A0A5K4F7T8_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F7T8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 310 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.3	Very low	57.9	Low	242 Å²	242	124.7 Å²	124.7	100%	1.192	62%	0.621	S	S	*	*				0	106.7	0	-79.9	172.6	151.9	0	0	107.6
2	L	49.5	Very low	58.7	Low	124 Å²	124	127.1 Å²	127.1	65%	0.649	62%	0.619	S	S	*	*			trans	-66.9	132.3	171	-83.8	150.7	0	0	0	107.7	D6 Q7	L2-D6 HydrophobicContact CD2-CB 4.14Å; L2-Q7 HydrophobicContact CB-CG 4.13Å
3	R	50.9	Low	58.7	Low	199 Å²	199	119.8 Å²	119.8	75%	0.751	60%	0.598	S	S	*	*			trans	-58.9	143.7	-179.8	-75.2	-179.5	171	-174.6	-2.6	108.7	S5 D6 Q7	R3-S5 PolarHBondContact O-N 2.9Å; R3-D6 PolarHBondContact O-N 3.16Å; R3-Q7 PolarHBondContact O-N 3.13Å
4	S	53.9	Low	59.2	Low	95 Å²	95	116.1 Å²	116.1	66%	0.664	58%	0.58	S	S	*	*	H	α-helix	trans	-51.9	-28.9	-174.9	49.3	0	0	0	0	114	L8	S4-L8 PolarHBondContact O-N 3.31Å
5	S	58.6	Low	59.5	Low	60 Å²	60	115 Å²	115	42%	0.42	58%	0.575	S	S	.	*	H	α-helix	trans	-65.2	-39.2	173.4	54.9	0	0	0	0	113.7	R3 L8 N9	R3-S5 PolarHBondContact O-N 2.9Å; S5-L8 PolarHBondContact O-N 3.17Å; S5-N9 PolarHBondContact O-N 2.8Å; S5-N9 VanDerWaalsContact O-N 3.15Å; S5-N9 PolarHBondContact O-ND2 3.08Å
6	D	58.8	Low	59.6	Low	77 Å²	77	116.3 Å²	116.3	41%	0.412	58%	0.576	S	S	.	*	H	α-helix	trans	-77.2	-32.7	-175.2	-58.8	-19.5	0	0	0	110.8	L2 R3 F10	L2-D6 HydrophobicContact CD2-CB 4.14Å; R3-D6 PolarHBondContact O-N 3.16Å; D6-F10 WeakPolarHBondContact O-CB 3.35Å; D6-F10 PolarHBondContact O-N 2.85Å
7	Q	62.1	Low	59.8	Low	102 Å²	102	116.1 Å²	116.1	48%	0.477	58%	0.577	S	S	.	*	H	α-helix	trans	-63.8	-47.1	171.8	-74.5	-176.7	-25.1	0	0	111.2	L2 R3 N9 F10 F11	L2-Q7 HydrophobicContact CB-CG 4.13Å; R3-Q7 PolarHBondContact O-N 3.13Å; Q7-N9 PolarHBondContact O-N 2.83Å; Q7-F10 PolarHBondContact O-N 3.23Å; Q7-F11 WeakPolarHBondContact O-CD2 3.33Å; Q7-F11 PolarHBondContact O-N 2.97Å
8	L	62.6	Low	59.5	Low	97 Å²	97	115.1 Å²	115.1	51%	0.508	57%	0.574	S	S	.	*	H	α-helix	trans	-59.1	-47.7	177.9	-81.7	162.6	0	0	0	111.8	S4 S5 F10 F11 Y12	S4-L8 PolarHBondContact O-N 3.31Å; S5-L8 PolarHBondContact O-N 3.17Å; L8-F10 VanDerWaalsContact C-N 3.31Å; L8-F10 PolarHBondContact O-N 2.75Å; L8-F11 PolarHBondContact O-N 2.99Å; L8-Y12 HydrophobicContact CB-CD2 4.5Å; L8-Y12 HydrophobicContact CB-CE2 4.25Å; L8-Y12 HydrophobicContact CD2-CE2 4.17Å; L8-Y12 WeakPolarHBondContact O-CD2 3.43Å; L8-Y12 PolarHBondContact O-N 2.87Å
9	N	67.7	Low	58.9	Low	112 Å²	112	112.4 Å²	112.4	60%	0.599	56%	0.564	S	S	*	*	H	α-helix	trans	-62.8	-36.6	178.9	-73.5	-23.3	0	0	0	112.7	S5 Q7 Y12 G13	S5-N9 PolarHBondContact O-N 2.8Å; S5-N9 VanDerWaalsContact O-N 3.15Å; S5-N9 PolarHBondContact O-ND2 3.08Å; Q7-N9 PolarHBondContact O-N 2.83Å; N9-Y12 PolarHBondContact O-N 2.9Å; N9-G13 PolarHBondContact O-N 3.16Å
10	F	67.9	Low	58.5	Low	139 Å²	139	109.9 Å²	109.9	61%	0.61	55%	0.552	S	S	*	*	H	α-helix	trans	-65.5	-43.5	174.6	-176.2	-103.1	0	0	0	112.2	D6 Q7 L8 G13 I14	D6-F10 WeakPolarHBondContact O-CB 3.35Å; D6-F10 PolarHBondContact O-N 2.85Å; Q7-F10 PolarHBondContact O-N 3.23Å; L8-F10 VanDerWaalsContact C-N 3.31Å; L8-F10 PolarHBondContact O-N 2.75Å; F10-G13 PolarHBondContact O-N 3.13Å; F10-I14 HydrophobicContact CD1-CD1 3.82Å; F10-I14 HydrophobicContact CE1-CD1 3.27Å; F10-I14 HydrophobicContact CE1-CG1 4.33Å; F10-I14 HydrophobicContact CE2-CD1 4.33Å; F10-I14 HydrophobicContact CZ-CD1 3.57Å; F10-I14 HydrophobicContact CZ-CG1 4.39Å; F10-I14 PolarHBondContact O-N 2.93Å; F10-I14 VanDerWaalsContact O-N 3.09Å
11	F	65	Low	58	Low	125 Å²	125	110.9 Å²	110.9	55%	0.548	56%	0.555	S	S	.	*	H	α-helix	trans	-62.4	-42.9	175.3	-82.2	-71.7	0	0	0	112	Q7 L8 G13 I14 I15	Q7-F11 WeakPolarHBondContact O-CD2 3.33Å; Q7-F11 PolarHBondContact O-N 2.97Å; L8-F11 PolarHBondContact O-N 2.99Å; F11-G13 VanDerWaalsContact C-N 3.34Å; F11-G13 PolarHBondContact O-N 2.97Å; F11-I14 PolarHBondContact O-N 3.36Å; F11-I15 WeakPolarHBondContact O-CG1 3.2Å; F11-I15 PolarHBondContact O-N 3.43Å
12	Y	66.9	Low	58.3	Low	153 Å²	153	107 Å²	107	60%	0.6	53%	0.533	S	S	*	.	H	α-helix	trans	-62.7	-39.6	175.8	-73.3	-61.7	0	0	0	112.4	L8 N9 I15 F16	L8-Y12 HydrophobicContact CB-CD2 4.5Å; L8-Y12 HydrophobicContact CB-CE2 4.25Å; L8-Y12 HydrophobicContact CD2-CE2 4.17Å; L8-Y12 WeakPolarHBondContact O-CD2 3.43Å; L8-Y12 PolarHBondContact O-N 2.87Å; N9-Y12 PolarHBondContact O-N 2.9Å; Y12-I15 PolarHBondContact O-N 3.16Å; Y12-F16 WeakPolarHBondContact O-CB 3.43Å; Y12-F16 PolarHBondContact O-N 3.27Å
13	G	58.6	Low	58.4	Low	33 Å²	33	107 Å²	107	34%	0.34	53%	0.533	S	S	.	.	H	α-helix	trans	-62.6	-42	176	0	0	0	0	0	113.3	N9 F10 F11 F16 L17	N9-G13 PolarHBondContact O-N 3.16Å; F10-G13 PolarHBondContact O-N 3.13Å; F11-G13 VanDerWaalsContact C-N 3.34Å; F11-G13 PolarHBondContact O-N 2.97Å; G13-F16 PolarHBondContact O-N 3.04Å; G13-L17 WeakPolarHBondContact O-CG 3.23Å; G13-L17 PolarHBondContact O-N 3.19Å; G13-L17 VanDerWaalsContact O-N 3.07Å
14	I	66.4	Low	57.8	Low	67 Å²	67	106.3 Å²	106.3	34%	0.344	53%	0.532	S	S	.	.	H	α-helix	trans	-66.6	-45	177.1	-69.4	177	0	0	0	111.3	F10 F11 F16 L17 L18	F10-I14 HydrophobicContact CD1-CD1 3.82Å; F10-I14 HydrophobicContact CE1-CD1 3.27Å; F10-I14 HydrophobicContact CE1-CG1 4.33Å; F10-I14 HydrophobicContact CE2-CD1 4.33Å; F10-I14 HydrophobicContact CZ-CD1 3.57Å; F10-I14 HydrophobicContact CZ-CG1 4.39Å; F10-I14 PolarHBondContact O-N 2.93Å; F10-I14 VanDerWaalsContact O-N 3.09Å; F11-I14 PolarHBondContact O-N 3.36Å; I14-F16 VanDerWaalsContact C-N 3.3Å; I14-F16 PolarHBondContact O-N 3.45Å; I14-L17 PolarHBondContact O-N 2.91Å; I14-L18 HydrophobicContact CG2-CD1 3.77Å; I14-L18 HydrophobicContact CG2-CG 4.47Å; I14-L18 WeakPolarHBondContact O-CG 3.44Å; I14-L18 PolarHBondContact O-N 3Å
15	I	62.7	Low	56.9	Low	100 Å²	100	104 Å²	104	51%	0.513	52%	0.518	S	S	.	.	H	α-helix	trans	-61.8	-41.3	178.9	-67.6	172.2	0	0	0	110.5	F11 Y12 L18 T19	F11-I15 WeakPolarHBondContact O-CG1 3.2Å; F11-I15 PolarHBondContact O-N 3.43Å; Y12-I15 PolarHBondContact O-N 3.16Å; I15-L18 PolarHBondContact O-N 3.02Å; I15-T19 PolarHBondContact O-N 2.67Å; I15-T19 PolarHBondContact O-OG1 2.92Å
16	F	62.2	Low	56	Low	136 Å²	136	106 Å²	106	60%	0.596	53%	0.53	S	S	*	.	H	α-helix	trans	-63	-42.5	176.8	-176.1	-105.5	0	0	0	112.6	Y12 G13 I14 T19 I20	Y12-F16 WeakPolarHBondContact O-CB 3.43Å; Y12-F16 PolarHBondContact O-N 3.27Å; G13-F16 PolarHBondContact O-N 3.04Å; I14-F16 VanDerWaalsContact C-N 3.3Å; I14-F16 PolarHBondContact O-N 3.45Å; F16-T19 WeakPolarHBondContact CA-OG1 3.42Å; F16-T19 PolarHBondContact O-N 2.84Å; F16-T19 PolarHBondContact O-OG1 2.91Å; F16-I20 HydrophobicContact CD1-CD1 3.86Å; F16-I20 HydrophobicContact CE1-CD1 3.37Å; F16-I20 HydrophobicContact CE1-CG1 4.45Å; F16-I20 HydrophobicContact CE2-CD1 4.4Å; F16-I20 HydrophobicContact CZ-CD1 3.69Å; F16-I20 HydrophobicContact CZ-CG1 4.48Å; F16-I20 WeakPolarHBondContact O-CG1 3.4Å; F16-I20 PolarHBondContact O-N 3.06Å; F16-I20 VanDerWaalsContact O-N 3.1Å
17	L	61.8	Low	55.2	Low	113 Å²	113	108 Å²	108	59%	0.592	55%	0.547	S	S	*	.	H	α-helix	trans	-67	-39.8	177.1	-74.6	166	0	0	0	112.5	G13 I14 I20 Q21	G13-L17 WeakPolarHBondContact O-CG 3.23Å; G13-L17 PolarHBondContact O-N 3.19Å; G13-L17 VanDerWaalsContact O-N 3.07Å; I14-L17 PolarHBondContact O-N 2.91Å; L17-I20 PolarHBondContact O-N 3.06Å; L17-Q21 PolarHBondContact O-N 2.79Å
18	L	54.3	Low	54.2	Low	98 Å²	98	108.6 Å²	108.6	51%	0.513	56%	0.558	S	S	.	*	H	α-helix	trans	-66.1	-36.7	176.4	-77.4	164.1	0	0	0	112.4	I14 I15 Q21 Q22	I14-L18 HydrophobicContact CG2-CD1 3.77Å; I14-L18 HydrophobicContact CG2-CG 4.47Å; I14-L18 WeakPolarHBondContact O-CG 3.44Å; I14-L18 PolarHBondContact O-N 3Å; I15-L18 PolarHBondContact O-N 3.02Å; L18-Q21 PolarHBondContact O-N 3.14Å; L18-Q22 PolarHBondContact O-N 3.31Å
19	T	49.3	Very low	53.1	Low	63 Å²	63	111 Å²	111	39%	0.387	57%	0.571	S	S	.	*	H	α-helix	trans	-68.1	-41	175.9	25.5	0	0	0	0	111.8	I15 F16 Q21 Q22 I23	I15-T19 PolarHBondContact O-N 2.67Å; I15-T19 PolarHBondContact O-OG1 2.92Å; F16-T19 WeakPolarHBondContact CA-OG1 3.42Å; F16-T19 PolarHBondContact O-N 2.84Å; F16-T19 PolarHBondContact O-OG1 2.91Å; T19-Q21 VanDerWaalsContact C-N 3.29Å; T19-Q21 PolarHBondContact O-N 2.62Å; T19-Q22 PolarHBondContact O-N 2.8Å; T19-I23 WeakPolarHBondContact O-CD1 3.4Å; T19-I23 VanDerWaalsContact O-CG1 3.25Å; T19-I23 WeakPolarHBondContact O-CG1 3.05Å; T19-I23 PolarHBondContact O-N 3.46Å
20	I	51.4	Low	51.5	Low	62 Å²	62	109.8 Å²	109.8	32%	0.318	57%	0.571	S	S	.	*	H	α-helix	trans	-58.8	-44.6	171.1	-70.3	174.5	0	0	0	109.9	F16 L17 Q22 I23 Y24	F16-I20 HydrophobicContact CD1-CD1 3.86Å; F16-I20 HydrophobicContact CE1-CD1 3.37Å; F16-I20 HydrophobicContact CE1-CG1 4.45Å; F16-I20 HydrophobicContact CE2-CD1 4.4Å; F16-I20 HydrophobicContact CZ-CD1 3.69Å; F16-I20 HydrophobicContact CZ-CG1 4.48Å; F16-I20 WeakPolarHBondContact O-CG1 3.4Å; F16-I20 PolarHBondContact O-N 3.06Å; F16-I20 VanDerWaalsContact O-N 3.1Å; L17-I20 PolarHBondContact O-N 3.06Å; I20-Q22 VanDerWaalsContact C-N 3.31Å; I20-Q22 PolarHBondContact O-N 3.06Å; I20-I23 PolarHBondContact O-N 2.93Å; I20-Y24 HydrophobicContact CG2-CD2 3.59Å; I20-Y24 HydrophobicContact CG2-CE2 3.88Å; I20-Y24 WeakPolarHBondContact O-CD2 3.39Å; I20-Y24 PolarHBondContact O-N 2.63Å
21	Q	47.9	Very low	49.7	Very low	132 Å²	132	106.8 Å²	106.8	62%	0.617	56%	0.561	S	S	*	*	H	α-helix	trans	-65.1	-33.2	179.8	-155.8	174.5	3.9	0	0	112.6	L17 L18 T19 A25	L17-Q21 PolarHBondContact O-N 2.79Å; L18-Q21 PolarHBondContact O-N 3.14Å; T19-Q21 VanDerWaalsContact C-N 3.29Å; T19-Q21 PolarHBondContact O-N 2.62Å; Q21-A25 WeakPolarHBondContact O-CA 3.49Å; Q21-A25 WeakPolarHBondContact O-CB 3.46Å; Q21-A25 PolarHBondContact O-N 2.88Å
22	Q	46	Very low	48.5	Very low	159 Å²	159	105.5 Å²	105.5	74%	0.743	57%	0.565	S	S	*	*	H	α-helix	trans	-73.6	-31.8	173.1	-81.6	-174.3	-17	0	0	113.9	L18 T19 I20	L18-Q22 PolarHBondContact O-N 3.31Å; T19-Q22 PolarHBondContact O-N 2.8Å; I20-Q22 VanDerWaalsContact C-N 3.31Å; I20-Q22 PolarHBondContact O-N 3.06Å
23	I	51.7	Low	47	Very low	126 Å²	126	103.7 Å²	103.7	65%	0.646	57%	0.57	S	S	*	*	H	α-helix	trans	-71.4	-37.9	176.8	-66.3	163.6	0	0	0	110.5	T19 I20	T19-I23 WeakPolarHBondContact O-CD1 3.4Å; T19-I23 VanDerWaalsContact O-CG1 3.25Å; T19-I23 WeakPolarHBondContact O-CG1 3.05Å; T19-I23 PolarHBondContact O-N 3.46Å; I20-I23 PolarHBondContact O-N 2.93Å
24	Y	38.9	Very low	45.8	Very low	183 Å²	183	110 Å²	110	72%	0.718	59%	0.585	S	S	*	*	H	α-helix	trans	-101.4	-15.6	-175.3	-66.4	-73.2	0	0	0	114.9	I20 P26	I20-Y24 HydrophobicContact CG2-CD2 3.59Å; I20-Y24 HydrophobicContact CG2-CE2 3.88Å; I20-Y24 WeakPolarHBondContact O-CD2 3.39Å; I20-Y24 PolarHBondContact O-N 2.63Å; Y24-P26 VanDerWaalsContact O-CD 3.27Å; Y24-P26 WeakPolarHBondContact O-CD 3.21Å
25	A	34.3	Very low	44	Very low	47 Å²	47	113.2 Å²	113.2	39%	0.388	60%	0.599	S	S	.	*	S	Bend	trans	-71.4	115.2	165.7	0	0	0	0	0	106.5	Q21	Q21-A25 WeakPolarHBondContact O-CA 3.49Å; Q21-A25 WeakPolarHBondContact O-CB 3.46Å; Q21-A25 PolarHBondContact O-N 2.88Å
26	P	39.7	Very low	42.5	Very low	102 Å²	102	113.5 Å²	113.5	66%	0.662	61%	0.61	S	S	*	*			trans	-52.3	137.5	170.3	23.1	-30.8	0	0	0	106.6	Y24 T28	Y24-P26 VanDerWaalsContact O-CD 3.27Å; Y24-P26 WeakPolarHBondContact O-CD 3.21Å; P26-T28 VanDerWaalsContact C-N 3.33Å; P26-T28 PolarHBondContact O-N 2.92Å
