A0A077ZKV4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKV4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 237 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	36.3	Very low	34.8	Very low	238 Å²	238	156.1 Å²	156.1	100%	1.172	84%	0.835	S	S	*	*				0	98.3	0	-77.1	-170.7	173	0	0	106.5	A3	M1-A3 PolarHBondContact O-N 3.46Å
2	N	37.5	Very low	34	Very low	146 Å²	146	159.2 Å²	159.2	78%	0.781	83%	0.826	S	S	*	*			trans	-92.2	99.6	-172.5	-66.9	-3.2	0	0	0	108	F4	N2-F4 VanDerWaalsContact C-N 3.34Å; N2-F4 PolarHBondContact O-N 3.06Å
3	A	41.1	Very low	33.9	Very low	97 Å²	97	163 Å²	163	80%	0.802	83%	0.833	S	S	*	*			trans	-68.4	100	161	0	0	0	0	0	106.5	M1 E5	M1-A3 PolarHBondContact O-N 3.46Å; A3-E5 PolarHBondContact O-N 3.07Å
4	F	41.1	Very low	33.5	Very low	187 Å²	187	160.8 Å²	160.8	82%	0.82	82%	0.824	S	S	*	*			trans	-64.5	93.2	166.6	-107.4	-96.5	0	0	0	106.8	N2 T6	N2-F4 VanDerWaalsContact C-N 3.34Å; N2-F4 PolarHBondContact O-N 3.06Å; F4-T6 PolarHBondContact O-N 2.91Å
5	E	36	Very low	33.1	Very low	182 Å²	182	161.6 Å²	161.6	85%	0.85	82%	0.819	S	S	*	*			trans	-60.6	107.7	163.8	-118	-179.7	162.1	0	0	106.8	A3 P7	A3-E5 PolarHBondContact O-N 3.07Å; E5-P7 WeakPolarHBondContact O-CD 3.47Å
6	T	38.2	Very low	32.5	Very low	126 Å²	126	157.9 Å²	157.9	77%	0.773	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-59.1	122.6	173.6	20.5	0	0	0	0	108.4	F4 R8	F4-T6 PolarHBondContact O-N 2.91Å; T6-R8 PolarHBondContact O-N 3.08Å; T6-R8 VanDerWaalsContact O-N 3.08Å
7	P	30.1	Very low	32.2	Very low	117 Å²	117	157.6 Å²	157.6	76%	0.76	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-63.9	117.5	-177.6	-16.8	28.5	0	0	0	109.2	E5 P9	E5-P7 WeakPolarHBondContact O-CD 3.47Å; P7-P9 VanDerWaalsContact O-CD 3.3Å; P7-P9 WeakPolarHBondContact O-CD 3.3Å; P7-P9 VanDerWaalsContact O-N 3.16Å
8	R	30.2	Very low	31.7	Very low	237 Å²	237	159.6 Å²	159.6	89%	0.894	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-57.6	118.9	167.6	-76.1	-179.6	172.7	171.3	-1.9	107.5	T6 S10	T6-R8 PolarHBondContact O-N 3.08Å; T6-R8 VanDerWaalsContact O-N 3.08Å; R8-S10 PolarHBondContact O-N 2.86Å
9	P	32	Very low	31.3	Very low	126 Å²	126	158.2 Å²	158.2	82%	0.818	80%	0.801	S	S	*	*			trans	-64.3	103.2	177.2	23.9	-30.2	0	0	0	108.2	P7 L11	P7-P9 VanDerWaalsContact O-CD 3.3Å; P7-P9 WeakPolarHBondContact O-CD 3.3Å; P7-P9 VanDerWaalsContact O-N 3.16Å; P9-L11 PolarHBondContact O-N 3.07Å; P9-L11 VanDerWaalsContact O-N 3.07Å
