact O-N 2.91Å; H240-I242 PolarHBondContact O-N 3.28Å
241	S	37.4	Very low	44.1	Very low	95 Å²	95	138.6 Å²	138.6	66%	0.664	75%	0.751	S	S	*	*			trans	-69.3	113	159.4	70.6	0	0	0	0	106.7	H239 C243	H239-S241 PolarHBondContact O-N 3.23Å; H239-S241 VanDerWaalsContact O-N 3.1Å; S241-C243 PolarHBondContact O-N 3.46Å
242	I	36	Very low	43.2	Very low	159 Å²	159	140.4 Å²	140.4	82%	0.815	76%	0.76	S	S	*	*			trans	-72.8	89.2	165	-57.6	172.4	0	0	0	105.6	H240 P244	H240-I242 PolarHBondContact O-N 3.28Å; I242-P244 WeakPolarHBondContact O-CD 3.28Å
243	C	35.1	Very low	42.5	Very low	101 Å²	101	139 Å²	139	68%	0.682	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-69.5	123.7	158.7	-87.7	0	0	0	0	106.8	S241 S245	S241-C243 PolarHBondContact O-N 3.46Å; C243-S245 PolarHBondContact O-N 3.02Å; C243-S245 VanDerWaalsContact O-N 3.1Å
244	P	36.6	Very low	42.6	Very low	118 Å²	118	145.6 Å²	145.6	77%	0.766	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-62.3	117.4	166.5	24.5	-29.1	0	0	0	108	I242	I242-P244 WeakPolarHBondContact O-CD 3.28Å
245	S	38.8	Very low	42.1	Very low	106 Å²	106	144.5 Å²	144.5	74%	0.741	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-58	128.8	170.2	178	0	0	0	0	109	C243 G247	C243-S245 PolarHBondContact O-N 3.02Å; C243-S245 VanDerWaalsContact O-N 3.1Å; S245-G247 VanDerWaalsContact C-N 3.32Å; S245-G247 PolarHBondContact O-N 2.74Å
246	P	44.7	Very low	41.7	Very low	121 Å²	121	146.4 Å²	146.4	79%	0.786	80%	0.803	S	S	*	*			trans	-73.3	92.2	173.2	29.3	-29.8	0	0	0	108.4	N248	P246-N248 PolarHBondContact O-N 2.95Å
247	G	37.7	Very low	40.9	Very low	62 Å²	62	144.1 Å²	144.1	64%	0.639	80%	0.801	S	S	*	*			trans	-66.6	94.5	173.1	0	0	0	0	0	111.4	S245	S245-G247 VanDerWaalsContact C-N 3.32Å; S245-G247 PolarHBondContact O-N 2.74Å
248	N	40.4	Very low	41	Very low	152 Å²	152	147.2 Å²	147.2	81%	0.813	81%	0.812	S	S	*	*			trans	51.5	105.7	135.5	-54.9	-34.8	0	0	0	118.5	P246 E250	P246-N248 PolarHBondContact O-N 2.95Å; N248-E250 PolarHBondContact O-N 2.93Å; N248-E250 VanDerWaalsContact O-N 3.16Å
249	K	47.5	Very low	40.8	Very low	209 Å²	209	147 Å²	147	91%	0.909	81%	0.814	S	S	*	*			trans	-51.7	108.9	159.2	-62.5	172.8	179.2	176.2	0	110.3	R251	K249-R251 PolarHBondContact O-N 3.49Å
250	E	40.9	Very low	40.8	Very low	186 Å²	186	145.5 Å²	145.5	87%	0.869	82%	0.816	S	S	*	*			trans	-76.7	112.1	163.3	-156.8	167.8	-158.2	0	0	108.1	N248 I252	N248-E250 PolarHBondContact O-N 2.93Å; N248-E250 VanDerWaalsContact O-N 3.16Å; E250-I252 PolarHBondContact O-N 3.49Å
251	R	45.8	Very low	41.2	Very low	241 Å²	241	144.5 Å²	144.5	91%	0.909	82%	0.822	S	S	*	*			trans	-66.5	122.7	172.3	-80	179.6	177.2	-159.8	-0.9	108.5	K249	K249-R251 PolarHBondContact O-N 3.49Å
252	I	42.3	Very low	41.5	Very low	160 Å²	160	148.3 Å²	148.3	82%	0.821	83%	0.834	S	S	*	*			trans	-112.9	113.5	154.8	-57.2	176.9	0	0	0	107.1	E250	E250-I252 PolarHBondContact O-N 3.49Å
253	S	38.8	Very low	41.9	Very low	112 Å²	112	147.4 Å²	147.4	78%	0.783	84%	0.835	S	S	*	*			trans	-171.8	151.1	160.5	-73.1	0	0	0	0	107.3
254	P	54.3	Low	42.5	Very low	201 Å²	201	151.6 Å²	151.6	100%	1.305	85%	0.849	S	S	*	*			cis	-106.8	0	19.6	15.4	5.9	0	0	0	115.3

Retrieved 254 of 254 residues in 101.5 ms (Link to these results)

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