27	P	41.9	Very low	41	Very low	120 Å²	120	116.8 Å²	116.8	78%	0.779	62%	0.619	S	S	*	*			trans	-48.3	111.9	170.7	19.9	-30.1	0	0	0	105	L29	P27-L29 PolarHBondContact O-N 3.42Å
28	T	41.8	Very low	39.5	Very low	114 Å²	114	116.4 Å²	116.4	70%	0.699	63%	0.626	S	S	*	*			trans	-47.8	127.4	173	36	0	0	0	0	103.9	P26 S30	P26-T28 VanDerWaalsContact C-N 3.33Å; P26-T28 PolarHBondContact O-N 2.92Å; T28-S30 PolarHBondContact O-N 3.05Å; T28-S30 PolarHBondContact O-OG 3.1Å
29	L	38.5	Very low	38.4	Very low	148 Å²	148	116 Å²	116	78%	0.775	63%	0.628	S	S	*	*	S	Bend	trans	-63.4	42.3	-178.3	-82.9	136.4	0	0	0	111.7	P27 N31	P27-L29 PolarHBondContact O-N 3.42Å; L29-N31 PolarHBondContact O-N 3.39Å
30	S	33.8	Very low	37.4	Very low	86 Å²	86	119.9 Å²	119.9	60%	0.601	65%	0.646	S	S	*	*			trans	-71.2	48.3	157	64.2	0	0	0	0	109.6	T28 P32	T28-S30 PolarHBondContact O-N 3.05Å; T28-S30 PolarHBondContact O-OG 3.1Å; S30-P32 WeakPolarHBondContact O-CD 3.48Å
31	N	30.9	Very low	36.3	Very low	76 Å²	76	126.5 Å²	126.5	41%	0.406	67%	0.668	S	S	.	*			trans	-76.5	113.9	153	-176.4	5.6	0	0	0	104.7	L29 T33 Y34	L29-N31 PolarHBondContact O-N 3.39Å; N31-T33 PolarHBondContact O-N 3.18Å; N31-T33 PolarHBondContact OD1-OG1 2.77Å; N31-T33 VanDerWaalsContact OD1-OG1 3.12Å; N31-Y34 HydrophobicContact CB-CD2 4Å; N31-Y34 PolarHBondContact O-N 2.97Å
32	P	38.8	Very low	35.4	Very low	98 Å²	98	127.4 Å²	127.4	64%	0.636	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-57.9	-17.9	-175.9	20.8	-31.6	0	0	0	113.1	S30 Y34 Q35	S30-P32 WeakPolarHBondContact O-CD 3.48Å; P32-Y34 PolarHBondContact O-N 2.56Å; P32-Q35 PolarHBondContact O-N 3.14Å
33	T	36	Very low	34.7	Very low	114 Å²	114	123.9 Å²	123.9	70%	0.699	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-62.8	-24.5	171.9	-34.5	0	0	0	0	113.3	N31	N31-T33 PolarHBondContact O-N 3.18Å; N31-T33 PolarHBondContact OD1-OG1 2.77Å; N31-T33 VanDerWaalsContact OD1-OG1 3.12Å
34	Y	33.8	Very low	34.3	Very low	166 Å²	166	123 Å²	123	65%	0.651	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-104.5	6.2	179.9	-68	-83.1	0	0	0	113.8	N31 P32 S36	N31-Y34 HydrophobicContact CB-CD2 4Å; N31-Y34 PolarHBondContact O-N 2.97Å; P32-Y34 PolarHBondContact O-N 2.56Å; Y34-S36 PolarHBondContact O-N 2.75Å
35	Q	28.2	Very low	34.1	Very low	135 Å²	135	120 Å²	120	63%	0.631	67%	0.667	S	S	*	*			trans	-70.4	75.5	154	-72.4	-172.9	-0.9	0	0	106.6	P32 Y37	P32-Q35 PolarHBondContact O-N 3.14Å; Q35-Y37 VanDerWaalsContact C-N 3.26Å; Q35-Y37 WeakPolarHBondContact O-CD2 3.2Å; Q35-Y37 PolarHBondContact O-N 2.8Å
36	S	32.3	Very low	34.4	Very low	106 Å²	106	125.5 Å²	125.5	74%	0.741	69%	0.691	S	S	*	*			trans	-52.9	104.7	160.4	51.3	0	0	0	0	105	Y34 S38	Y34-S36 PolarHBondContact O-N 2.75Å; S36-S38 VanDerWaalsContact C-N 3.34Å; S36-S38 PolarHBondContact O-N 3.14Å
37	Y	29.1	Very low	34.1	Very low	204 Å²	204	128.4 Å²	128.4	80%	0.8	70%	0.695	S	S	*	*			trans	-50.5	105.8	172.7	-71.7	-104.4	0	0	0	106.3	Q35 V39	Q35-Y37 VanDerWaalsContact C-N 3.26Å; Q35-Y37 WeakPolarHBondContact O-CD2 3.2Å; Q35-Y37 PolarHBondContact O-N 2.8Å; Y37-V39 VanDerWaalsContact CB-CG2 3.4Å; Y37-V39 HydrophobicContact CD1-CG2 4.46Å; Y37-V39 HydrophobicContact CG-CG2 4.29Å; Y37-V39 PolarHBondContact O-N 3.49Å
38	S	31.9	Very low	33.7	Very low	106 Å²	106	134.9 Å²	134.9	74%	0.741	70%	0.704	S	S	*	*			trans	-68.3	72.4	154.5	56.6	0	0	0	0	105.3	S36 N40	S36-S38 VanDerWaalsContact C-N 3.34Å; S36-S38 PolarHBondContact O-N 3.14Å; S38-N40 PolarHBondContact O-N 3Å; S38-N40 VanDerWaalsContact O-N 3.08Å
39	V	30.7	Very low	33.2	Very low	89 Å²	89	137.9 Å²	137.9	54%	0.539	71%	0.711	S	S	.	*			trans	-64.2	113.3	171.2	-167.7	0	0	0	0	104.2	Y37 Y41	Y37-V39 VanDerWaalsContact CB-CG2 3.4Å; Y37-V39 HydrophobicContact CD1-CG2 4.46Å; Y37-V39 HydrophobicContact CG-CG2 4.29Å; Y37-V39 PolarHBondContact O-N 3.49Å; V39-Y41 HydrophobicContact CB-CD2 4.43Å; V39-Y41 HydrophobicContact CG1-CD2 3.34Å; V39-Y41 HydrophobicContact CG1-CE2 3.67Å; V39-Y41 HydrophobicContact CG1-CG 4.41Å; V39-Y41 PolarHBondContact O-N 2.8Å
40	N	28.9	Very low	33	Very low	144 Å²	144	139.7 Å²	139.7	77%	0.77	72%	0.715	S	S	*	*			trans	-65.7	54	174.5	-84.5	-30.4	0	0	0	111.9	S38	S38-N40 PolarHBondContact O-N 3Å; S38-N40 VanDerWaalsContact O-N 3.08Å
41	Y	27	Very low	33.2	Very low	202 Å²	202	141.6 Å²	141.6	79%	0.792	72%	0.723	S	S	*	*			trans	-99.4	68.4	157.4	-71.9	-69.2	0	0	0	108.3	V39 S43	V39-Y41 HydrophobicContact CB-CD2 4.43Å; V39-Y41 HydrophobicContact CG1-CD2 3.34Å; V39-Y41 HydrophobicContact CG1-CE2 3.67Å; V39-Y41 HydrophobicContact CG1-CG 4.41Å; V39-Y41 PolarHBondContact O-N 2.8Å; Y41-S43 PolarHBondContact O-N 3.06Å
42	I	28.4	Very low	33.4	Very low	150 Å²	150	143.3 Å²	143.3	77%	0.769	74%	0.738	S	S	*	*			trans	-67.9	84.4	150.4	-61.7	169.3	0	0	0	104.8
43	S	32.2	Very low	33.5	Very low	85 Å²	85	146.8 Å²	146.8	59%	0.594	75%	0.746	S	S	*	*			trans	-72.4	122	161.9	-174.6	0	0	0	0	106.3	Y41 N45	Y41-S43 PolarHBondContact O-N 3.06Å; S43-N45 PolarHBondContact O-N 3.01Å
44	P	42.4	Very low	33.8	Very low	107 Å²	107	146.3 Å²	146.3	70%	0.695	75%	0.745	S	S	*	*	S	Bend	trans	-75.2	17.1	-165.8	30.2	-35	0	0	0	114.6	N46	P44-N46 PolarHBondContact O-N 2.96Å
45	N	35.6	Very low	34.4	Very low	120 Å²	120	145.4 Å²	145.4	64%	0.642	76%	0.756	S	S	*	*			trans	-87.6	104.3	176.3	-73.5	-9.3	0	0	0	109.3	S43 Q47	S43-N45 PolarHBondContact O-N 3.01Å; N45-Q47 PolarHBondContact O-N 2.77Å
46	N	40	Very low	34.8	Very low	164 Å²	164	142.5 Å²	142.5	88%	0.877	75%	0.748	S	S	*	*			trans	-57.6	20.2	172.5	-78.2	-9.6	0	0	0	115.2	P44 W48	P44-N46 PolarHBondContact O-N 2.96Å; N46-W48 PolarHBondContact O-N 3.06Å
47	Q	33.4	Very low	35.3	Very low	163 Å²	163	141.3 Å²	141.3	76%	0.762	73%	0.733	S	S	*	*	S	Bend	trans	-83.9	111.3	167.7	-70.1	-175.4	-30.3	0	0	106.5	N45 Q49	N45-Q47 PolarHBondContact O-N 2.77Å; Q47-Q49 VanDerWaalsContact C-N 3.34Å; Q47-Q49 PolarHBondContact O-N 3.3Å
48	W	33.7	Very low	36	Very low	255 Å²	255	137.5 Å²	137.5	97%	0.966	73%	0.725	S	S	*	*			trans	-46.1	102.2	168.3	-70.8	90.4	0	0	0	108.2	N46 E50	N46-W48 PolarHBondContact O-N 3.06Å; W48-E50 PolarHBondContact O-N 2.79Å; W48-E50 VanDerWaalsContact O-N 3.11Å
49	Q	32.5	Very low	36.5	Very low	178 Å²	178	139.6 Å²	139.6	83%	0.832	72%	0.721	S	S	*	*			trans	-67.6	112.4	167.7	-105.1	174.5	-10.1	0	0	105	Q47 V51	Q47-Q49 VanDerWaalsContact C-N 3.34Å; Q47-Q49 PolarHBondContact O-N 3.3Å; Q49-V51 PolarHBondContact O-N 3.08Å
50	E	32.5	Very low	36.6	Very low	185 Å²	185	138.8 Å²	138.8	86%	0.864	71%	0.714	S	S	*	*			trans	-54.7	106.8	171.9	-162.5	167.9	-148.1	0	0	106.5	W48 P52	W48-E50 PolarHBondContact O-N 2.79Å; W48-E50 VanDerWaalsContact O-N 3.11Å; E50-P52 VanDerWaalsContact O-CD 3.25Å; E50-P52 WeakPolarHBondContact O-CD 3.31Å; E50-P52 VanDerWaalsContact O-N 3.13Å
51	V	38.4	Very low	36.9	Very low	127 Å²	127	133.4 Å²	133.4	77%	0.77	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-60.8	117.9	175.8	177.9	0	0	0	0	104.9	Q49 E53	Q49-V51 PolarHBondContact O-N 3.08Å; V51-E53 PolarHBondContact O-N 2.99Å; V51-E53 VanDerWaalsContact O-N 3.08Å
52	P	36.3	Very low	37.7	Very low	111 Å²	111	128.6 Å²	128.6	72%	0.721	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-55.5	124.8	179	-21.6	31.2	0	0	0	107.8	E50	E50-P52 VanDerWaalsContact O-CD 3.25Å; E50-P52 WeakPolarHBondContact O-CD 3.31Å; E50-P52 VanDerWaalsContact O-N 3.13Å
53	E	40.2	Very low	38.2	Very low	172 Å²	172	130 Å²	130	80%	0.804	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-50.9	135.7	172.4	-67.9	-169.2	166	0	0	107.8	V51 T55	V51-E53 PolarHBondContact O-N 2.99Å; V51-E53 VanDerWaalsContact O-N 3.08Å; E53-T55 PolarHBondContact O-N 3.06Å
54	P	43.3	Very low	38.4	Very low	104 Å²	104	132.7 Å²	132.7	68%	0.675	68%	0.684	S	S	*	*			trans	-56.7	107.6	-179.9	22.4	-31.4	0	0	0	107.8	T56	P54-T56 CarbonylContact O-C 3.56Å; P54-T56 PolarHBondContact O-N 2.8Å
55	T	46.3	Very low	37.8	Very low	146 Å²	146	134.8 Å²	134.8	90%	0.896	69%	0.685	S	S	*	*	S	Bend	trans	-57.9	-15	-178.2	49.2	0	0	0	0	112.3	E53	E53-T55 PolarHBondContact O-N 3.06Å
56	T	35.8	Very low	37.6	Very low	74 Å²	74	133.5 Å²	133.5	45%	0.454	69%	0.685	S	S	.	*	S	Bend	trans	-119.4	115.6	173.7	-25.2	0	0	0	0	108	P54 I58 D60 A61	P54-T56 CarbonylContact O-C 3.56Å; P54-T56 PolarHBondContact O-N 2.8Å; T56-I58 PolarHBondContact O-N 3.08Å; T56-D60 HydrophobicContact CG2-CB 4.42Å; T56-A61 HydrophobicContact CG2-CB 4.11Å
57	N	43.3	Very low	37.3	Very low	82 Å²	82	129 Å²	129	44%	0.439	67%	0.665	S	S	.	*			trans	-52.4	131.3	166.6	-176.4	-11.7	0	0	0	108.2	F59 D60 A61	N57-F59 PolarHBondContact O-N 2.7Å; N57-F59 WeakPolarHBondContact OD1-CD2 3.36Å; N57-F59 PolarHBondContact OD1-N 3.02Å; N57-D60 HydrophobicContact CB-CB 4.14Å; N57-D60 WeakPolarHBondContact CB-OD2 3.43Å; N57-D60 WeakPolarHBondContact O-CA 3.19Å; N57-D60 WeakPolarHBondContact O-CB 3.36Å; N57-D60 PolarHBondContact O-N 2.93Å; N57-A61 PolarHBondContact O-N 2.88Å
58	I	43.4	Very low	37	Very low	123 Å²	123	128.1 Å²	128.1	63%	0.631	67%	0.671	S	S	*	*	H	α-helix	trans	-52.2	-33.9	176.5	-74.3	168.3	0	0	0	110.5	T56 D60 A61 V62	T56-I58 PolarHBondContact O-N 3.08Å; I58-D60 VanDerWaalsContact C-N 3.35Å; I58-D60 PolarHBondContact O-N 2.97Å; I58-A61 PolarHBondContact O-N 3.29Å; I58-V62 HydrophobicContact CG2-CG2 4.28Å; I58-V62 WeakPolarHBondContact O-CB 3.33Å; I58-V62 WeakPolarHBondContact O-CG2 3.26Å; I58-V62 PolarHBondContact O-N 3.4Å
59	F	42.4	Very low	36.8	Very low	150 Å²	150	124.9 Å²	124.9	66%	0.658	66%	0.66	S	S	*	*	H	α-helix	trans	-67.9	-31.7	175.6	-63.1	-68.6	0	0	0	113.4	N57 R63	N57-F59 PolarHBondContact O-N 2.7Å; N57-F59 WeakPolarHBondContact OD1-CD2 3.36Å; N57-F59 PolarHBondContact OD1-N 3.02Å; F59-R63 WeakPolarHBondContact O-CB 3.49Å; F59-R63 WeakPolarHBondContact O-CD 3.16Å; F59-R63 WeakPolarHBondContact O-CG 3.19Å; F59-R63 PolarHBondContact O-N 3.45Å; F59-R63 VanDerWaalsContact O-N 3.14Å
60	D	31.8	Very low	36.5	Very low	73 Å²	73	125 Å²	125	39%	0.39	66%	0.66	S	S	.	*	H	α-helix	trans	-79.2	-36.6	175.5	-67.5	-30.1	0	0	0	111.6	T56 N57 I58 R63 N64	T56-D60 HydrophobicContact CG2-CB 4.42Å; N57-D60 HydrophobicContact CB-CB 4.14Å; N57-D60 WeakPolarHBondContact CB-OD2 3.43Å; N57-D60 WeakPolarHBondContact O-CA 3.19Å; N57-D60 WeakPolarHBondContact O-CB 3.36Å; N57-D60 PolarHBondContact O-N 2.93Å; I58-D60 VanDerWaalsContact C-N 3.35Å; I58-D60 PolarHBondContact O-N 2.97Å; D60-R63 PolarHBondContact O-N 2.88Å; D60-N64 WeakPolarHBondContact O-CB 3.4Å; D60-N64 PolarHBondContact O-N 3.39Å
61	A	35.5	Very low	36.5	Very low	30 Å²	30	122.8 Å²	122.8	25%	0.248	66%	0.655	C	S	.	*	H	α-helix	trans	-64.3	-40.1	173.5	0	0	0	0	0	111.7	T56 N57 I58 Q65	T56-A61 HydrophobicContact CG2-CB 4.11Å; N57-A61 PolarHBondContact O-N 2.88Å; I58-A61 PolarHBondContact O-N 3.29Å; A61-Q65 WeakPolarHBondContact O-CB 3.25Å; A61-Q65 WeakPolarHBondContact O-CG 3.31Å; A61-Q65 PolarHBondContact O-N 3.45Å
62	V	44.4	Very low	36	Very low	101 Å²	101	125.5 Å²	125.5	61%	0.612	66%	0.656	S	S	*	*	H	α-helix	trans	-71	-31	175.7	174.2	0	0	0	0	112.1	I58	I58-V62 HydrophobicContact CG2-CG2 4.28Å; I58-V62 WeakPolarHBondContact O-CB 3.33Å; I58-V62 WeakPolarHBondContact O-CG2 3.26Å; I58-V62 PolarHBondContact O-N 3.4Å