10	S	27.8	Very low	30.8	Very low	86 Å²	86	158.5 Å²	158.5	60%	0.601	80%	0.802	S	S	*	*			trans	-65	110.8	169.2	61.7	0	0	0	0	106.8	R8 R12	R8-S10 PolarHBondContact O-N 2.86Å; S10-R12 PolarHBondContact O-N 2.7Å
11	L	32.1	Very low	30.6	Very low	175 Å²	175	154.3 Å²	154.3	92%	0.916	80%	0.799	S	S	*	*			trans	-57.9	78.3	166.3	-90.6	152.7	0	0	0	109	P9 K13	P9-L11 PolarHBondContact O-N 3.07Å; P9-L11 VanDerWaalsContact O-N 3.07Å; L11-K13 PolarHBondContact O-N 3.38Å
12	R	25.6	Very low	29.9	Very low	193 Å²	193	154.1 Å²	154.1	73%	0.728	79%	0.786	S	S	*	*			trans	-72.9	119.3	169.2	-75.3	-167.7	177.8	-161.3	0.2	106.8	S10 D14	S10-R12 PolarHBondContact O-N 2.7Å; R12-D14 PolarHBondContact O-N 2.8Å
13	K	32.1	Very low	29.2	Very low	209 Å²	209	153.1 Å²	153.1	91%	0.909	79%	0.785	S	S	*	*	S	Bend	trans	-64.1	27.4	-175.2	-79.4	174.6	171	175.3	0	115.3	L11	L11-K13 PolarHBondContact O-N 3.38Å
14	D	28.2	Very low	28.5	Very low	132 Å²	132	154.5 Å²	154.5	71%	0.706	78%	0.783	S	S	*	*			trans	-116.1	32.4	-168.4	-61.4	-27.4	0	0	0	114	R12 S16	R12-D14 PolarHBondContact O-N 2.8Å; D14-S16 PolarHBondContact O-N 2.93Å
15	F	27.5	Very low	27.7	Very low	173 Å²	173	152.8 Å²	152.8	76%	0.759	78%	0.783	S	S	*	*			trans	-79.4	62.8	166.2	-80.3	-81.2	0	0	0	111.5	K17	F15-K17 VanDerWaalsContact C-N 3.26Å; F15-K17 HydrophobicContact CD1-CD 4.18Å; F15-K17 HydrophobicContact CD1-CG 4.33Å; F15-K17 HydrophobicContact CE1-CD 4.34Å; F15-K17 PolarHBondContact O-N 3.44Å
16	S	23.7	Very low	27.2	Very low	103 Å²	103	148.7 Å²	148.7	72%	0.72	77%	0.774	S	S	*	*			trans	-88.9	66.5	156.4	179.8	0	0	0	0	108.3	D14	D14-S16 PolarHBondContact O-N 2.93Å
17	K	27.2	Very low	26.5	Very low	153 Å²	153	147 Å²	147	67%	0.665	78%	0.781	S	S	*	*			trans	-93.4	103.2	168.6	-72	-170.2	-178.2	-179.3	0	107.8	F15 L19	F15-K17 VanDerWaalsContact C-N 3.26Å; F15-K17 HydrophobicContact CD1-CD 4.18Å; F15-K17 HydrophobicContact CD1-CG 4.33Å; F15-K17 HydrophobicContact CE1-CD 4.34Å; F15-K17 PolarHBondContact O-N 3.44Å; K17-L19 VanDerWaalsContact C-N 3.3Å; K17-L19 PolarHBondContact O-N 3.37Å
18	K	23.9	Very low	26.5	Very low	193 Å²	193	144.2 Å²	144.2	84%	0.839	76%	0.764	S	S	*	*			trans	-58.6	91	168.4	-68.6	-178.2	177.4	-178.3	0	108.8	I20	K18-I20 PolarHBondContact O-N 3.32Å
19	L	24.1	Very low	26.5	Very low	133 Å²	133	139 Å²	139	70%	0.696	76%	0.764	S	S	*	*			trans	-78.5	103	178.2	-131.1	88.8	0	0	0	109.1	K17 G21	K17-L19 VanDerWaalsContact C-N 3.3Å; K17-L19 PolarHBondContact O-N 3.37Å; L19-G21 VanDerWaalsContact C-N 3.32Å; L19-G21 PolarHBondContact O-N 2.74Å; L19-G21 VanDerWaalsContact O-N 3.11Å