63	R	39.8	Very low	35.9	Very low	181 Å²	181	123.4 Å²	123.4	68%	0.683	64%	0.641	S	S	*	*	H	α-helix	trans	-71.8	-41.8	173.9	-78.4	170.9	176	-167.2	-2.1	112.2	F59 D60 S66	F59-R63 WeakPolarHBondContact O-CB 3.49Å; F59-R63 WeakPolarHBondContact O-CD 3.16Å; F59-R63 WeakPolarHBondContact O-CG 3.19Å; F59-R63 PolarHBondContact O-N 3.45Å; F59-R63 VanDerWaalsContact O-N 3.14Å; D60-R63 PolarHBondContact O-N 2.88Å; R63-S66 PolarHBondContact O-OG 3.28Å
64	N	34.8	Very low	35.4	Very low	141 Å²	141	119.9 Å²	119.9	75%	0.754	64%	0.635	S	S	*	*	H	α-helix	trans	-87.6	-26.9	-175.6	-70.9	-14.5	0	0	0	113.8	D60 S66	D60-N64 WeakPolarHBondContact O-CB 3.4Å; D60-N64 PolarHBondContact O-N 3.39Å; N64-S66 PolarHBondContact O-N 2.88Å; N64-S66 VanDerWaalsContact O-N 3.13Å
65	Q	31.1	Very low	34.8	Very low	151 Å²	151	120 Å²	120	71%	0.706	63%	0.63	S	S	*	*			trans	-84.9	66.5	161.4	-62.1	-175	2.8	0	0	107.9	A61 P67	A61-Q65 WeakPolarHBondContact O-CB 3.25Å; A61-Q65 WeakPolarHBondContact O-CG 3.31Å; A61-Q65 PolarHBondContact O-N 3.45Å; Q65-P67 WeakPolarHBondContact O-CD 3.39Å
66	S	31.8	Very low	34.2	Very low	93 Å²	93	119.4 Å²	119.4	65%	0.65	62%	0.621	S	S	*	*			trans	-76.2	97.2	153.4	-68.6	0	0	0	0	105.2	R63 N64 T68	R63-S66 PolarHBondContact O-OG 3.28Å; N64-S66 PolarHBondContact O-N 2.88Å; N64-S66 VanDerWaalsContact O-N 3.13Å; S66-T68 PolarHBondContact O-N 2.92Å; S66-T68 VanDerWaalsContact O-N 3.16Å
67	P	31.9	Very low	34.3	Very low	70 Å²	70	125.4 Å²	125.4	46%	0.455	64%	0.641	S	S	.	*			trans	-66.6	127.5	171.3	-10.7	33.5	0	0	0	102.9	Q65 Y69	Q65-P67 WeakPolarHBondContact O-CD 3.39Å; P67-Y69 HydrophobicContact CB-CD2 3.69Å; P67-Y69 HydrophobicContact CB-CE1 4.5Å; P67-Y69 HydrophobicContact CB-CE2 3.54Å; P67-Y69 HydrophobicContact CB-CG 4.27Å; P67-Y69 HydrophobicContact CG-CD2 3.84Å; P67-Y69 HydrophobicContact CG-CE2 3.27Å; P67-Y69 WeakPolarHBondContact O-CD2 3.43Å; P67-Y69 PolarHBondContact O-N 3.43Å
68	T	28.3	Very low	33.8	Very low	144 Å²	144	122.8 Å²	122.8	88%	0.883	63%	0.633	S	S	*	*			trans	-55.1	77.6	157.6	29.9	0	0	0	0	107.4	S66 Q70	S66-T68 PolarHBondContact O-N 2.92Å; S66-T68 VanDerWaalsContact O-N 3.16Å; T68-Q70 PolarHBondContact O-N 3.06Å
69	Y	29.4	Very low	33.2	Very low	187 Å²	187	118.7 Å²	118.7	73%	0.733	61%	0.612	S	S	*	*			trans	-70.7	92.1	169.4	-80.1	-71.3	0	0	0	104.4	P67 N71	P67-Y69 HydrophobicContact CB-CD2 3.69Å; P67-Y69 HydrophobicContact CB-CE1 4.5Å; P67-Y69 HydrophobicContact CB-CE2 3.54Å; P67-Y69 HydrophobicContact CB-CG 4.27Å; P67-Y69 HydrophobicContact CG-CD2 3.84Å; P67-Y69 HydrophobicContact CG-CE2 3.27Å; P67-Y69 WeakPolarHBondContact O-CD2 3.43Å; P67-Y69 PolarHBondContact O-N 3.43Å; Y69-N71 VanDerWaalsContact C-N 3.26Å; Y69-N71 PolarHBondContact O-N 2.87Å
70	Q	26.9	Very low	32.6	Very low	180 Å²	180	118.6 Å²	118.6	84%	0.841	61%	0.612	S	S	*	*			trans	-44.6	102.6	152.1	-85.3	-175.7	-26.8	0	0	107	T68 K72	T68-Q70 PolarHBondContact O-N 3.06Å; Q70-K72 PolarHBondContact O-N 3.24Å
71	N	32	Very low	32.9	Very low	139 Å²	139	116.8 Å²	116.8	74%	0.743	60%	0.604	S	S	*	*	S	Bend	trans	21.6	53.9	151.1	-153.2	-10.4	0	0	0	116.1	Y69 V73	Y69-N71 VanDerWaalsContact C-N 3.26Å; Y69-N71 PolarHBondContact O-N 2.87Å; N71-V73 VanDerWaalsContact OD1-CG2 3.23Å; N71-V73 WeakPolarHBondContact OD1-CG2 3.24Å
72	K	27.6	Very low	32.9	Very low	184 Å²	184	117.5 Å²	117.5	80%	0.8	61%	0.61	S	S	*	*			trans	-101.6	85.4	160.9	-99.6	-171.1	177.1	-177.1	0	104.5	Q70 S74	Q70-K72 PolarHBondContact O-N 3.24Å; K72-S74 PolarHBondContact O-N 2.85Å
73	V	33.2	Very low	32.6	Very low	66 Å²	66	118.8 Å²	118.8	40%	0.4	62%	0.618	S	S	.	*			trans	-63.7	79	163.3	-127.2	0	0	0	0	106.6	N71 N75 P81	N71-V73 VanDerWaalsContact OD1-CG2 3.23Å; N71-V73 WeakPolarHBondContact OD1-CG2 3.24Å; V73-N75 PolarHBondContact O-N 3.15Å; V73-N75 VanDerWaalsContact O-N 3.09Å; V73-P81 HydrophobicContact CB-CG 3.78Å; V73-P81 HydrophobicContact CG1-CB 3.93Å; V73-P81 HydrophobicContact CG1-CG 3.34Å; V73-P81 HydrophobicContact CG2-CG 4.35Å
74	S	30.7	Very low	32.4	Very low	99 Å²	99	111.4 Å²	111.4	69%	0.692	60%	0.598	S	S	*	*			trans	-70.9	103	168.8	53.2	0	0	0	0	106.1	K72 L76	K72-S74 PolarHBondContact O-N 2.85Å; S74-L76 PolarHBondContact O-N 2.99Å
75	N	30	Very low	32.6	Very low	106 Å²	106	110.4 Å²	110.4	57%	0.567	60%	0.602	S	S	*	*			trans	-28.7	104.9	168.6	-75.9	-16.6	0	0	0	111.3	V73 F77	V73-N75 PolarHBondContact O-N 3.15Å; V73-N75 VanDerWaalsContact O-N 3.09Å; N75-F77 PolarHBondContact O-N 3.09Å
76	L	33.9	Very low	33	Very low	134 Å²	134	109.3 Å²	109.3	70%	0.702	60%	0.597	S	S	*	*	S	Bend	trans	-67.5	115.4	151.4	-103.3	74.3	0	0	0	105.4	S74 G78 L79	S74-L76 PolarHBondContact O-N 2.99Å; L76-G78 PolarHBondContact O-N 3.48Å; L76-L79 PolarHBondContact O-N 3.18Å
77	F	39.3	Very low	33.4	Very low	200 Å²	200	107.3 Å²	107.3	88%	0.877	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	31.2	82.5	163.2	-74.4	-86.1	0	0	0	115.7	N75 L79	N75-F77 PolarHBondContact O-N 3.09Å; F77-L79 PolarHBondContact O-N 3.12Å
78	G	31.1	Very low	33.6	Very low	26 Å²	26	109.9 Å²	109.9	27%	0.268	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	61.4	16.6	166.6	0	0	0	0	0	115.9	L76 D94	L76-G78 PolarHBondContact O-N 3.48Å; G78-D94 WeakPolarHBondContact CA-OD2 3.49Å; G78-D94 PolarHBondContact O-N 2.99Å; G78-D94 VanDerWaalsContact O-OD1 3.12Å
79	L	32.3	Very low	34.1	Very low	37 Å²	37	107.9 Å²	107.9	19%	0.194	57%	0.569	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.1	105.9	174.8	-63.5	169.7	0	0	0	109.1	L76 F77 P81 L91 R92	L76-L79 PolarHBondContact O-N 3.18Å; F77-L79 PolarHBondContact O-N 3.12Å; L79-P81 WeakPolarHBondContact O-CD 3.2Å; L79-L91 HydrophobicContact CB-CB 4.12Å; L79-L91 HydrophobicContact CB-CD2 4.09Å; L79-L91 HydrophobicContact CD1-CB 4.08Å; L79-L91 HydrophobicContact CD1-CD1 4.2Å; L79-L91 HydrophobicContact CD2-CB 4.29Å; L79-L91 HydrophobicContact CG-CB 4.39Å; L79-R92 VanDerWaalsContact CA-O 3.3Å; L79-R92 WeakPolarHBondContact CA-O 3.37Å; L79-R92 VanDerWaalsContact CD2-O 3.29Å; L79-R92 WeakPolarHBondContact CD2-O 3.48Å
80	K	29.8	Very low	34.8	Very low	148 Å²	148	101.2 Å²	101.2	64%	0.643	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.7	170.1	-71.7	-172.9	-176.6	175.4	0	108.3	A82 R92	K80-A82 PolarHBondContact O-N 3.27Å; K80-A82 VanDerWaalsContact O-N 3.15Å; K80-R92 PolarHBondContact N-O 2.79Å
81	P	36.6	Very low	35.5	Very low	35 Å²	35	94.4 Å²	94.4	23%	0.227	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	110.8	172.4	22	-18	0	0	0	108.2	V73 L79 L91	V73-P81 HydrophobicContact CB-CG 3.78Å; V73-P81 HydrophobicContact CG1-CB 3.93Å; V73-P81 HydrophobicContact CG1-CG 3.34Å; V73-P81 HydrophobicContact CG2-CG 4.35Å; L79-P81 WeakPolarHBondContact O-CD 3.2Å; P81-L91 HydrophobicContact CB-CD2 4.29Å
82	A	35.2	Very low	35.8	Very low	46 Å²	46	93.4 Å²	93.4	38%	0.38	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	113.1	162.1	0	0	0	0	0	106.8	K80 G84 I90	K80-A82 PolarHBondContact O-N 3.27Å; K80-A82 VanDerWaalsContact O-N 3.15Å; A82-G84 PolarHBondContact O-N 2.92Å; A82-G84 VanDerWaalsContact O-N 3.14Å; A82-I90 HydrophobicContact CB-CB 4.43Å; A82-I90 PolarHBondContact N-O 2.88Å; A82-I90 PolarHBondContact O-N 2.8Å
83	V	39	Very low	36.4	Very low	127 Å²	127	85.5 Å²	85.5	77%	0.77	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	102.4	169	-175.6	0	0	0	0	106
84	G	34.8	Very low	36.6	Very low	27 Å²	27	88.2 Å²	88.2	28%	0.278	48%	0.48	S	S	.	.			trans	-68	142.1	163.4	0	0	0	0	0	108.7	A82 E86	A82-G84 PolarHBondContact O-N 2.92Å; A82-G84 VanDerWaalsContact O-N 3.14Å; G84-E86 PolarHBondContact O-N 3.11Å
85	S	39.2	Very low	37.1	Very low	120 Å²	120	88.8 Å²	88.8	84%	0.839	48%	0.476	S	S	*	.	S	Bend	trans	-59.2	-25.4	171.5	46.8	0	0	0	0	112.6
86	E	39.5	Very low	37.6	Very low	128 Å²	128	90.6 Å²	90.6	60%	0.598	48%	0.481	S	S	*	.	S	Bend	trans	-93.7	98.9	-179.5	-60.4	-68.7	142	0	0	108.7	G84 Y88	G84-E86 PolarHBondContact O-N 3.11Å; E86-Y88 HydrophobicContact CB-CD2 4.45Å; E86-Y88 WeakPolarHBondContact O-CA 3.35Å; E86-Y88 WeakPolarHBondContact O-CB 3.11Å; E86-Y88 WeakPolarHBondContact O-CD2 3.45Å; E86-Y88 PolarHBondContact O-N 2.98Å
87	G	40.9	Very low	38	Very low	51 Å²	51	88.4 Å²	88.4	53%	0.526	48%	0.477	S	S	.	.	S	Bend	trans	41.3	4.8	151.3	0	0	0	0	0	122.4	S104	G87-S104 WeakPolarHBondContact O-CA 3.08Å; G87-S104 VanDerWaalsContact O-CB 3.26Å; G87-S104 WeakPolarHBondContact O-CB 3.46Å; G87-S104 PolarHBondContact O-N 3.27Å
88	Y	36.5	Very low	37.8	Very low	123 Å²	123	80.9 Å²	80.9	48%	0.482	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	135.2	-161.5	-63.5	-83.1	0	0	0	108.3	E86 V101 I102 P103	E86-Y88 HydrophobicContact CB-CD2 4.45Å; E86-Y88 WeakPolarHBondContact O-CA 3.35Å; E86-Y88 WeakPolarHBondContact O-CB 3.11Å; E86-Y88 WeakPolarHBondContact O-CD2 3.45Å; E86-Y88 PolarHBondContact O-N 2.98Å; Y88-V101 HydrophobicContact CD1-CG1 3.8Å; Y88-V101 HydrophobicContact CG-CG1 4.04Å; Y88-I102 CarbonylContact C-O 3.53Å; Y88-I102 WeakPolarHBondContact CA-O 3.48Å; Y88-P103 HydrophobicContact CD1-CB 4.16Å; Y88-P103 HydrophobicContact CD1-CG 4.32Å; Y88-P103 HydrophobicContact CE1-CB 4.09Å; Y88-P103 HydrophobicContact CE1-CG 4.17Å
89	R	37.8	Very low	38	Very low	102 Å²	102	82.7 Å²	82.7	39%	0.385	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	118.4	174.9	-157.6	-178.2	-68.8	-132.1	1.4	107.8	I102	R89-I102 HydrophobicContact CB-CB 4.42Å; R89-I102 PolarHBondContact N-O 3.29Å; R89-I102 PolarHBondContact O-N 2.82Å
90	I	44	Very low	38.4	Very low	47 Å²	47	88 Å²	88	24%	0.241	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	120.5	177.4	-53.4	175.8	0	0	0	107.9	A82 R92 Y100 V101	A82-I90 HydrophobicContact CB-CB 4.43Å; A82-I90 PolarHBondContact N-O 2.88Å; A82-I90 PolarHBondContact O-N 2.8Å; I90-R92 HydrophobicContact CG2-CG 3.98Å; I90-Y100 WeakPolarHBondContact CA-O 3.44Å; I90-V101 HydrophobicContact CG1-CG2 4.48Å
91	L	42.6	Very low	39	Very low	37 Å²	37	84.8 Å²	84.8	19%	0.194	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	115	171.1	-64.7	173.8	0	0	0	108	L79 P81 A99 Y100 I102	L79-L91 HydrophobicContact CB-CB 4.12Å; L79-L91 HydrophobicContact CB-CD2 4.09Å; L79-L91 HydrophobicContact CD1-CB 4.08Å; L79-L91 HydrophobicContact CD1-CD1 4.2Å; L79-L91 HydrophobicContact CD2-CB 4.29Å; L79-L91 HydrophobicContact CG-CB 4.39Å; P81-L91 HydrophobicContact CB-CD2 4.29Å; L91-A99 CarbonylContact O-C 3.36Å; L91-A99 WeakPolarHBondContact O-CA 3.29Å; L91-Y100 PolarHBondContact N-O 2.8Å; L91-Y100 PolarHBondContact O-N 3.08Å; L91-I102 HydrophobicContact CD1-CD1 3.57Å; L91-I102 HydrophobicContact CG-CD1 4.35Å
92	R	37	Very low	39.4	Very low	119 Å²	119	87 Å²	87	45%	0.449	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	137.2	175.7	-66.2	-173	-179.3	-178.3	0.1	110.5	L79 K80 I90 E96 S98 A99	L79-R92 VanDerWaalsContact CA-O 3.3Å; L79-R92 WeakPolarHBondContact CA-O 3.37Å; L79-R92 VanDerWaalsContact CD2-O 3.29Å; L79-R92 WeakPolarHBondContact CD2-O 3.48Å; K80-R92 PolarHBondContact N-O 2.79Å; I90-R92 HydrophobicContact CG2-CG 3.98Å; R92-E96 IonicContact NH1-OE1 3.83Å; R92-S98 WeakPolarHBondContact CA-O 3.34Å; R92-A99 HydrophobicContact CG-CB 4.3Å