20	I	22.3	Very low	26.4	Very low	163 Å²	163	143.4 Å²	143.4	84%	0.836	77%	0.765	S	S	*	*			trans	-79.6	85.9	170.2	-59.5	170	0	0	0	106.4	K18 R22	K18-I20 PolarHBondContact O-N 3.32Å; I20-R22 PolarHBondContact O-N 2.89Å
21	G	25.3	Very low	27	Very low	72 Å²	72	147.3 Å²	147.3	74%	0.742	77%	0.773	S	S	*	*			trans	-75.5	110.9	-179.4	0	0	0	0	0	112	L19	L19-G21 VanDerWaalsContact C-N 3.32Å; L19-G21 PolarHBondContact O-N 2.74Å; L19-G21 VanDerWaalsContact O-N 3.11Å
22	R	21.8	Very low	27.4	Very low	234 Å²	234	148.1 Å²	148.1	88%	0.883	76%	0.764	S	S	*	*			trans	-84.7	140.6	178.4	-157.4	173.9	-179.1	159.2	-1.3	109.6	I20 V24	I20-R22 PolarHBondContact O-N 2.89Å; R22-V24 PolarHBondContact O-N 2.85Å
23	T	23.1	Very low	28.3	Very low	125 Å²	125	139.6 Å²	139.6	77%	0.767	74%	0.736	S	S	*	*			trans	-54.8	118.3	-179.8	-47.8	0	0	0	0	112.1
24	V	26	Very low	29.3	Very low	125 Å²	125	134.4 Å²	134.4	76%	0.758	72%	0.718	S	S	*	*			trans	-123.7	123.7	163.3	-77	0	0	0	0	109.2	R22	R22-V24 PolarHBondContact O-N 2.85Å
25	N	24.1	Very low	30.5	Very low	152 Å²	152	134.9 Å²	134.9	81%	0.813	71%	0.714	S	S	*	*			trans	-88.1	107.6	173	-71.9	-40.8	0	0	0	107.3
26	S	26.4	Very low	32	Very low	96 Å²	96	131.8 Å²	131.8	67%	0.671	71%	0.705	S	S	*	*			trans	-120.9	121.3	168.2	-60.8	0	0	0	0	108.2	S28	S26-S28 PolarHBondContact O-N 2.82Å
27	G	23.6	Very low	33.7	Very low	89 Å²	89	129.3 Å²	129.3	92%	0.918	68%	0.684	S	S	*	*			trans	-81.6	105.1	-174.7	0	0	0	0	0	112
28	S	29.1	Very low	35.3	Very low	59 Å²	59	126.7 Å²	126.7	41%	0.413	68%	0.683	S	S	.	*			trans	-106	108.6	153	-179.4	0	0	0	0	108.1	S26 R30	S26-S28 PolarHBondContact O-N 2.82Å; S28-R30 VanDerWaalsContact C-N 3.27Å; S28-R30 PolarHBondContact O-N 3.23Å; S28-R30 VanDerWaalsContact O-N 3.16Å
29	S	31.1	Very low	37.3	Very low	127 Å²	127	119.4 Å²	119.4	89%	0.888	65%	0.653	S	S	*	*			trans	-83.5	69.3	174.8	164.1	0	0	0	0	109.3
30	R	30.3	Very low	39.2	Very low	219 Å²	219	114.1 Å²	114.1	83%	0.826	63%	0.625	S	S	*	*	S	Bend	trans	-124.8	136.9	161.1	-71.1	-172.4	178.4	-168.5	0.9	106.9	S28 R32	S28-R30 VanDerWaalsContact C-N 3.27Å; S28-R30 PolarHBondContact O-N 3.23Å; S28-R30 VanDerWaalsContact O-N 3.16Å; R30-R32 PolarHBondContact O-N 2.74Å
31	Q	39.6	Very low	41	Very low	168 Å²	168	106.9 Å²	106.9	79%	0.785	59%	0.588	S	S	*	*			trans	-25.2	96.8	-167.6	-88.3	179.8	-33.7	0	0	111.5	G33	Q31-G33 PolarHBondContact O-N 2.83Å
32	R	40.3	Very low	42.8	Very low	193 Å²	193	104.8 Å²	104.8	73%	0.728	56%	0.561	S	S	*	*			trans	-59.2	99.7	162.2	-89.5	-173.4	-178.1	-171.7	0.4	103.8	R30 N34	R30-R32 PolarHBondContact O-N 2.74Å; R32-N34 PolarHBondContact O-N 2.74Å