93	S	40.1	Very low	39.5	Very low	17 Å²	17	88.6 Å²	88.6	12%	0.119	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	152	169.4	56.7	0	0	0	0	111.6	D95 E96 S97 S98	S93-D95 WeakPolarHBondContact CB-OD1 3.09Å; S93-D95 PolarHBondContact O-N 2.77Å; S93-D95 PolarHBondContact OG-OD1 3.4Å; S93-E96 WeakPolarHBondContact O-CA 3.32Å; S93-E96 PolarHBondContact O-N 3.35Å; S93-S97 PolarHBondContact OG-N 3.16Å; S93-S97 PolarHBondContact OG-OG 2.91Å; S93-S98 WeakPolarHBondContact CB-OG 3.38Å; S93-S98 PolarHBondContact N-O 2.75Å; S93-S98 PolarHBondContact OG-N 2.87Å; S93-S98 PolarHBondContact OG-O 2.75Å; S93-S98 PolarHBondContact OG-OG 2.91Å; S93-S98 VanDerWaalsContact OG-OG 3.05Å
94	D	37.3	Very low	39.6	Very low	123 Å²	123	84.6 Å²	84.6	66%	0.658	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.7	179.5	-72.7	-40.1	0	0	0	113.2	G78	G78-D94 WeakPolarHBondContact CA-OD2 3.49Å; G78-D94 PolarHBondContact O-N 2.99Å; G78-D94 VanDerWaalsContact O-OD1 3.12Å
95	D	41.9	Very low	39.8	Very low	112 Å²	112	89.9 Å²	89.9	60%	0.599	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	3.9	175.3	69	-17.7	0	0	0	113.6	S93 S97	S93-D95 WeakPolarHBondContact CB-OD1 3.09Å; S93-D95 PolarHBondContact O-N 2.77Å; S93-D95 PolarHBondContact OG-OD1 3.4Å; D95-S97 PolarHBondContact O-N 3.47Å; D95-S97 PolarHBondContact OD1-N 3.35Å; D95-S97 PolarHBondContact OD1-OG 2.9Å; D95-S97 VanDerWaalsContact OD2-CB 3.31Å; D95-S97 WeakPolarHBondContact OD2-CB 3.3Å; D95-S97 PolarHBondContact OD2-OG 2.93Å
96	E	40	Very low	39.6	Very low	143 Å²	143	87.2 Å²	87.2	67%	0.668	48%	0.479	S	S	*	.	S	Bend	trans	56	10.3	-175.5	-56.4	-165.7	138.4	0	0	115.8	R92 S93 S98	R92-E96 IonicContact NH1-OE1 3.83Å; S93-E96 WeakPolarHBondContact O-CA 3.32Å; S93-E96 PolarHBondContact O-N 3.35Å; E96-S98 PolarHBondContact O-N 2.86Å
97	S	43	Very low	39.2	Very low	89 Å²	89	86.6 Å²	86.6	62%	0.622	48%	0.484	S	S	*	.	S	Bend	trans	-69.5	-22.3	-178.6	66.7	0	0	0	0	113.5	S93 D95	S93-S97 PolarHBondContact OG-N 3.16Å; S93-S97 PolarHBondContact OG-OG 2.91Å; D95-S97 PolarHBondContact O-N 3.47Å; D95-S97 PolarHBondContact OD1-N 3.35Å; D95-S97 PolarHBondContact OD1-OG 2.9Å; D95-S97 VanDerWaalsContact OD2-CB 3.31Å; D95-S97 WeakPolarHBondContact OD2-CB 3.3Å; D95-S97 PolarHBondContact OD2-OG 2.93Å
98	S	34.9	Very low	38.7	Very low	41 Å²	41	91 Å²	91	29%	0.287	50%	0.5	S	S	.	.			trans	-140.6	137	-176.4	59.4	0	0	0	0	112.2	R92 S93 E96	R92-S98 WeakPolarHBondContact CA-O 3.34Å; S93-S98 WeakPolarHBondContact CB-OG 3.38Å; S93-S98 PolarHBondContact N-O 2.75Å; S93-S98 PolarHBondContact OG-N 2.87Å; S93-S98 PolarHBondContact OG-O 2.75Å; S93-S98 PolarHBondContact OG-OG 2.91Å; S93-S98 VanDerWaalsContact OG-OG 3.05Å; E96-S98 PolarHBondContact O-N 2.86Å
99	A	36.1	Very low	38.1	Very low	65 Å²	65	90 Å²	90	54%	0.537	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	126.8	175.1	0	0	0	0	0	109.8	L91 R92	L91-A99 CarbonylContact O-C 3.36Å; L91-A99 WeakPolarHBondContact O-CA 3.29Å; R92-A99 HydrophobicContact CG-CB 4.3Å
100	Y	40.9	Very low	37.6	Very low	147 Å²	147	90.9 Å²	90.9	58%	0.576	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	123.7	173.5	-64.5	-88.5	0	0	0	109.1	I90 L91	I90-Y100 WeakPolarHBondContact CA-O 3.44Å; L91-Y100 PolarHBondContact N-O 2.8Å; L91-Y100 PolarHBondContact O-N 3.08Å
101	V	41.3	Very low	36.7	Very low	82 Å²	82	97.1 Å²	97.1	50%	0.497	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.6	114.1	175.4	-175.4	0	0	0	0	107.9	Y88 I90	Y88-V101 HydrophobicContact CD1-CG1 3.8Å; Y88-V101 HydrophobicContact CG-CG1 4.04Å; I90-V101 HydrophobicContact CG1-CG2 4.48Å
102	I	44.6	Very low	35.8	Very low	80 Å²	80	103.1 Å²	103.1	41%	0.41	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106	122.5	176.8	-57	176	0	0	0	107.7	Y88 R89 L91 S104	Y88-I102 CarbonylContact C-O 3.53Å; Y88-I102 WeakPolarHBondContact CA-O 3.48Å; R89-I102 HydrophobicContact CB-CB 4.42Å; R89-I102 PolarHBondContact N-O 3.29Å; R89-I102 PolarHBondContact O-N 2.82Å; L91-I102 HydrophobicContact CD1-CD1 3.57Å; L91-I102 HydrophobicContact CG-CD1 4.35Å; I102-S104 PolarHBondContact O-N 2.85Å; I102-S104 VanDerWaalsContact O-N 3.14Å
103	P	38.6	Very low	35.2	Very low	80 Å²	80	104 Å²	104	52%	0.519	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-56.2	120.2	168.1	-18.2	29.2	0	0	0	109.5	Y88 T105	Y88-P103 HydrophobicContact CD1-CB 4.16Å; Y88-P103 HydrophobicContact CD1-CG 4.32Å; Y88-P103 HydrophobicContact CE1-CB 4.09Å; Y88-P103 HydrophobicContact CE1-CG 4.17Å; P103-T105 PolarHBondContact O-N 3.44Å
104	S	40.2	Very low	34.4	Very low	44 Å²	44	109.8 Å²	109.8	31%	0.308	62%	0.621	S	S	.	*			trans	-73.9	96.4	178.4	-173	0	0	0	0	108.2	G87 I102 A106	G87-S104 WeakPolarHBondContact O-CA 3.08Å; G87-S104 VanDerWaalsContact O-CB 3.26Å; G87-S104 WeakPolarHBondContact O-CB 3.46Å; G87-S104 PolarHBondContact O-N 3.27Å; I102-S104 PolarHBondContact O-N 2.85Å; I102-S104 VanDerWaalsContact O-N 3.14Å; S104-A106 PolarHBondContact O-N 2.97Å
105	T	39.6	Very low	33.8	Very low	137 Å²	137	109 Å²	109	84%	0.84	62%	0.622	S	S	*	*			trans	-69.9	4.7	174.6	50.5	0	0	0	0	113.3	P103 T107	P103-T105 PolarHBondContact O-N 3.44Å; T105-T107 PolarHBondContact O-N 2.96Å
106	A	33.8	Very low	33.2	Very low	65 Å²	65	109.4 Å²	109.4	54%	0.537	62%	0.623	S	S	.	*			trans	-100.4	71.7	179.8	0	0	0	0	0	111.4	S104	S104-A106 PolarHBondContact O-N 2.97Å
107	T	31.5	Very low	32.5	Very low	114 Å²	114	108.9 Å²	108.9	70%	0.699	63%	0.625	S	S	*	*			trans	-164.2	87.6	131.6	39.1	0	0	0	0	108.3	T105 T109	T105-T107 PolarHBondContact O-N 2.96Å; T107-T109 PolarHBondContact O-N 3.22Å
108	T	30.1	Very low	32	Very low	143 Å²	143	111.2 Å²	111.2	88%	0.877	63%	0.631	S	S	*	*			trans	-64.6	63.1	146.5	47	0	0	0	0	108.9
109	T	25.6	Very low	31.8	Very low	103 Å²	103	116.4 Å²	116.4	63%	0.632	66%	0.655	S	S	*	*			trans	-77.5	117.7	143.9	15.2	0	0	0	0	104.4	T107 Q111	T107-T109 PolarHBondContact O-N 3.22Å; T109-Q111 PolarHBondContact O-N 3.19Å; T109-Q111 VanDerWaalsContact O-N 3.08Å
110	P	25.8	Very low	31.7	Very low	120 Å²	120	119.4 Å²	119.4	78%	0.779	66%	0.662	S	S	*	*			trans	-52	123	-176.5	19.7	-30.5	0	0	0	108.4	K112	P110-K112 PolarHBondContact O-N 3.37Å
111	Q	25.9	Very low	31.6	Very low	178 Å²	178	120.3 Å²	120.3	83%	0.832	67%	0.671	S	S	*	*			trans	-42.3	106.3	175.5	-84	175.5	-53.4	0	0	108.4	T109 T113	T109-Q111 PolarHBondContact O-N 3.19Å; T109-Q111 VanDerWaalsContact O-N 3.08Å; Q111-T113 VanDerWaalsContact C-N 3.32Å; Q111-T113 PolarHBondContact O-N 3.27Å
112	K	23.7	Very low	31.4	Very low	163 Å²	163	122.7 Å²	122.7	71%	0.709	68%	0.681	S	S	*	*			trans	-61.8	108.5	157.8	-168.3	169.9	174	-170.5	0	103.6	P110 F114	P110-K112 PolarHBondContact O-N 3.37Å; K112-F114 HydrophobicContact CB-CD2 4.27Å; K112-F114 HydrophobicContact CB-CE2 4.16Å; K112-F114 HydrophobicContact CD-CD2 4.4Å; K112-F114 HydrophobicContact CD-CE2 3.52Å; K112-F114 HydrophobicContact CD-CZ 3.89Å; K112-F114 HydrophobicContact CG-CD2 4.12Å; K112-F114 HydrophobicContact CG-CE2 3.71Å; K112-F114 HydrophobicContact CG-CZ 4.25Å; K112-F114 PolarHBondContact O-N 3.09Å
113	T	23.6	Very low	30.9	Very low	137 Å²	137	120.7 Å²	120.7	84%	0.84	68%	0.68	S	S	*	*			trans	-54.5	89.4	175.8	-39.3	0	0	0	0	107.6	Q111	Q111-T113 VanDerWaalsContact C-N 3.32Å; Q111-T113 PolarHBondContact O-N 3.27Å
114	F	24.5	Very low	31	Very low	140 Å²	140	123.2 Å²	123.2	61%	0.614	69%	0.685	S	S	*	*			trans	-97.6	132.9	158.8	-75.4	-70.8	0	0	0	106.2	K112 I116	K112-F114 HydrophobicContact CB-CD2 4.27Å; K112-F114 HydrophobicContact CB-CE2 4.16Å; K112-F114 HydrophobicContact CD-CD2 4.4Å; K112-F114 HydrophobicContact CD-CE2 3.52Å; K112-F114 HydrophobicContact CD-CZ 3.89Å; K112-F114 HydrophobicContact CG-CD2 4.12Å; K112-F114 HydrophobicContact CG-CE2 3.71Å; K112-F114 HydrophobicContact CG-CZ 4.25Å; K112-F114 PolarHBondContact O-N 3.09Å; F114-I116 PolarHBondContact O-N 2.91Å; F114-I116 VanDerWaalsContact O-N 3.17Å
115	P	25	Very low	31.3	Very low	105 Å²	105	125.9 Å²	125.9	68%	0.682	70%	0.696	S	S	*	*			trans	-59.3	124.3	179.5	25.4	-30.7	0	0	0	107.5	D117	P115-D117 VanDerWaalsContact C-N 3.3Å; P115-D117 PolarHBondContact O-N 2.64Å
116	I	28.5	Very low	31.4	Very low	122 Å²	122	125.1 Å²	125.1	63%	0.626	68%	0.683	S	S	*	*			trans	-70.5	96	172	-60.8	169.1	0	0	0	105.3	F114 N118	F114-I116 PolarHBondContact O-N 2.91Å; F114-I116 VanDerWaalsContact O-N 3.17Å; I116-N118 WeakPolarHBondContact CG2-OD1 3.32Å; I116-N118 PolarHBondContact O-N 3.3Å
117	D	24.7	Very low	31.9	Very low	132 Å²	132	125.8 Å²	125.8	71%	0.706	68%	0.68	S	S	*	*			trans	-64.5	107.5	153.5	-76.2	-30.9	0	0	0	105.5	P115 D119	P115-D117 VanDerWaalsContact C-N 3.3Å; P115-D117 PolarHBondContact O-N 2.64Å; D117-D119 PolarHBondContact O-N 2.83Å
118	N	32.7	Very low	32.5	Very low	137 Å²	137	126.7 Å²	126.7	73%	0.733	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	19.1	-172.8	-78.1	-45.4	0	0	0	114.7	I116	I116-N118 WeakPolarHBondContact CG2-OD1 3.32Å; I116-N118 PolarHBondContact O-N 3.3Å
119	D	31.1	Very low	33	Very low	151 Å²	151	123.7 Å²	123.7	81%	0.807	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	3.9	-168.3	-69.1	-15.8	0	0	0	114.2	D117	D117-D119 PolarHBondContact O-N 2.83Å
120	L	34.4	Very low	33.5	Very low	128 Å²	128	124.7 Å²	124.7	67%	0.67	65%	0.646	S	S	*	*	S	Bend	trans	-109.6	-13.4	-177.1	-87	148.8	0	0	0	116.2
121	E	37.8	Very low	34.1	Very low	165 Å²	165	125.8 Å²	125.8	77%	0.771	64%	0.64	S	S	*	*	H	α-helix	trans	-79.9	-26.7	-176.1	-72.6	-167.3	169	0	0	114.5
122	D	38.4	Very low	34.6	Very low	132 Å²	132	121 Å²	121	71%	0.706	62%	0.619	S	S	*	*	H	α-helix	trans	-76.3	-37.6	-176.9	-72.8	-13.3	0	0	0	112	E126	D122-E126 WeakPolarHBondContact O-CB 3.46Å; D122-E126 PolarHBondContact O-N 3.45Å
123	G	33.3	Very low	35.2	Very low	39 Å²	39	118.7 Å²	118.7	40%	0.402	61%	0.614	S	S	.	*	H	α-helix	trans	-69	-39.7	-174.7	0	0	0	0	0	114.3	T127	G123-T127 VanDerWaalsContact O-CB 3.31Å; G123-T127 WeakPolarHBondContact O-CB 3.29Å; G123-T127 PolarHBondContact O-N 3.08Å; G123-T127 PolarHBondContact O-OG1 3.14Å
124	E	41.7	Very low	35.4	Very low	132 Å²	132	115.2 Å²	115.2	62%	0.617	61%	0.605	S	S	*	*	H	α-helix	trans	-75.1	-38.3	-178.4	-68.3	-168.5	168.9	0	0	112.3	T127 W128	E124-T127 PolarHBondContact O-N 3.32Å; E124-W128 WeakPolarHBondContact O-CB 3.12Å; E124-W128 PolarHBondContact O-N 2.9Å
125	L	46.4	Very low	35.7	Very low	101 Å²	101	113.7 Å²	113.7	53%	0.529	60%	0.603	S	S	.	*	H	α-helix	trans	-65.4	-43.1	174.3	-176.5	65.9	0	0	0	110.9	W128 I129	L125-W128 HydrophobicContact CD1-CE3 4.48Å; L125-W128 PolarHBondContact O-N 3.15Å; L125-I129 HydrophobicContact CD1-CD1 4.3Å; L125-I129 HydrophobicContact CG-CD1 3.94Å; L125-I129 WeakPolarHBondContact O-CB 3.34Å; L125-I129 VanDerWaalsContact O-CG1 3.24Å; L125-I129 WeakPolarHBondContact O-CG1 3.31Å; L125-I129 PolarHBondContact O-N 2.85Å
126	E	41.1	Very low	35.8	Very low	121 Å²	121	114.5 Å²	114.5	57%	0.565	60%	0.601	S	S	*	*	H	α-helix	trans	-65.3	-41	177.4	-156.1	165.1	-137.4	0	0	110.8	D122 W128 I129 H130	D122-E126 WeakPolarHBondContact O-CB 3.46Å; D122-E126 PolarHBondContact O-N 3.45Å; E126-W128 PolarHBondContact O-N 2.7Å; E126-I129 PolarHBondContact O-N 2.97Å; E126-H130 WeakPolarHBondContact O-CB 3.49Å; E126-H130 PolarHBondContact O-CD2 2.91Å; E126-H130 PolarHBondContact O-N 2.95Å
127	T	44.1	Very low	36	Very low	79 Å²	79	114.4 Å²	114.4	49%	0.485	60%	0.602	S	S	.	*	H	α-helix	trans	-62.7	-40.1	173.3	-53.3	0	0	0	0	112.1	G123 E124 H130 Q131	G123-T127 VanDerWaalsContact O-CB 3.31Å; G123-T127 WeakPolarHBondContact O-CB 3.29Å; G123-T127 PolarHBondContact O-N 3.08Å; G123-T127 PolarHBondContact O-OG1 3.14Å; E124-T127 PolarHBondContact O-N 3.32Å; T127-H130 PolarHBondContact O-N 3Å; T127-Q131 WeakPolarHBondContact O-CG 3.47Å; T127-Q131 PolarHBondContact O-N 2.57Å
128	W	43.4	Very low	36.1	Very low	133 Å²	133	118.2 Å²	118.2	50%	0.504	61%	0.607	S	S	.	*	H	α-helix	trans	-68.1	-43.1	177.1	-176.4	83.6	0	0	0	112.3	E124 L125 E126 H130 Q131 M132	E124-W128 WeakPolarHBondContact O-CB 3.12Å; E124-W128 PolarHBondContact O-N 2.9Å; L125-W128 HydrophobicContact CD1-CE3 4.48Å; L125-W128 PolarHBondContact O-N 3.15Å; E126-W128 PolarHBondContact O-N 2.7Å; W128-H130 VanDerWaalsContact C-N 3.3Å; W128-H130 PolarHBondContact O-N 3.21Å; W128-Q131 PolarHBondContact O-N 2.84Å; W128-M132 HydrophobicContact CD2-CG 4.2Å; W128-M132 HydrophobicContact CE3-CG 4.39Å; W128-M132 HydrophobicContact CH2-CE 3.91Å; W128-M132 HydrophobicContact CH2-CG 4.35Å; W128-M132 HydrophobicContact CZ2-CE 3.21Å; W128-M132 HydrophobicContact CZ2-CG 4.16Å; W128-M132 HydrophobicContact CZ3-CG 4.45Å; W128-M132 WeakPolarHBondContact O-CB 3.36Å; W128-M132 WeakPolarHBondContact O-CG 3.22Å; W128-M132 PolarHBondContact O-N 2.79Å
129	I	40.8	Very low	35.9	Very low	80 Å²	80	122.7 Å²	122.7	41%	0.41	61%	0.613	S	S	.	*	H	α-helix	trans	-62.1	-39.6	174	-67.4	168.1	0	0	0	110.3	L125 E126 M132 N133	L125-I129 HydrophobicContact CD1-CD1 4.3Å; L125-I129 HydrophobicContact CG-CD1 3.94Å; L125-I129 WeakPolarHBondContact O-CB 3.34Å; L125-I129 VanDerWaalsContact O-CG1 3.24Å; L125-I129 WeakPolarHBondContact O-CG1 3.31Å; L125-I129 PolarHBondContact O-N 2.85Å; E126-I129 PolarHBondContact O-N 2.97Å; I129-M132 PolarHBondContact O-N 3.32Å; I129-N133 PolarHBondContact O-N 3.04Å
130	H	36.8	Very low	35.9	Very low	123 Å²	123	121.8 Å²	121.8	57%	0.569	61%	0.608	S	S	*	*	H	α-helix	trans	-68.9	-36.9	175.7	-76.1	-57.2	0	0	0	113.4	E126 T127 W128 M132 N133	E126-H130 WeakPolarHBondContact O-CB 3.49Å; E126-H130 PolarHBondContact O-CD2 2.91Å; E126-H130 PolarHBondContact O-N 2.95Å; T127-H130 PolarHBondContact O-N 3Å; W128-H130 VanDerWaalsContact C-N 3.3Å; W128-H130 PolarHBondContact O-N 3.21Å; H130-M132 VanDerWaalsContact C-N 3.34Å; H130-N133 PolarHBondContact O-N 3.2Å
131	Q	38.5	Very low	35.4	Very low	143 Å²	143	123.6 Å²	123.6	67%	0.668	61%	0.613	S	S	*	*	H	α-helix	trans	-64.5	-39	171.2	-78	-177.6	2.7	0	0	111.8	T127 W128 G134	T127-Q131 WeakPolarHBondContact O-CG 3.47Å; T127-Q131 PolarHBondContact O-N 2.57Å; W128-Q131 PolarHBondContact O-N 2.84Å; Q131-G134 PolarHBondContact O-N 3.05Å
132	M	35.3	Very low	35	Very low	78 Å²	78	126.3 Å²	126.3	38%	0.384	62%	0.618	S	S	.	*	H	α-helix	trans	-70.6	-30.5	176.3	-73.4	-68	-158.6	0	0	113.1	W128 I129 H130 G134 I135	W128-M132 HydrophobicContact CD2-CG 4.2Å; W128-M132 HydrophobicContact CE3-CG 4.39Å; W128-M132 HydrophobicContact CH2-CE 3.91Å; W128-M132 HydrophobicContact CH2-CG 4.35Å; W128-M132 HydrophobicContact CZ2-CE 3.21Å; W128-M132 HydrophobicContact CZ2-CG 4.16Å; W128-M132 HydrophobicContact CZ3-CG 4.45Å; W128-M132 WeakPolarHBondContact O-CB 3.36Å; W128-M132 WeakPolarHBondContact O-CG 3.22Å; W128-M132 PolarHBondContact O-N 2.79Å; I129-M132 PolarHBondContact O-N 3.32Å; H130-M132 VanDerWaalsContact C-N 3.34Å; M132-G134 PolarHBondContact O-N 3.35Å; M132-G134 VanDerWaalsContact O-N 3.16Å; M132-I135 WeakPolarHBondContact O-CB 3.25Å; M132-I135 PolarHBondContact O-N 3.4Å; M132-I135 HydrophobicContact SD-CD1 3.65Å
133	N	36.4	Very low	34.4	Very low	115 Å²	115	126 Å²	126	62%	0.615	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-11.1	174.5	-92.2	-13.3	0	0	0	113.8	I129 H130 I135	I129-N133 PolarHBondContact O-N 3.04Å; H130-N133 PolarHBondContact O-N 3.2Å; N133-I135 VanDerWaalsContact C-N 3.35Å
134	G	28	Very low	34	Very low	63 Å²	63	128 Å²	128	65%	0.649	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-15.7	167.9	0	0	0	0	0	113.9	Q131 M132 D136	Q131-G134 PolarHBondContact O-N 3.05Å; M132-G134 PolarHBondContact O-N 3.35Å; M132-G134 VanDerWaalsContact O-N 3.16Å; G134-D136 PolarHBondContact O-N 3.18Å; G134-D136 VanDerWaalsContact O-N 3.15Å
135	I	31.6	Very low	33.5	Very low	109 Å²	109	126.6 Å²	126.6	56%	0.559	63%	0.631	S	S	*	*	S	Bend	trans	-79.8	99.7	172	-53.1	179.4	0	0	0	106.3	M132 N133 N137	M132-I135 WeakPolarHBondContact O-CB 3.25Å; M132-I135 PolarHBondContact O-N 3.4Å; M132-I135 HydrophobicContact SD-CD1 3.65Å; N133-I135 VanDerWaalsContact C-N 3.35Å; I135-N137 VanDerWaalsContact C-N 3.31Å; I135-N137 PolarHBondContact O-N 2.74Å
136	D	27	Very low	32.5	Very low	121 Å²	121	126.6 Å²	126.6	65%	0.647	64%	0.639	S	S	*	*			trans	-43	89.3	176.1	-92.2	-47.1	0	0	0	112	G134 R138	G134-D136 PolarHBondContact O-N 3.18Å; G134-D136 VanDerWaalsContact O-N 3.15Å; D136-R138 PolarHBondContact O-N 2.94Å
137	N	32.4	Very low	31.8	Very low	120 Å²	120	128.8 Å²	128.8	64%	0.642	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-67.2	7.1	171	-98.6	-27.8	0	0	0	112.4	I135 R139 N140	I135-N137 VanDerWaalsContact C-N 3.31Å; I135-N137 PolarHBondContact O-N 2.74Å; N137-R139 PolarHBondContact O-N 3.05Å; N137-R139 VanDerWaalsContact O-N 3.13Å; N137-N140 PolarHBondContact O-N 2.69Å
138	R	26.7	Very low	31.2	Very low	213 Å²	213	129.7 Å²	129.7	80%	0.804	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-61	-16.3	175.4	-69.3	-173.8	176.4	-161.9	0.1	113.8	D136	D136-R138 PolarHBondContact O-N 2.94Å
139	R	28.7	Very low	30.3	Very low	230 Å²	230	130.1 Å²	130.1	87%	0.868	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-92.9	-16.8	-179.5	-78	-170.8	176.7	-170	0.8	115.5	N137 E141	N137-R139 PolarHBondContact O-N 3.05Å; N137-R139 VanDerWaalsContact O-N 3.13Å; R139-E141 PolarHBondContact O-N 3.37Å
140	N	30.5	Very low	29.5	Very low	132 Å²	132	135.9 Å²	135.9	71%	0.706	68%	0.683	S	S	*	*			trans	-104.9	58.2	177	-68.4	-8.7	0	0	0	109.4	N137 Y142	N137-N140 PolarHBondContact O-N 2.69Å; N140-Y142 PolarHBondContact O-N 3.13Å
141	E	25.4	Very low	29	Very low	167 Å²	167	136.1 Å²	136.1	78%	0.78	69%	0.688	S	S	*	*			trans	-55.1	113.1	156.8	-82.1	177.6	168.5	0	0	106.8	R139 V143	R139-E141 PolarHBondContact O-N 3.37Å; E141-V143 PolarHBondContact O-N 3.21Å
142	Y	29.2	Very low	28.4	Very low	221 Å²	221	135.3 Å²	135.3	87%	0.867	69%	0.693	S	S	*	*			trans	-62.4	88.7	178.6	-158.3	-92.6	0	0	0	107.9	N140 S144	N140-Y142 PolarHBondContact O-N 3.13Å; Y142-S144 VanDerWaalsContact C-N 3.26Å; Y142-S144 PolarHBondContact O-N 2.74Å
143	V	24.2	Very low	27.9	Very low	125 Å²	125	138.2 Å²	138.2	76%	0.758	71%	0.706	S	S	*	*			trans	-69.7	94.2	170	-174.2	0	0	0	0	105.8	E141	E141-V143 PolarHBondContact O-N 3.21Å
144	S	25.4	Very low	27.6	Very low	82 Å²	82	138.8 Å²	138.8	57%	0.573	72%	0.716	S	S	*	*			trans	-50.1	126.6	168.2	-176.6	0	0	0	0	107.7	Y142 S146	Y142-S144 VanDerWaalsContact C-N 3.26Å; Y142-S144 PolarHBondContact O-N 2.74Å; S144-S146 PolarHBondContact O-N 3.39Å
145	P	31.4	Very low	27.4	Very low	102 Å²	102	146.8 Å²	146.8	66%	0.662	73%	0.728	S	S	*	*			trans	-65.8	89.2	177.5	-6.7	18.5	0	0	0	108.5	Q147	P145-Q147 PolarHBondContact O-N 2.82Å
146	S	26.4	Very low	27.3	Very low	102 Å²	102	149.8 Å²	149.8	71%	0.713	73%	0.732	S	S	*	*			trans	-63	109.7	166.7	53.3	0	0	0	0	107.1	S144	S144-S146 PolarHBondContact O-N 3.39Å
147	Q	25.8	Very low	27.4	Very low	166 Å²	166	145.9 Å²	145.9	78%	0.776	72%	0.721	S	S	*	*			trans	62	64.5	158.8	-55.7	179.1	-9.4	0	0	115.5	P145 I149	P145-Q147 PolarHBondContact O-N 2.82Å; Q147-I149 HydrophobicContact CB-CG1 4.48Å; Q147-I149 PolarHBondContact O-N 2.96Å
148	T	30.7	Very low	27.2	Very low	99 Å²	99	151.5 Å²	151.5	61%	0.607	73%	0.733	S	S	*	*			trans	-69.1	89.5	151.7	-50	0	0	0	0	107.6	W150	T148-W150 PolarHBondContact O-N 2.89Å
149	I	24.6	Very low	27.3	Very low	142 Å²	142	147.5 Å²	147.5	73%	0.728	73%	0.728	S	S	*	*			trans	-62.6	103.6	169.5	-61.4	170.3	0	0	0	106	Q147 N151	Q147-I149 HydrophobicContact CB-CG1 4.48Å; Q147-I149 PolarHBondContact O-N 2.96Å; I149-N151 PolarHBondContact O-N 2.71Å
150	W	25.5	Very low	27.2	Very low	201 Å²	201	142.8 Å²	142.8	76%	0.761	72%	0.724	S	S	*	*			trans	-62.3	104.4	176.2	-68.4	91.4	0	0	0	108.2	T148 T152	T148-W150 PolarHBondContact O-N 2.89Å; W150-T152 PolarHBondContact O-N 2.98Å
151	N	24.6	Very low	27.3	Very low	127 Å²	127	142.1 Å²	142.1	68%	0.679	73%	0.727	S	S	*	*			trans	-70	85.3	177.1	-155.1	2.1	0	0	0	107.8	I149 Q153	I149-N151 PolarHBondContact O-N 2.71Å; N151-Q153 PolarHBondContact O-N 3.42Å
152	T	27.3	Very low	27.4	Very low	126 Å²	126	145.6 Å²	145.6	77%	0.773	73%	0.733	S	S	*	*			trans	-73.5	71.8	176.1	51.3	0	0	0	0	108.9	W150 P154	W150-T152 PolarHBondContact O-N 2.98Å; T152-P154 WeakPolarHBondContact O-CD 3.27Å
153	Q	24.7	Very low	27.2	Very low	140 Å²	140	143.3 Å²	143.3	65%	0.654	73%	0.73	S	S	*	*			trans	-90.8	114.5	170.8	-77.9	-174.8	-13.1	0	0	109.4	N151	N151-Q153 PolarHBondContact O-N 3.42Å
154	P	29.1	Very low	27.3	Very low	127 Å²	127	143 Å²	143	83%	0.825	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-74	129.6	178.2	27.7	-31.3	0	0	0	111.3	T152	T152-P154 WeakPolarHBondContact O-CD 3.27Å
155	Y	25.3	Very low	27.2	Very low	231 Å²	231	146.7 Å²	146.7	91%	0.906	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-68.4	125.3	-172.8	-66.4	-96	0	0	0	113.2
156	R	28.3	Very low	26.9	Very low	171 Å²	171	148 Å²	148	65%	0.645	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-97.6	128.5	160	-90.2	-176.5	137.5	-149.4	-11.7	107.8	A186 S187	R156-A186 HydrophobicContact CB-CB 3.79Å; R156-A186 HydrophobicContact CG-CB 3.46Å; R156-A186 VanDerWaalsContact CG-CB 3.46Å; R156-A186 VanDerWaalsContact CZ-N 3.31Å; R156-S187 VanDerWaalsContact C-OG 3.27Å
157	G	28.5	Very low	26.9	Very low	40 Å²	40	149.9 Å²	149.9	41%	0.412	75%	0.754	S	S	.	*			trans	-71.3	-146.4	-169.9	0	0	0	0	0	117.5	S187	G157-S187 VanDerWaalsContact CA-CB 3.47Å; G157-S187 WeakPolarHBondContact CA-OG 3.33Å; G157-S187 PolarHBondContact N-O 3.1Å; G157-S187 PolarHBondContact N-OG 3.42Å; G157-S187 WeakPolarHBondContact O-CB 2.93Å; G157-S187 PolarHBondContact O-OG 2.98Å
158	W	29.7	Very low	26.8	Very low	238 Å²	238	147.5 Å²	147.5	90%	0.902	76%	0.756	S	S	*	*			trans	-106.6	138.6	-163.7	-70.1	52	0	0	0	113.6	S187	W158-S187 WeakPolarHBondContact O-CB 3.33Å
159	N	27.7	Very low	26.5	Very low	129 Å²	129	149.9 Å²	149.9	69%	0.69	76%	0.758	S	S	*	*			trans	-155.2	98.3	150	-100.3	-14	0	0	0	111
160	V	27.1	Very low	26.4	Very low	130 Å²	130	150.6 Å²	150.6	79%	0.788	76%	0.758	S	S	*	*			trans	47.6	130.9	140.1	-157.8	0	0	0	0	120.2
161	P	32.7	Very low	26.2	Very low	118 Å²	118	148.9 Å²	148.9	77%	0.766	76%	0.758	S	S	*	*			trans	-92.2	150.5	-163.2	35.1	-29.3	0	0	0	114.3
162	R	26.2	Very low	26.3	Very low	240 Å²	240	149 Å²	149	91%	0.906	76%	0.764	S	S	*	*			trans	-121.4	120	163.3	-75	-170.8	176	-166.4	-0.3	109.9
163	H	25.8	Very low	26.2	Very low	173 Å²	173	148 Å²	148	80%	0.801	76%	0.762	S	S	*	*			trans	-7.4	133.8	160.8	-45.8	-78.3	0	0	0	118.8
164	S	25.5	Very low	26.4	Very low	118 Å²	118	147.5 Å²	147.5	83%	0.825	77%	0.771	S	S	*	*				161.1	137.2	102.6	51.7	0	0	0	0	112
165	N	23.3	Very low	26.4	Very low	160 Å²	160	147.2 Å²	147.2	86%	0.856	77%	0.769	S	S	*	*			trans	-83.4	122.9	173.9	-69.6	-35	0	0	0	110
166	T	25.4	Very low	26.6	Very low	131 Å²	131	145.4 Å²	145.4	80%	0.804	77%	0.769	S	S	*	*			trans	-164	109.7	139.5	-0.9	0	0	0	0	111