33	G	45.7	Very low	44.2	Very low	13 Å²	13	94.3 Å²	94.3	13%	0.134	52%	0.522	C	S	.	.			trans	-43.9	134.3	163.2	0	0	0	0	0	105.9	Q31 K35	Q31-G33 PolarHBondContact O-N 2.83Å; G33-K35 PolarHBondContact O-N 3.16Å; G33-K35 VanDerWaalsContact O-N 3.08Å
34	N	52.7	Low	45.8	Very low	101 Å²	101	93.7 Å²	93.7	54%	0.54	51%	0.511	S	S	.	.			trans	-46.7	128.9	173.1	179.9	-6.8	0	0	0	106.5	R32 N36 D37	R32-N34 PolarHBondContact O-N 2.74Å; N34-N36 PolarHBondContact O-N 2.98Å; N34-N36 WeakPolarHBondContact OD1-CB 3.39Å; N34-N36 PolarHBondContact OD1-N 2.86Å; N34-N36 VanDerWaalsContact OD1-N 3.11Å; N34-N36 PolarHBondContact OD1-ND2 3.43Å; N34-D37 VanDerWaalsContact O-CB 3.23Å; N34-D37 WeakPolarHBondContact O-CB 3.23Å; N34-D37 PolarHBondContact O-N 3.21Å
35	K	53.9	Low	47.1	Very low	142 Å²	142	94.1 Å²	94.1	62%	0.617	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-11.8	178.5	-67.4	-174.2	177	-173.5	0	112.8	G33	G33-K35 PolarHBondContact O-N 3.16Å; G33-K35 VanDerWaalsContact O-N 3.08Å
36	N	57.2	Low	48.7	Very low	107 Å²	107	88.7 Å²	88.7	57%	0.572	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	5.3	173.9	-52.6	-59.8	0	0	0	114.1	N34 P38	N34-N36 PolarHBondContact O-N 2.98Å; N34-N36 WeakPolarHBondContact OD1-CB 3.39Å; N34-N36 PolarHBondContact OD1-N 2.86Å; N34-N36 VanDerWaalsContact OD1-N 3.11Å; N34-N36 PolarHBondContact OD1-ND2 3.43Å; N36-P38 WeakPolarHBondContact O-CD 3.22Å
37	D	59.4	Low	49.9	Very low	51 Å²	51	85.7 Å²	85.7	27%	0.273	46%	0.458	S	S	.	.			trans	-68.7	120.7	178.5	-165.1	-37.9	0	0	0	109.3	N34 N39 L40	N34-D37 VanDerWaalsContact O-CB 3.23Å; N34-D37 WeakPolarHBondContact O-CB 3.23Å; N34-D37 PolarHBondContact O-N 3.21Å; D37-N39 PolarHBondContact O-N 2.72Å; D37-N39 VanDerWaalsContact OD1-CB 3.31Å; D37-N39 WeakPolarHBondContact OD1-CB 3.41Å; D37-N39 PolarHBondContact OD1-N 2.98Å; D37-L40 HydrophobicContact CB-CB 4.15Å; D37-L40 PolarHBondContact O-N 3.49Å; D37-L40 VanDerWaalsContact O-N 3.09Å
38	P	62.6	Low	51.6	Low	99 Å²	99	84.3 Å²	84.3	64%	0.643	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-8.6	178.7	28.8	-37	0	0	0	113.7	N36 R209	N36-P38 WeakPolarHBondContact O-CD 3.22Å; P38-R209 PolarHBondContact O-NH1 3.09Å; P38-R209 VanDerWaalsContact O-NH1 3.1Å
39	N	64.5	Low	52.9	Low	39 Å²	39	83.7 Å²	83.7	21%	0.209	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-7.8	177.4	-62.1	-5.2	0	0	0	113.4	D37 F41 M50 F51 R209	D37-N39 PolarHBondContact O-N 2.72Å; D37-N39 VanDerWaalsContact OD1-CB 3.31Å; D37-N39 WeakPolarHBondContact OD1-CB 3.41Å; D37-N39 PolarHBondContact OD1-N 2.98Å; N39-F41 VanDerWaalsContact O-CD2 3.24Å; N39-F41 WeakPolarHBondContact O-CD2 3.42Å; N39-F41 WeakPolarHBondContact O-CE2 3.5Å; N39-M50 HydrophobicContact CB-CG 4.43Å; N39-M50 WeakPolarHBondContact O-CA 3.44Å; N39-F51 WeakPolarHBondContact CB-O 3.33Å; N39-F51 PolarHBondContact ND2-O 3.43Å; N39-F51 PolarHBondContact O-N 3.17Å; N39-R209 PolarHBondContact OD1-NH1 3.35Å; N39-R209 VanDerWaalsContact OD1-NH1 3.14Å; N39-R209 PolarHBondContact OD1-NH2 3.48Å
40	L	65.2	Low	53.8	Low	22 Å²	22	78 Å²	78	12%	0.115	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.2	179	-173.4	68	0	0	0	110.6	D37 E48 Y49 L65	D37-L40 HydrophobicContact CB-CB 4.15Å; D37-L40 PolarHBondContact O-N 3.49Å; D37-L40 VanDerWaalsContact O-N 3.09Å; L40-E48 HydrophobicContact CD1-CB 4.24Å; L40-Y49 CarbonylContact C-O 3.56Å; L40-Y49 WeakPolarHBondContact CA-O 3.42Å; L40-L65 HydrophobicContact CD1-CD1 3.42Å; L40-L65 VanDerWaalsContact CD1-CD1 3.42Å
41	F	60.1	Low	55.2	Low	12 Å²	12	68.1 Å²	68.1	5%	0.053	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	145.4	178.9	-64.5	-98.4	0	0	0	110	N39 E48 Y49 F51 M197 L202 K205	N39-F41 VanDerWaalsContact O-CD2 3.24Å; N39-F41 WeakPolarHBondContact O-CD2 3.42Å; N39-F41 WeakPolarHBondContact O-CE2 3.5Å; F41-E48 CarbonylContact O-C 3.58Å; F41-E48 WeakPolarHBondContact O-CA 3.33Å; F41-Y49 PolarHBondContact N-O 3.11Å; F41-Y49 PolarHBondContact O-N 3.49Å; F41-F51 HydrophobicContact CB-CE2 4.31Å; F41-F51 AromaticContact CD2-CD2 3.34Å; F41-F51 HydrophobicContact CD2-CD2 3.34Å; F41-F51 AromaticContact CD2-CE2 3.36Å; F41-F51 HydrophobicContact CD2-CE2 3.36Å; F41-F51 AromaticContact CE2-CD2 3.5Å; F41-F51 HydrophobicContact CE2-CD2 3.5Å; F41-F51 VanDerWaalsContact CE2-CD2 3.5Å; F41-F51 AromaticContact CE2-CE2 3.85Å; F41-F51 HydrophobicContact CE2-CE2 3.85Å; F41-F51 HydrophobicContact CG-CD2 4.39Å; F41-F51 AromaticContact CG-CE2 3.99Å; F41-F51 HydrophobicContact CG-CE2 3.99Å; F41-M197 HydrophobicContact CD1-CE 3.65Å; F41-M197 HydrophobicContact CD1-SD 4.05Å; F41-M197 HydrophobicContact CE1-CE 3.98Å; F41-M197 HydrophobicContact CE1-SD 4.48Å; F41-L202 HydrophobicContact CB-CD1 3.76Å; F41-L202 HydrophobicContact CD1-CD1 3.41Å; F41-L202 VanDerWaalsContact CD1-CD1 3.41Å; F41-L202 HydrophobicContact CE1-CD1 4.18Å; F41-L202 HydrophobicContact CG-CD1 3.72Å; F41-K205 HydrophobicContact CE1-CD 3.9Å; F41-K205 HydrophobicContact CE1-CG 4.5Å