167	L	26.9	Very low	26.5	Very low	141 Å²	141	148.4 Å²	148.4	74%	0.738	78%	0.78	S	S	*	*			trans	-73.5	122.5	162	-75.1	103.7	0	0	0	108.6	F169	L167-F169 HydrophobicContact CB-CD2 4.24Å; L167-F169 HydrophobicContact CB-CE2 3.88Å; L167-F169 HydrophobicContact CD2-CD2 4.39Å; L167-F169 HydrophobicContact CD2-CE2 3.38Å; L167-F169 HydrophobicContact CD2-CZ 3.48Å; L167-F169 VanDerWaalsContact CD2-CZ 3.48Å; L167-F169 HydrophobicContact CG-CE2 4.27Å
168	S	23.3	Very low	26.4	Very low	115 Å²	115	154.6 Å²	154.6	80%	0.804	80%	0.798	S	S	*	*			trans	-126.6	118.3	161.7	-54.7	0	0	0	0	107.9
169	F	24.9	Very low	26.3	Very low	150 Å²	150	150.6 Å²	150.6	66%	0.658	79%	0.793	S	S	*	*			trans	-94.7	147.9	-172.1	-79.9	-91.6	0	0	0	112.6	L167	L167-F169 HydrophobicContact CB-CD2 4.24Å; L167-F169 HydrophobicContact CB-CE2 3.88Å; L167-F169 HydrophobicContact CD2-CD2 4.39Å; L167-F169 HydrophobicContact CD2-CE2 3.38Å; L167-F169 HydrophobicContact CD2-CZ 3.48Å; L167-F169 VanDerWaalsContact CD2-CZ 3.48Å; L167-F169 HydrophobicContact CG-CE2 4.27Å
170	H	22.4	Very low	26.3	Very low	156 Å²	156	151.6 Å²	151.6	72%	0.722	80%	0.797	S	S	*	*			trans	75.9	139	145.3	-71.5	-64.5	0	0	0	122.1
171	H	22.3	Very low	26.4	Very low	165 Å²	165	151.2 Å²	151.2	76%	0.764	80%	0.795	S	S	*	*			trans	86.9	96.4	160.6	-59.7	-79.1	0	0	0	118.5
172	T	25.4	Very low	26.3	Very low	130 Å²	130	150.6 Å²	150.6	80%	0.798	79%	0.792	S	S	*	*				166.4	133.7	101.8	37.3	0	0	0	0	112.8
173	S	25.9	Very low	26.2	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	79%	0.785	S	S	*	*			trans	62.6	134.7	161	38.5	0	0	0	0	120.8	P175	S173-P175 WeakPolarHBondContact O-CD 3.39Å
174	P	28.9	Very low	26.4	Very low	129 Å²	129	145.3 Å²	145.3	84%	0.838	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-84.2	121.6	-167.9	32.4	-31.9	0	0	0	112.6
175	P	29.8	Very low	26.6	Very low	122 Å²	122	145.7 Å²	145.7	79%	0.792	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-80.9	134.3	169.7	1.5	15.6	0	0	0	110.6	S173	S173-P175 WeakPolarHBondContact O-CD 3.39Å
176	Q	27.6	Very low	26.9	Very low	192 Å²	192	139.9 Å²	139.9	90%	0.897	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-51.3	136	172.9	-79.6	175	-29.5	0	0	111.9	Q178	Q176-Q178 PolarHBondContact O-N 3.24Å
177	R	27.9	Very low	27	Very low	235 Å²	235	134.4 Å²	134.4	89%	0.887	72%	0.724	S	S	*	*			trans	-59.1	99	174.8	-69.7	179.5	171.8	-158.8	-1.7	111
178	Q	25	Very low	27.2	Very low	170 Å²	170	133.1 Å²	133.1	79%	0.794	72%	0.722	S	S	*	*			trans	-107.4	111.5	146.4	-84.3	-177.4	-5.7	0	0	107.2	Q176 L180	Q176-Q178 PolarHBondContact O-N 3.24Å; Q178-L180 PolarHBondContact O-N 3.43Å
179	I	28.9	Very low	27.7	Very low	153 Å²	153	133.3 Å²	133.3	79%	0.785	72%	0.721	S	S	*	*			trans	-72.5	84.5	178.9	-58	169.6	0	0	0	106.6
180	L	26.6	Very low	28	Very low	150 Å²	150	137.7 Å²	137.7	79%	0.785	74%	0.735	S	S	*	*			trans	-85.7	109.1	166.9	-76.4	166.5	0	0	0	107.6	Q178	Q178-L180 PolarHBondContact O-N 3.43Å
181	T	28.6	Very low	28.3	Very low	122 Å²	122	138.2 Å²	138.2	75%	0.748	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-63.3	123.6	-177.7	-20.7	0	0	0	0	109.9	A183	T181-A183 PolarHBondContact O-N 3.01Å
182	P	32.5	Very low	28.6	Very low	106 Å²	106	137.7 Å²	137.7	69%	0.688	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-67.7	129.1	-173.7	22.2	-30.4	0	0	0	112.4	Y184	P182-Y184 HydrophobicContact CB-CD2 4.33Å; P182-Y184 HydrophobicContact CB-CE2 4.09Å
183	A	24.3	Very low	28.8	Very low	92 Å²	92	141.7 Å²	141.7	76%	0.76	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-88.9	116	177.2	0	0	0	0	0	110.6	T181	T181-A183 PolarHBondContact O-N 3.01Å
184	Y	29.2	Very low	29.2	Very low	209 Å²	209	147.4 Å²	147.4	82%	0.82	75%	0.746	S	S	*	*			trans	-135.5	139.9	167.3	-71.1	-76.4	0	0	0	112.6	P182	P182-Y184 HydrophobicContact CB-CD2 4.33Å; P182-Y184 HydrophobicContact CB-CE2 4.09Å
185	T	29.8	Very low	29.4	Very low	126 Å²	126	147.9 Å²	147.9	77%	0.773	74%	0.742	S	S	*	*			trans	-100.1	160.2	-163.2	42.2	0	0	0	0	113
186	A	28.9	Very low	29.3	Very low	39 Å²	39	147.5 Å²	147.5	32%	0.322	74%	0.742	S	S	.	*			trans	-103.5	170.9	179.3	0	0	0	0	0	115.7	R156	R156-A186 HydrophobicContact CB-CB 3.79Å; R156-A186 HydrophobicContact CG-CB 3.46Å; R156-A186 VanDerWaalsContact CG-CB 3.46Å; R156-A186 VanDerWaalsContact CZ-N 3.31Å
187	S	28.3	Very low	29.5	Very low	15 Å²	15	146.9 Å²	146.9	11%	0.105	74%	0.737	C	S	.	*			cis	78.6	55.4	3.6	73.9	0	0	0	0	123.1	R156 G157 W158	R156-S187 VanDerWaalsContact C-OG 3.27Å; G157-S187 VanDerWaalsContact CA-CB 3.47Å; G157-S187 WeakPolarHBondContact CA-OG 3.33Å; G157-S187 PolarHBondContact N-O 3.1Å; G157-S187 PolarHBondContact N-OG 3.42Å; G157-S187 WeakPolarHBondContact O-CB 2.93Å; G157-S187 PolarHBondContact O-OG 2.98Å; W158-S187 WeakPolarHBondContact O-CB 3.33Å
188	V	31	Very low	29.5	Very low	114 Å²	114	140 Å²	140	69%	0.691	72%	0.724	S	S	*	*				47.5	124.5	119.7	-163.2	0	0	0	0	120.8
189	P	33.2	Very low	29.7	Very low	119 Å²	119	138.6 Å²	138.6	77%	0.773	73%	0.728	S	S	*	*			trans	-84.9	145.2	-171.5	33.5	-36	0	0	0	115.8	Q191	P189-Q191 PolarHBondContact O-N 3.29Å
190	Y	31.1	Very low	29.5	Very low	242 Å²	242	135.8 Å²	135.8	95%	0.949	72%	0.722	S	S	*	*			trans	-70.8	108.6	168.6	-101.6	-98.7	0	0	0	110.7	N192	Y190-N192 PolarHBondContact O-N 2.97Å
191	Q	28.4	Very low	29.6	Very low	167 Å²	167	139.3 Å²	139.3	78%	0.78	73%	0.726	S	S	*	*			trans	-73.9	110.1	170.1	-156.5	164.6	10.6	0	0	108.6	P189 R193	P189-Q191 PolarHBondContact O-N 3.29Å; Q191-R193 PolarHBondContact O-N 2.76Å
192	N	29.3	Very low	29.5	Very low	154 Å²	154	138.8 Å²	138.8	82%	0.824	73%	0.728	S	S	*	*			trans	-67.3	80.5	174.8	-157.1	-10.6	0	0	0	108.8	Y190 R194	Y190-N192 PolarHBondContact O-N 2.97Å; N192-R194 PolarHBondContact O-N 3.19Å
193	R	29.4	Very low	29.2	Very low	215 Å²	215	139.5 Å²	139.5	81%	0.811	74%	0.735	S	S	*	*			trans	-69.2	84	165.3	-76.3	-170.9	179.9	-174.1	0.4	107	Q191 N195	Q191-R193 PolarHBondContact O-N 2.76Å; R193-N195 PolarHBondContact O-N 3.25Å
194	R	34.5	Very low	29.2	Very low	224 Å²	224	138.7 Å²	138.7	85%	0.845	73%	0.728	S	S	*	*			trans	-45.4	125.6	159.5	-153.6	-177.8	-132.1	-141.2	3.4	106.1	N192 S196	N192-R194 PolarHBondContact O-N 3.19Å; R194-S196 PolarHBondContact O-N 3.36Å
195	N	32.8	Very low	29.1	Very low	139 Å²	139	138.4 Å²	138.4	74%	0.743	73%	0.732	S	S	*	*			trans	-55.8	92.9	172.6	-74.4	-11.5	0	0	0	108.8	R193 F197	R193-N195 PolarHBondContact O-N 3.25Å; N195-F197 VanDerWaalsContact C-N 3.31Å; N195-F197 HydrophobicContact CB-CD2 4.26Å; N195-F197 HydrophobicContact CB-CE2 4.2Å; N195-F197 PolarHBondContact O-N 3.41Å
196	S	27.9	Very low	28.9	Very low	115 Å²	115	138.5 Å²	138.5	80%	0.804	73%	0.732	S	S	*	*			trans	-75.8	91.7	159.5	49.6	0	0	0	0	105.8	R194 S198	R194-S196 PolarHBondContact O-N 3.36Å; S196-S198 PolarHBondContact O-N 2.77Å
197	F	32.2	Very low	28.9	Very low	178 Å²	178	142.7 Å²	142.7	78%	0.781	75%	0.754	S	S	*	*			trans	-65.4	115.1	156.4	-80	-83.9	0	0	0	106.7	N195 T199	N195-F197 VanDerWaalsContact C-N 3.31Å; N195-F197 HydrophobicContact CB-CD2 4.26Å; N195-F197 HydrophobicContact CB-CE2 4.2Å; N195-F197 PolarHBondContact O-N 3.41Å; F197-T199 PolarHBondContact O-N 3Å
198	S	27.4	Very low	28.8	Very low	90 Å²	90	150.1 Å²	150.1	63%	0.629	79%	0.787	S	S	*	*			trans	-57.1	118.5	166.3	179.3	0	0	0	0	108.1	S196 S200	S196-S198 PolarHBondContact O-N 2.77Å; S198-S200 PolarHBondContact O-N 3.47Å; S198-S200 PolarHBondContact OG-OG 2.71Å
199	T	29.9	Very low	28.5	Very low	142 Å²	142	150.9 Å²	150.9	87%	0.871	78%	0.783	S	S	*	*			trans	-66.9	83.7	163.5	38.4	0	0	0	0	108.5	F197	F197-T199 PolarHBondContact O-N 3Å
200	S	24.9	Very low	28.3	Very low	93 Å²	93	149.8 Å²	149.8	65%	0.65	77%	0.774	S	S	*	*			trans	-131.7	69	168	44.7	0	0	0	0	108.2	S198	S198-S200 PolarHBondContact O-N 3.47Å; S198-S200 PolarHBondContact OG-OG 2.71Å
201	Y	28.4	Very low	28.2	Very low	224 Å²	224	145.7 Å²	145.7	88%	0.878	77%	0.769	S	S	*	*			trans	-99.7	122.3	159.8	-74.2	-79.6	0	0	0	107.9
202	S	25.4	Very low	28.2	Very low	112 Å²	112	145 Å²	145	78%	0.783	76%	0.763	S	S	*	*			trans	-63.9	132.1	162.7	171.1	0	0	0	0	109	A204	S202-A204 PolarHBondContact O-N 3.36Å; S202-A204 VanDerWaalsContact O-N 3.09Å
203	S	26.2	Very low	28.6	Very low	121 Å²	121	142.6 Å²	142.6	85%	0.846	76%	0.757	S	S	*	*			trans	-63.6	99.3	170.9	55	0	0	0	0	111
204	A	25.6	Very low	28.8	Very low	74 Å²	74	139.1 Å²	139.1	61%	0.612	76%	0.759	S	S	*	*			trans	-161.2	86.9	155.9	0	0	0	0	0	108.8	S202	S202-A204 PolarHBondContact O-N 3.36Å; S202-A204 VanDerWaalsContact O-N 3.09Å
205	F	27.6	Very low	28.6	Very low	203 Å²	203	137 Å²	137	89%	0.89	76%	0.759	S	S	*	*				-179.2	116.9	116.8	-105	-83.8	0	0	0	108.2
206	T	24.1	Very low	28.8	Very low	129 Å²	129	140.8 Å²	140.8	79%	0.791	76%	0.763	S	S	*	*			trans	-51.4	131.4	176.1	-14.9	0	0	0	0	110.5	Q208	T206-Q208 PolarHBondContact O-N 2.77Å
207	T	29.2	Very low	29.1	Very low	126 Å²	126	140.7 Å²	140.7	77%	0.773	76%	0.76	S	S	*	*			trans	-53.2	114	165.9	27.9	0	0	0	0	110.7	Q209	T207-Q209 VanDerWaalsContact C-N 3.33Å; T207-Q209 PolarHBondContact O-N 2.81Å
208	Q	25.9	Very low	29.3	Very low	171 Å²	171	137.9 Å²	137.9	80%	0.799	76%	0.762	S	S	*	*			trans	-93.7	79.6	149.8	-73.7	-160.7	13.7	0	0	108	T206 T210	T206-Q208 PolarHBondContact O-N 2.77Å; Q208-T210 PolarHBondContact O-N 3.14Å
209	Q	26.3	Very low	30	Very low	130 Å²	130	141 Å²	141	61%	0.607	77%	0.771	S	S	*	*			trans	-71.6	73.2	158	-173.8	174.7	36.5	0	0	107.4	T207 F212	T207-Q209 VanDerWaalsContact C-N 3.33Å; T207-Q209 PolarHBondContact O-N 2.81Å; Q209-F212 VanDerWaalsContact CD-CZ 3.49Å; Q209-F212 HydrophobicContact CG-CD2 4.1Å; Q209-F212 HydrophobicContact CG-CE2 3.77Å; Q209-F212 HydrophobicContact CG-CZ 4.37Å
210	T	28.6	Very low	30	Very low	97 Å²	97	137 Å²	137	60%	0.595	76%	0.758	S	S	*	*			trans	-93.8	121.6	170.2	23.5	0	0	0	0	108.3	Q208	Q208-T210 PolarHBondContact O-N 3.14Å
211	N	29.1	Very low	30.5	Very low	156 Å²	156	138 Å²	138	83%	0.834	76%	0.762	S	S	*	*			trans	91.6	65.4	175.5	-46.9	-31.5	0	0	0	116.1
212	F	28.2	Very low	31.1	Very low	151 Å²	151	133.4 Å²	133.4	66%	0.662	76%	0.76	S	S	*	*			trans	-55.2	154.6	144.5	-86.8	-72.7	0	0	0	111	Q209	Q209-F212 VanDerWaalsContact CD-CZ 3.49Å; Q209-F212 HydrophobicContact CG-CD2 4.1Å; Q209-F212 HydrophobicContact CG-CE2 3.77Å; Q209-F212 HydrophobicContact CG-CZ 4.37Å
213	P	36.2	Very low	31.5	Very low	105 Å²	105	133.7 Å²	133.7	68%	0.682	76%	0.757	S	S	*	*			trans	-78.6	147.7	-152.8	30.7	-35.5	0	0	0	113.4	Q215	P213-Q215 PolarHBondContact O-N 3.06Å
214	T	35	Very low	31.7	Very low	141 Å²	141	135.6 Å²	135.6	87%	0.865	76%	0.757	S	S	*	*			trans	-59	112.9	170	-39.7	0	0	0	0	108.8	R216	T214-R216 PolarHBondContact O-N 3.31Å; T214-R216 VanDerWaalsContact O-N 3.16Å
215	Q	30.7	Very low	32.2	Very low	179 Å²	179	138.6 Å²	138.6	84%	0.836	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-51.2	120.7	171.3	-66.2	177.5	4.8	0	0	108.5	P213 P217	P213-Q215 PolarHBondContact O-N 3.06Å; Q215-P217 WeakPolarHBondContact O-CD 3.4Å
216	R	36.2	Very low	32.3	Very low	219 Å²	219	136.3 Å²	136.3	83%	0.826	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-58.5	121	178.5	-159.1	178.6	-168.4	-135.7	4	107.7	T214 S218	T214-R216 PolarHBondContact O-N 3.31Å; T214-R216 VanDerWaalsContact O-N 3.16Å; R216-S218 PolarHBondContact O-N 3.24Å
217	P	34.8	Very low	32.7	Very low	114 Å²	114	141.2 Å²	141.2	74%	0.74	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-61.4	138.5	-177.4	19.2	-28	0	0	0	110.7	Q215 L219	Q215-P217 WeakPolarHBondContact O-CD 3.4Å; P217-L219 PolarHBondContact O-N 3.19Å
218	S	36.4	Very low	32.5	Very low	119 Å²	119	144.3 Å²	144.3	83%	0.832	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-48.1	125.9	176.9	-178.8	0	0	0	0	110.8	R216 G220	R216-S218 PolarHBondContact O-N 3.24Å; S218-G220 PolarHBondContact O-N 3.24Å
219	L	40.8	Very low	32.7	Very low	155 Å²	155	144.6 Å²	144.6	81%	0.812	77%	0.771	S	S	*	*			trans	-63.5	102.8	176.8	-72.3	162	0	0	0	108.2	P217	P217-L219 PolarHBondContact O-N 3.19Å
220	G	30.9	Very low	33.2	Very low	58 Å²	58	149 Å²	149	60%	0.598	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57.6	157.8	175.5	0	0	0	0	0	112.4	S218	S218-G220 PolarHBondContact O-N 3.24Å
221	P	35.6	Very low	33.1	Very low	113 Å²	113	154.3 Å²	154.3	73%	0.734	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-63.9	155.2	-172.3	25.2	-33.2	0	0	0	113.2	V223	P221-V223 PolarHBondContact O-N 3.23Å
222	P	39.6	Very low	33.1	Very low	129 Å²	129	152 Å²	152	84%	0.838	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-74.8	117.6	-162.4	30.3	-32.8	0	0	0	110.6
223	V	35.3	Very low	33	Very low	118 Å²	118	148.9 Å²	148.9	72%	0.715	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-95.4	118.1	177.4	179.3	0	0	0	0	109.3	P221 I225	P221-V223 PolarHBondContact O-N 3.23Å; V223-I225 HydrophobicContact CG1-CG1 4.25Å; V223-I225 PolarHBondContact O-N 3.28Å; V223-I225 VanDerWaalsContact O-N 3.13Å
224	D	30.3	Very low	32.6	Very low	160 Å²	160	153 Å²	153	86%	0.856	80%	0.802	S	S	*	*			trans	-59.2	101.1	171.5	-86.1	-41.6	0	0	0	111.6
225	I	34.6	Very low	32.1	Very low	138 Å²	138	153.5 Å²	153.5	71%	0.708	80%	0.795	S	S	*	*			trans	-109.5	74.8	174.9	-54.6	166.2	0	0	0	108.6	V223	V223-I225 HydrophobicContact CG1-CG1 4.25Å; V223-I225 PolarHBondContact O-N 3.28Å; V223-I225 VanDerWaalsContact O-N 3.13Å
226	I	31.2	Very low	32	Very low	155 Å²	155	151.5 Å²	151.5	80%	0.795	80%	0.797	S	S	*	*			trans	-115.1	-9.5	168.5	-70.3	-177	0	0	0	113.3
227	R	30.7	Very low	31.6	Very low	232 Å²	232	147.8 Å²	147.8	88%	0.875	79%	0.794	S	S	*	*	S	Bend	trans	-110.1	-2.9	-161.6	-71.2	-163.1	-179.2	-141.4	2.1	121.3
228	K	25.9	Very low	31.2	Very low	190 Å²	190	151.2 Å²	151.2	83%	0.826	80%	0.8	S	S	*	*	S	Bend	trans	-151.3	128.8	174.1	-65.5	-172.2	-180	178.6	0	112.1	R230	K228-R230 PolarHBondContact O-N 3.07Å
229	N	29.5	Very low	30.7	Very low	178 Å²	178	154.6 Å²	154.6	95%	0.952	80%	0.802	S	S	*	*			trans	-40.4	100.2	172.3	-74.5	-17.1	0	0	0	112.4
230	R	36.9	Very low	30.2	Very low	223 Å²	223	152.2 Å²	152.2	84%	0.842	80%	0.796	S	S	*	*			trans	-155.5	130.5	169.1	-102.2	-173.2	-169.5	171.1	3.3	109.1	K228	K228-R230 PolarHBondContact O-N 3.07Å
231	Y	27.2	Very low	30.1	Very low	208 Å²	208	155 Å²	155	82%	0.816	80%	0.804	S	S	*	*			trans	64.8	94.7	173.6	-80.4	-98.6	0	0	0	116.6
232	T	28.7	Very low	29.7	Very low	107 Å²	107	156.6 Å²	156.6	66%	0.656	81%	0.805	S	S	*	*				59.1	91.2	95.6	61.8	0	0	0	0	113.1	F234	T232-F234 PolarHBondContact O-N 2.99Å; T232-F234 VanDerWaalsContact O-N 3.16Å
233	G	25.6	Very low	29	Very low	85 Å²	85	161 Å²	161	88%	0.876	81%	0.806	S	S	*	*			trans	-67	107.1	172.4	0	0	0	0	0	111.1
234	F	28.7	Very low	28.6	Very low	192 Å²	192	161.2 Å²	161.2	84%	0.842	81%	0.808	S	S	*	*			trans	-84.1	132.8	155.9	-96.8	-87.9	0	0	0	109.1	T232	T232-F234 PolarHBondContact O-N 2.99Å; T232-F234 VanDerWaalsContact O-N 3.16Å
235	Q	25.4	Very low	28.4	Very low	152 Å²	152	158.9 Å²	158.9	71%	0.71	80%	0.801	S	S	*	*			trans	-44.1	147.9	-174.8	-66.5	162.7	-37.2	0	0	114.8	N237	Q235-N237 PolarHBondContact O-N 3.48Å
236	P	28.2	Very low	27.9	Very low	137 Å²	137	158.8 Å²	158.8	89%	0.89	80%	0.802	S	S	*	*	S	Bend	trans	-69.2	83.7	167.4	30.7	-32.2	0	0	0	109
237	N	26.8	Very low	27.6	Very low	141 Å²	141	159.5 Å²	159.5	75%	0.754	80%	0.804	S	S	*	*			trans	-136.5	46.1	172.5	-132.2	8.1	0	0	0	110.3	Q235	Q235-N237 PolarHBondContact O-N 3.48Å
238	Q	26.5	Very low	27.4	Very low	186 Å²	186	156.6 Å²	156.6	87%	0.869	80%	0.798	S	S	*	*			trans	-146.4	72.6	163.8	-65.8	-166	5.1	0	0	110	P240	Q238-P240 WeakPolarHBondContact O-CD 3.11Å
239	Q	26.5	Very low	27.5	Very low	190 Å²	190	153.8 Å²	153.8	89%	0.888	79%	0.791	S	S	*	*			trans	-73.8	113	141	-82.8	-176.1	-11.6	0	0	105.3
240	P	29.5	Very low	27.5	Very low	104 Å²	104	155.5 Å²	155.5	68%	0.675	78%	0.784	S	S	*	*			trans	-57.4	137.8	168	23.3	-29.8	0	0	0	107.6	Q238 I242	Q238-P240 WeakPolarHBondContact O-CD 3.11Å; P240-I242 PolarHBondContact O-N 2.96Å
241	P	28.9	Very low	27.1	Very low	117 Å²	117	150 Å²	150	76%	0.76	77%	0.768	S	S	*	*			trans	-51.3	121.3	172.4	20	-30.1	0	0	0	107.7	Y243	P241-Y243 PolarHBondContact O-N 3.49Å
242	I	27.6	Very low	27.3	Very low	147 Å²	147	142.2 Å²	142.2	75%	0.754	74%	0.743	S	S	*	*			trans	-51.7	114.8	166.9	-68.1	168.7	0	0	0	105	P240 T244	P240-I242 PolarHBondContact O-N 2.96Å; I242-T244 PolarHBondContact O-N 3.42Å
243	Y	24.2	Very low	27.2	Very low	221 Å²	221	141.7 Å²	141.7	87%	0.867	73%	0.732	S	S	*	*			trans	-52.4	92.8	161.2	-85.8	-99	0	0	0	107	P241 P245	P241-Y243 PolarHBondContact O-N 3.49Å; Y243-P245 WeakPolarHBondContact O-CD 3.48Å
244	T	27	Very low	27.4	Very low	122 Å²	122	140 Å²	140	75%	0.748	70%	0.702	S	S	*	*			trans	-79.6	102.7	152.5	38.7	0	0	0	0	105.4	I242 N246	I242-T244 PolarHBondContact O-N 3.42Å; T244-N246 PolarHBondContact O-N 2.99Å
245	P	26.2	Very low	28.2	Very low	111 Å²	111	136.1 Å²	136.1	72%	0.721	70%	0.699	S	S	*	*			trans	-55.5	140.5	172.8	24.4	-33	0	0	0	109	Y243 M247	Y243-P245 WeakPolarHBondContact O-CD 3.48Å; P245-M247 PolarHBondContact O-N 3.04Å
246	N	25.1	Very low	28.9	Very low	136 Å²	136	136.6 Å²	136.6	73%	0.727	70%	0.699	S	S	*	*			trans	-32.3	98	168.6	-68	-34.5	0	0	0	112.7	T244 F248	T244-N246 PolarHBondContact O-N 2.99Å; N246-F248 VanDerWaalsContact C-N 3.32Å; N246-F248 HydrophobicContact CB-CD2 3.85Å; N246-F248 HydrophobicContact CB-CE2 3.66Å; N246-F248 HydrophobicContact CB-CZ 4.49Å; N246-F248 PolarHBondContact O-N 3.45Å
247	M	24.5	Very low	29	Very low	171 Å²	171	140 Å²	140	84%	0.842	69%	0.694	S	S	*	*			trans	-85.6	91.5	154.1	-126.9	-172	-59.6	0	0	105.7	P245 I249	P245-M247 PolarHBondContact O-N 3.04Å; M247-I249 PolarHBondContact O-N 2.98Å
248	F	26.3	Very low	29.1	Very low	170 Å²	170	141.8 Å²	141.8	75%	0.746	69%	0.69	S	S	*	*			trans	-55.8	91.5	160.1	-72	-89.5	0	0	0	107.4	N246 R250	N246-F248 VanDerWaalsContact C-N 3.32Å; N246-F248 HydrophobicContact CB-CD2 3.85Å; N246-F248 HydrophobicContact CB-CE2 3.66Å; N246-F248 HydrophobicContact CB-CZ 4.49Å; N246-F248 PolarHBondContact O-N 3.45Å; F248-R250 PolarHBondContact O-N 3.09Å
249	I	28.5	Very low	29.2	Very low	131 Å²	131	135.6 Å²	135.6	67%	0.672	67%	0.667	S	S	*	*			trans	-71.5	91.1	166.8	-57.4	177.9	0	0	0	105	M247 Q251	M247-I249 PolarHBondContact O-N 2.98Å; I249-Q251 PolarHBondContact O-N 3.34Å
250	R	28.7	Very low	29.3	Very low	215 Å²	215	130.9 Å²	130.9	81%	0.811	65%	0.646	S	S	*	*			trans	-50.2	110.1	163.1	-81.2	178.1	170.6	-100.5	0.9	106.3	F248	F248-R250 PolarHBondContact O-N 3.09Å
251	Q	29.8	Very low	29.4	Very low	106 Å²	106	135.1 Å²	135.1	50%	0.495	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-54	123.3	176	-74.3	173	-15.1	0	0	107.8	I249 F253 P259	I249-Q251 PolarHBondContact O-N 3.34Å; Q251-F253 VanDerWaalsContact O-CD2 3.22Å; Q251-F253 WeakPolarHBondContact O-CD2 2.97Å; Q251-F253 WeakPolarHBondContact O-CE2 3.38Å; Q251-F253 PolarHBondContact O-N 3.46Å; Q251-P259 HydrophobicContact CB-CB 4.02Å
252	P	31.3	Very low	29.5	Very low	45 Å²	45	133 Å²	133	29%	0.292	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-59	139	173	25.3	-31.6	0	0	0	107.1	M260 Y264	P252-M260 WeakPolarHBondContact O-CA 3.41Å; P252-M260 VanDerWaalsContact O-CB 3.29Å; P252-M260 WeakPolarHBondContact O-CB 3.11Å; P252-M260 PolarHBondContact O-N 3.42Å; P252-Y264 HydrophobicContact CG-CE2 3.87Å
253	F	26.5	Very low	29.5	Very low	97 Å²	97	131 Å²	131	43%	0.425	65%	0.648	S	S	.	*	B	Isolated β-bridge	trans	-101.5	150.1	-178.2	-60.2	-97.2	0	0	0	109.9	Q251 R257 R258 P259	Q251-F253 VanDerWaalsContact O-CD2 3.22Å; Q251-F253 WeakPolarHBondContact O-CD2 2.97Å; Q251-F253 WeakPolarHBondContact O-CE2 3.38Å; Q251-F253 PolarHBondContact O-N 3.46Å; F253-R257 VanDerWaalsContact CB-CA 3.41Å; F253-R257 HydrophobicContact CB-CB 4.29Å; F253-R257 HydrophobicContact CD1-CB 4.44Å; F253-R257 WeakPolarHBondContact CD1-O 3.41Å; F253-R257 HydrophobicContact CG-CB 4.38Å; F253-R258 CarbonylContact C-O 3.52Å; F253-R258 WeakPolarHBondContact CA-O 3Å; F253-R258 WeakPolarHBondContact CB-O 3.48Å; F253-P259 HydrophobicContact CD1-CB 4.5Å
254	N	29.2	Very low	29.6	Very low	49 Å²	49	128.3 Å²	128.3	26%	0.262	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-65	172.5	168.2	70.5	12.8	0	0	0	109.9	F256 R257 R258 M260	N254-F256 PolarHBondContact O-N 3.38Å; N254-F256 PolarHBondContact OD1-N 2.72Å; N254-F256 VanDerWaalsContact OD1-N 3.14Å; N254-R257 WeakPolarHBondContact O-CA 3.35Å; N254-R257 PolarHBondContact O-N 2.89Å; N254-R258 PolarHBondContact N-O 3.21Å; N254-R258 WeakPolarHBondContact OD1-CB 3.2Å; N254-R258 PolarHBondContact OD1-N 2.71Å; N254-R258 PolarHBondContact OD1-O 2.82Å; N254-M260 HydrophobicContact CB-CE 3.82Å; N254-M260 HydrophobicContact CB-CG 3.71Å; N254-M260 HydrophobicContact CB-SD 4.2Å
255	S	44.7	Very low	29.6	Very low	111 Å²	111	130.3 Å²	130.3	78%	0.776	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-7.4	-176.6	32	0	0	0	0	115.1
256	F	40.7	Very low	29.5	Very low	162 Å²	162	131.1 Å²	131.1	71%	0.711	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	15.7	170.2	-65.9	-77.5	0	0	0	114.7	N254 R258	N254-F256 PolarHBondContact O-N 3.38Å; N254-F256 PolarHBondContact OD1-N 2.72Å; N254-F256 VanDerWaalsContact OD1-N 3.14Å; F256-R258 VanDerWaalsContact C-N 3.25Å; F256-R258 HydrophobicContact CB-CG 4.45Å; F256-R258 PolarHBondContact O-N 2.87Å
257	R	29.9	Very low	29.5	Very low	208 Å²	208	128.9 Å²	128.9	79%	0.785	64%	0.637	S	S	*	*	S	Bend	trans	51.7	39.1	-169.6	-71.7	-170.6	179.2	-126.6	3	113.4	F253 N254	F253-R257 VanDerWaalsContact CB-CA 3.41Å; F253-R257 HydrophobicContact CB-CB 4.29Å; F253-R257 HydrophobicContact CD1-CB 4.44Å; F253-R257 WeakPolarHBondContact CD1-O 3.41Å; F253-R257 HydrophobicContact CG-CB 4.38Å; N254-R257 WeakPolarHBondContact O-CA 3.35Å; N254-R257 PolarHBondContact O-N 2.89Å
258	R	29.7	Very low	29.6	Very low	178 Å²	178	127 Å²	127	67%	0.672	63%	0.631	S	S	*	*			trans	-102	139.1	164.5	-59	-177.3	174.4	-137.8	-0.3	110.9	F253 N254 F256 M260	F253-R258 CarbonylContact C-O 3.52Å; F253-R258 WeakPolarHBondContact CA-O 3Å; F253-R258 WeakPolarHBondContact CB-O 3.48Å; N254-R258 PolarHBondContact N-O 3.21Å; N254-R258 WeakPolarHBondContact OD1-CB 3.2Å; N254-R258 PolarHBondContact OD1-N 2.71Å; N254-R258 PolarHBondContact OD1-O 2.82Å; F256-R258 VanDerWaalsContact C-N 3.25Å; F256-R258 HydrophobicContact CB-CG 4.45Å; F256-R258 PolarHBondContact O-N 2.87Å; R258-M260 PolarHBondContact O-N 3.02Å
259	P	29.3	Very low	29.5	Very low	57 Å²	57	128.8 Å²	128.8	37%	0.37	63%	0.634	S	S	.	*	B	Isolated β-bridge	trans	-55.6	125.5	-174.2	19.6	-30.8	0	0	0	111.5	Q251 F253	Q251-P259 HydrophobicContact CB-CB 4.02Å; F253-P259 HydrophobicContact CD1-CB 4.5Å