42	V	61.8	Low	55.9	Low	28 Å²	28	64 Å²	64	17%	0.17	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.6	176.7	-168.6	0	0	0	0	107.7	I47 E48 P194	V42-I47 VanDerWaalsContact CA-O 3.3Å; V42-I47 WeakPolarHBondContact CA-O 3.24Å; V42-E48 HydrophobicContact CG1-CG 4.49Å; V42-E48 HydrophobicContact CG2-CG 4.03Å; V42-P194 HydrophobicContact CG2-CB 4.06Å; V42-P194 HydrophobicContact CG2-CG 4.06Å
43	D	52.7	Low	56.3	Low	13 Å²	13	61.1 Å²	61.1	7%	0.07	31%	0.312	C	S	.	.			trans	-77.5	-178.5	176.1	69.1	16.4	0	0	0	112.4	F45 G46 I47 Y49	D43-F45 PolarHBondContact O-N 2.73Å; D43-F45 WeakPolarHBondContact OD1-CA 3.38Å; D43-F45 WeakPolarHBondContact OD1-CB 3.46Å; D43-F45 PolarHBondContact OD1-N 2.95Å; D43-G46 PolarHBondContact O-N 3.09Å; D43-G46 PolarHBondContact OD1-N 2.77Å; D43-I47 PolarHBondContact N-O 3.29Å; D43-I47 PolarHBondContact OD1-N 3.07Å; D43-I47 WeakPolarHBondContact OD2-CB 3.28Å; D43-Y49 HydrophobicContact CB-CE2 3.79Å; D43-Y49 WeakPolarHBondContact OD2-CE2 3.15Å; D43-Y49 PolarHBondContact OD2-OH 3.35Å
44	E	55.7	Low	56.5	Low	113 Å²	113	63.2 Å²	63.2	53%	0.528	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.9	178.5	64.3	-172.8	172.8	0	0	113.8	G46 P199	E44-G46 VanDerWaalsContact C-N 3.33Å; E44-P199 HydrophobicContact CG-CG 4.17Å; E44-P199 WeakPolarHBondContact OE1-CD 3.47Å; E44-P199 VanDerWaalsContact OE1-CG 3.24Å; E44-P199 WeakPolarHBondContact OE1-CG 3.38Å
45	F	52.6	Low	56.2	Low	134 Å²	134	64.1 Å²	64.1	59%	0.588	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-6.1	176.6	-57	-74.7	0	0	0	112.6	D43 I47 P68	D43-F45 PolarHBondContact O-N 2.73Å; D43-F45 WeakPolarHBondContact OD1-CA 3.38Å; D43-F45 WeakPolarHBondContact OD1-CB 3.46Å; D43-F45 PolarHBondContact OD1-N 2.95Å; F45-I47 HydrophobicContact CB-CD1 4.4Å; F45-I47 HydrophobicContact CB-CG1 4.19Å; F45-P68 WeakPolarHBondContact O-CD 3.37Å; F45-P68 WeakPolarHBondContact O-CG 3.47Å
46	G	57.6	Low	55.5	Low	37 Å²	37	65.2 Å²	65.2	38%	0.381	34%	0.341	S	S	.	.			trans	84.5	13.2	-178.6	0	0	0	0	0	113.6	D43 E44	D43-G46 PolarHBondContact O-N 3.09Å; D43-G46 PolarHBondContact OD1-N 2.77Å; E44-G46 VanDerWaalsContact C-N 3.33Å