260	M	28.7	Very low	29.4	Very low	91 Å²	91	130.3 Å²	130.3	45%	0.448	64%	0.639	S	S	.	*			trans	-80.5	115.1	168.7	-84.6	171.4	149.4	0	0	108	P252 N254 R258 S262	P252-M260 WeakPolarHBondContact O-CA 3.41Å; P252-M260 VanDerWaalsContact O-CB 3.29Å; P252-M260 WeakPolarHBondContact O-CB 3.11Å; P252-M260 PolarHBondContact O-N 3.42Å; N254-M260 HydrophobicContact CB-CE 3.82Å; N254-M260 HydrophobicContact CB-CG 3.71Å; N254-M260 HydrophobicContact CB-SD 4.2Å; R258-M260 PolarHBondContact O-N 3.02Å; M260-S262 PolarHBondContact O-N 3.3Å
261	F	31.2	Very low	29.4	Very low	193 Å²	193	124 Å²	124	85%	0.846	63%	0.632	S	S	*	*			trans	-69.9	82.4	155.7	-65.7	-85.8	0	0	0	107.9
262	S	31.5	Very low	29.4	Very low	71 Å²	71	126.5 Å²	126.5	50%	0.497	65%	0.648	S	S	.	*			trans	-94.2	119.1	152	-79.7	0	0	0	0	106.2	M260 Y264	M260-S262 PolarHBondContact O-N 3.3Å; S262-Y264 WeakPolarHBondContact O-CD2 3.36Å; S262-Y264 PolarHBondContact O-N 2.99Å
263	A	27.2	Very low	29.1	Very low	107 Å²	107	131.7 Å²	131.7	88%	0.884	67%	0.673	S	S	*	*			trans	-61.6	90.4	172.4	0	0	0	0	0	108.4	L265	A263-L265 PolarHBondContact O-N 3.15Å; A263-L265 VanDerWaalsContact O-N 3.08Å
264	Y	26.3	Very low	29	Very low	164 Å²	164	135.9 Å²	135.9	64%	0.643	69%	0.691	S	S	*	*			trans	-66	107.3	159.8	-71.7	-85.4	0	0	0	105.7	P252 S262 V266	P252-Y264 HydrophobicContact CG-CE2 3.87Å; S262-Y264 WeakPolarHBondContact O-CD2 3.36Å; S262-Y264 PolarHBondContact O-N 2.99Å; Y264-V266 VanDerWaalsContact C-N 3.29Å; Y264-V266 PolarHBondContact O-N 3.47Å
265	L	25.8	Very low	28.8	Very low	163 Å²	163	137.4 Å²	137.4	85%	0.853	71%	0.71	S	S	*	*			trans	-45	102.5	154.4	-81.4	153.2	0	0	0	106.7	A263 P267	A263-L265 PolarHBondContact O-N 3.15Å; A263-L265 VanDerWaalsContact O-N 3.08Å; L265-P267 WeakPolarHBondContact O-CD 3.36Å
266	V	24.6	Very low	27.9	Very low	128 Å²	128	136.5 Å²	136.5	78%	0.776	70%	0.7	S	S	*	*			trans	-66	110.2	170.6	176.8	0	0	0	0	105.2	Y264 N268	Y264-V266 VanDerWaalsContact C-N 3.29Å; Y264-V266 PolarHBondContact O-N 3.47Å; V266-N268 PolarHBondContact O-N 3.49Å
267	P	25.3	Very low	27.2	Very low	89 Å²	89	138.2 Å²	138.2	58%	0.578	71%	0.708	S	S	*	*			trans	-69.2	111.3	177.8	-11	28.3	0	0	0	106.7	L265 Y269	L265-P267 WeakPolarHBondContact O-CD 3.36Å; P267-Y269 HydrophobicContact CB-CE2 4.25Å; P267-Y269 WeakPolarHBondContact O-CD2 2.96Å; P267-Y269 PolarHBondContact O-N 3.36Å
268	N	26.5	Very low	26.9	Very low	132 Å²	132	138.6 Å²	138.6	71%	0.706	71%	0.709	S	S	*	*			trans	-72.3	108.4	175.8	-171.1	-6	0	0	0	108.5	V266 Q270	V266-N268 PolarHBondContact O-N 3.49Å; N268-Q270 PolarHBondContact O-N 3.31Å; N268-Q270 PolarHBondContact OD1-N 2.84Å
269	Y	24.4	Very low	26.6	Very low	207 Å²	207	133.2 Å²	133.2	81%	0.812	71%	0.709	S	S	*	*			trans	-77.2	33.3	178.6	-76.8	-87.4	0	0	0	113.5	P267 A271	P267-Y269 HydrophobicContact CB-CE2 4.25Å; P267-Y269 WeakPolarHBondContact O-CD2 2.96Å; P267-Y269 PolarHBondContact O-N 3.36Å; Y269-A271 PolarHBondContact O-N 2.99Å; Y269-A271 VanDerWaalsContact O-N 3.1Å
270	Q	26.9	Very low	26.3	Very low	164 Å²	164	141.2 Å²	141.2	77%	0.766	73%	0.734	S	S	*	*			trans	-81.6	78.6	156.3	-73.9	-166.9	-12.9	0	0	108.5	N268 L272	N268-Q270 PolarHBondContact O-N 3.31Å; N268-Q270 PolarHBondContact OD1-N 2.84Å; Q270-L272 VanDerWaalsContact C-N 3.33Å; Q270-L272 PolarHBondContact O-N 3.27Å
271	A	27.2	Very low	26	Very low	81 Å²	81	147.4 Å²	147.4	67%	0.669	75%	0.752	S	S	*	*			trans	-69.5	81.9	178.1	0	0	0	0	0	111.9	Y269	Y269-A271 PolarHBondContact O-N 2.99Å; Y269-A271 VanDerWaalsContact O-N 3.1Å
272	L	30.8	Very low	25.7	Very low	159 Å²	159	142.8 Å²	142.8	83%	0.832	74%	0.741	S	S	*	*	S	Bend	trans	-141.6	68.9	148.8	-86.1	174.2	0	0	0	108.6	Q270	Q270-L272 VanDerWaalsContact C-N 3.33Å; Q270-L272 PolarHBondContact O-N 3.27Å
273	N	25.3	Very low	25.4	Very low	155 Å²	155	146.8 Å²	146.8	83%	0.829	76%	0.757	S	S	*	*			trans	176	84.1	134	-86.7	-21.8	0	0	0	107.5	A275	N273-A275 VanDerWaalsContact C-N 3.3Å; N273-A275 PolarHBondContact O-N 3.04Å
274	K	23	Very low	25.4	Very low	185 Å²	185	147 Å²	147	80%	0.804	75%	0.748	S	S	*	*			trans	-59	101.3	157.6	-73.5	178.7	176.2	178	0	106.6	T276	K274-T276 WeakPolarHBondContact CB-OG1 3.14Å; K274-T276 PolarHBondContact O-N 3.06Å
275	A	27	Very low	25.8	Very low	80 Å²	80	145.9 Å²	145.9	66%	0.661	76%	0.761	S	S	*	*			trans	-68.1	72.9	149.2	0	0	0	0	0	106.4	N273 F277	N273-A275 VanDerWaalsContact C-N 3.3Å; N273-A275 PolarHBondContact O-N 3.04Å; A275-F277 HydrophobicContact CB-CD2 4.4Å; A275-F277 HydrophobicContact CB-CE2 4.2Å; A275-F277 PolarHBondContact O-N 3Å
276	T	24	Very low	25.8	Very low	92 Å²	92	142.8 Å²	142.8	56%	0.564	75%	0.753	S	S	*	*			trans	-65.2	98.3	159.5	-35.7	0	0	0	0	102.6	K274 R278	K274-T276 WeakPolarHBondContact CB-OG1 3.14Å; K274-T276 PolarHBondContact O-N 3.06Å; T276-R278 HydrophobicContact CG2-CG 4.01Å; T276-R278 PolarHBondContact O-N 3.27Å
277	F	27.6	Very low	26	Very low	199 Å²	199	142.6 Å²	142.6	87%	0.873	76%	0.757	S	S	*	*			trans	-64.7	71.1	159.5	-76.6	-87.9	0	0	0	106.6	A275 G279	A275-F277 HydrophobicContact CB-CD2 4.4Å; A275-F277 HydrophobicContact CB-CE2 4.2Å; A275-F277 PolarHBondContact O-N 3Å; F277-G279 PolarHBondContact O-N 3.28Å; F277-G279 VanDerWaalsContact O-N 3.08Å
278	R	22.6	Very low	26.1	Very low	215 Å²	215	141.8 Å²	141.8	81%	0.811	76%	0.764	S	S	*	*			trans	-65.1	103.8	151.9	-85.1	-172	172	-143.8	-1.8	102.6	T276 Y280	T276-R278 HydrophobicContact CG2-CG 4.01Å; T276-R278 PolarHBondContact O-N 3.27Å; R278-Y280 PolarHBondContact O-N 2.89Å
279	G	24.3	Very low	26	Very low	65 Å²	65	142.4 Å²	142.4	67%	0.67	77%	0.768	S	S	*	*			trans	-38.8	120.7	168.2	0	0	0	0	0	107.7	F277 R281	F277-G279 PolarHBondContact O-N 3.28Å; F277-G279 VanDerWaalsContact O-N 3.08Å; G279-R281 VanDerWaalsContact C-N 3.3Å; G279-R281 PolarHBondContact O-N 2.95Å
280	Y	23.4	Very low	26.2	Very low	225 Å²	225	138.5 Å²	138.5	88%	0.882	76%	0.761	S	S	*	*			trans	-50.4	103.8	171.4	-124.5	-96.4	0	0	0	105.6	R278 P282	R278-Y280 PolarHBondContact O-N 2.89Å; Y280-P282 VanDerWaalsContact O-CD 3.31Å; Y280-P282 WeakPolarHBondContact O-CD 3.43Å
281	R	21.3	Very low	26.1	Very low	221 Å²	221	137.1 Å²	137.1	83%	0.834	76%	0.758	S	S	*	*			trans	-88.4	105.1	163.9	-138.6	-173.4	-168.9	-157.5	3.1	102.5	G279 N283	G279-R281 VanDerWaalsContact C-N 3.3Å; G279-R281 PolarHBondContact O-N 2.95Å; R281-N283 PolarHBondContact O-N 2.81Å
282	P	25.1	Very low	26	Very low	96 Å²	96	143.8 Å²	143.8	62%	0.623	77%	0.768	S	S	*	*			trans	-63.9	116	178.4	-15.3	30	0	0	0	107.5	Y280 T284	Y280-P282 VanDerWaalsContact O-CD 3.31Å; Y280-P282 WeakPolarHBondContact O-CD 3.43Å; P282-T284 PolarHBondContact O-N 2.87Å
283	N	24.9	Very low	25.7	Very low	156 Å²	156	141.8 Å²	141.8	83%	0.834	76%	0.764	S	S	*	*			trans	-80.3	74.8	168.9	-83	-10.7	0	0	0	108.5	R281	R281-N283 PolarHBondContact O-N 2.81Å
284	T	27.3	Very low	25.7	Very low	112 Å²	112	140.6 Å²	140.6	69%	0.687	76%	0.763	S	S	*	*			trans	-146.1	118.5	157.4	28.9	0	0	0	0	109	P282 S286	P282-T284 PolarHBondContact O-N 2.87Å; T284-S286 PolarHBondContact O-N 2.78Å
285	P	35.5	Very low	26.1	Very low	140 Å²	140	140.6 Å²	140.6	91%	0.909	77%	0.771	S	S	*	*			trans	-79.2	93.8	-178.7	32.2	-29.8	0	0	0	108.3
286	S	25.8	Very low	26	Very low	98 Å²	98	139.1 Å²	139.1	69%	0.685	76%	0.763	S	S	*	*			trans	-112	110.5	169.9	173.4	0	0	0	0	107.9	T284 G288	T284-S286 PolarHBondContact O-N 2.78Å; S286-G288 PolarHBondContact O-N 3.31Å
287	S	28.4	Very low	26	Very low	124 Å²	124	141.3 Å²	141.3	87%	0.867	78%	0.776	S	S	*	*			trans	-34.5	106.2	160.8	52.6	0	0	0	0	110.9
288	G	26.6	Very low	26	Very low	71 Å²	71	138.3 Å²	138.3	73%	0.732	77%	0.774	S	S	*	*			trans	-161.5	94.5	-175.3	0	0	0	0	0	108.9	S286 L290	S286-G288 PolarHBondContact O-N 3.31Å; G288-L290 PolarHBondContact O-N 2.54Å
289	N	25.4	Very low	26	Very low	145 Å²	145	132.5 Å²	132.5	78%	0.775	77%	0.767	S	S	*	*			trans	-62.2	128.5	179.9	-147.6	15.1	0	0	0	110.1
290	L	28.3	Very low	26	Very low	126 Å²	126	136.6 Å²	136.6	66%	0.66	77%	0.769	S	S	*	*			trans	70.8	138.4	143	-67.5	162.4	0	0	0	121.7	G288	G288-L290 PolarHBondContact O-N 2.54Å
291	N	24.9	Very low	25.9	Very low	135 Å²	135	135.1 Å²	135.1	72%	0.722	76%	0.763	S	S	*	*			trans	79.5	81.2	151.1	-58.3	-21	0	0	0	117.4	P293	N291-P293 WeakPolarHBondContact O-CD 3.43Å
292	Y	24.3	Very low	26	Very low	221 Å²	221	130.8 Å²	130.8	87%	0.867	76%	0.756	S	S	*	*			trans	-56.5	124.9	145.5	-69.9	-84	0	0	0	108.6	T294	Y292-T294 VanDerWaalsContact C-N 3.33Å; Y292-T294 PolarHBondContact O-N 3.43Å
293	P	25.6	Very low	25.9	Very low	116 Å²	116	130.8 Å²	130.8	75%	0.753	76%	0.759	S	S	*	*			trans	-67	97.7	169.5	26.4	-30.3	0	0	0	107.9	N291 L295	N291-P293 WeakPolarHBondContact O-CD 3.43Å; P293-L295 PolarHBondContact O-N 2.88Å; P293-L295 VanDerWaalsContact O-N 3.14Å
294	T	25.4	Very low	26	Very low	130 Å²	130	128.1 Å²	128.1	80%	0.798	75%	0.748	S	S	*	*			trans	-54.9	117.2	157.5	-36.3	0	0	0	0	105.6	Y292 G296	Y292-T294 VanDerWaalsContact C-N 3.33Å; Y292-T294 PolarHBondContact O-N 3.43Å; T294-G296 PolarHBondContact O-N 3Å
295	L	31.5	Very low	25.9	Very low	186 Å²	186	133.9 Å²	133.9	97%	0.974	76%	0.757	S	S	*	*			trans	-64.7	79.3	170	-94	114.5	0	0	0	108.7	P293	P293-L295 PolarHBondContact O-N 2.88Å; P293-L295 VanDerWaalsContact O-N 3.14Å
296	G	23.1	Very low	25.9	Very low	49 Å²	49	139.2 Å²	139.2	51%	0.505	76%	0.759	S	S	.	*			trans	-99.8	115.7	166.2	0	0	0	0	0	108.8	T294	T294-G296 PolarHBondContact O-N 3Å
297	T	25.5	Very low	26	Very low	137 Å²	137	139 Å²	139	84%	0.84	76%	0.758	S	S	*	*			trans	24.6	112.3	139.7	58.6	0	0	0	0	118.9
298	T	26.1	Very low	26.1	Very low	136 Å²	136	139.1 Å²	139.1	83%	0.834	76%	0.756	S	S	*	*			trans	-164	115.6	143.1	33.2	0	0	0	0	108.4
299	S	22.5	Very low	26.2	Very low	93 Å²	93	145.1 Å²	145.1	65%	0.65	76%	0.762	S	S	*	*				75.2	102.6	69.2	-166.3	0	0	0	0	113.7
300	Q	24.1	Very low	26.7	Very low	151 Å²	151	147.3 Å²	147.3	71%	0.706	79%	0.788	S	S	*	*			trans	66.1	156	141.3	-61.7	179.8	-17.6	0	0	120.4
301	Y	22.5	Very low	26.6	Very low	194 Å²	194	148.4 Å²	148.4	76%	0.761	80%	0.795	S	S	*	*			trans	82.4	134	161	-69.5	-75.9	0	0	0	116.3
302	N	23	Very low	26.7	Very low	131 Å²	131	149.1 Å²	149.1	70%	0.701	80%	0.799	S	S	*	*			cis	-178.7	159.7	-0.9	-149.2	-1.6	0	0	0	108.1
303	S	24	Very low	26.8	Very low	96 Å²	96	145.1 Å²	145.1	67%	0.671	80%	0.795	S	S	*	*			trans	70.3	148.2	141.4	-120.6	0	0	0	0	118.9
304	T	25.6	Very low	26.9	Very low	100 Å²	100	146.8 Å²	146.8	61%	0.613	80%	0.797	S	S	*	*			cis	-168.7	149.7	4.2	-26.6	0	0	0	0	108.7
305	R	26.2	Very low	27	Very low	232 Å²	232	147.8 Å²	147.8	88%	0.875	80%	0.797	S	S	*	*			trans	46.4	128.7	143.1	-72.3	175.5	-164	-151.8	-0.4	121.7
306	R	35.2	Very low	26.7	Very low	252 Å²	252	145.3 Å²	145.3	95%	0.951	79%	0.786	S	S	*	*				-154.2	116.8	122.9	-106.3	175.4	-172.7	-132	1.7	110.7
307	S	27.4	Very low	27	Very low	94 Å²	94	152.1 Å²	152.1	66%	0.657	81%	0.806	S	S	*	*			trans	-78.7	166	155	68.6	0	0	0	0	109.2
308	P	31	Very low	27.1	Very low	127 Å²	127	153.3 Å²	153.3	83%	0.825	80%	0.803	S	S	*	*				-141.2	147.2	111.6	32.5	-16.3	0	0	0	113.8
309	F	28.7	Very low	27.1	Very low	197 Å²	197	154.8 Å²	154.8	86%	0.864	80%	0.8	S	S	*	*			trans	-64.8	146.4	166.8	-77.7	-103.5	0	0	0	112
310	S	35.7	Very low	27.6	Very low	190 Å²	190	160.4 Å²	160.4	100%	1.329	81%	0.814	S	S	*	*				-153.2	0	128.8	64.3	0	0	0	0	108.9

Retrieved 310 of 310 residues in 663.7 ms (Link to these results)

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