47	I	53.2	Low	54.3	Low	33 Å²	33	68.2 Å²	68.2	17%	0.169	34%	0.344	C	S	.	.			trans	-77.9	126	176	-54.1	179.5	0	0	0	108.7	V42 D43 F45 Y49 I64 D66	V42-I47 VanDerWaalsContact CA-O 3.3Å; V42-I47 WeakPolarHBondContact CA-O 3.24Å; D43-I47 PolarHBondContact N-O 3.29Å; D43-I47 PolarHBondContact OD1-N 3.07Å; D43-I47 WeakPolarHBondContact OD2-CB 3.28Å; F45-I47 HydrophobicContact CB-CD1 4.4Å; F45-I47 HydrophobicContact CB-CG1 4.19Å; I47-Y49 HydrophobicContact CB-CE2 3.86Å; I47-Y49 HydrophobicContact CG2-CE1 4.23Å; I47-Y49 HydrophobicContact CG2-CE2 3.84Å; I47-Y49 WeakPolarHBondContact O-CD2 3.43Å; I47-Y49 VanDerWaalsContact O-CE2 3.25Å; I47-Y49 WeakPolarHBondContact O-CE2 3.5Å; I47-I64 HydrophobicContact CG2-CG2 3.39Å; I47-D66 WeakPolarHBondContact CA-O 3.42Å
48	E	57.8	Low	53.3	Low	61 Å²	61	74.9 Å²	74.9	29%	0.285	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	128.3	178.2	-61.7	-169	170.5	0	0	111	L40 F41 V42 I64 L65 D66	L40-E48 HydrophobicContact CD1-CB 4.24Å; F41-E48 CarbonylContact O-C 3.58Å; F41-E48 WeakPolarHBondContact O-CA 3.33Å; V42-E48 HydrophobicContact CG1-CG 4.49Å; V42-E48 HydrophobicContact CG2-CG 4.03Å; E48-I64 CarbonylContact O-C 3.57Å; E48-I64 WeakPolarHBondContact O-CA 2.94Å; E48-L65 HydrophobicContact CB-CB 3.95Å; E48-L65 HydrophobicContact CB-CD1 4.27Å; E48-L65 PolarHBondContact O-N 3.23Å; E48-D66 PolarHBondContact N-O 2.98Å; E48-D66 VanDerWaalsContact N-O 3.09Å
49	Y	56.4	Low	51.9	Low	45 Å²	45	73.8 Å²	73.8	18%	0.176	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135	177.6	-55.4	-94.8	0	0	0	109.9	L40 F41 D43 I47 I62 E63 I64 L202	L40-Y49 CarbonylContact C-O 3.56Å; L40-Y49 WeakPolarHBondContact CA-O 3.42Å; F41-Y49 PolarHBondContact N-O 3.11Å; F41-Y49 PolarHBondContact O-N 3.49Å; D43-Y49 HydrophobicContact CB-CE2 3.79Å; D43-Y49 WeakPolarHBondContact OD2-CE2 3.15Å; D43-Y49 PolarHBondContact OD2-OH 3.35Å; I47-Y49 HydrophobicContact CB-CE2 3.86Å; I47-Y49 HydrophobicContact CG2-CE1 4.23Å; I47-Y49 HydrophobicContact CG2-CE2 3.84Å; I47-Y49 WeakPolarHBondContact O-CD2 3.43Å; I47-Y49 VanDerWaalsContact O-CE2 3.25Å; I47-Y49 WeakPolarHBondContact O-CE2 3.5Å; Y49-I62 HydrophobicContact CD1-CG2 3.88Å; Y49-E63 WeakPolarHBondContact CA-O 3.47Å; Y49-I64 HydrophobicContact CD1-CG1 4.09Å; Y49-I64 HydrophobicContact CE1-CD1 4.44Å; Y49-I64 HydrophobicContact CE1-CG1 3.95Å; Y49-L202 HydrophobicContact CD2-CD2 4.39Å; Y49-L202 HydrophobicContact CE2-CD2 4.45Å
50	M	51.3	Low	50.6	Low	7 Å²	7	75.3 Å²	75.3	3%	0.034	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129.3	171.8	-173.5	153.4	44.8	0	0	111.2	N39 Y52 E63 L65	N39-M50 HydrophobicContact CB-CG 4.43Å; N39-M50 WeakPolarHBondContact O-CA 3.44Å; M50-Y52 HydrophobicContact CB-CE2 4.21Å; M50-Y52 HydrophobicContact CE-CE2 4.24Å; M50-Y52 WeakPolarHBondContact CE-OH 3.42Å; M50-Y52 HydrophobicContact CG-CD2 4.44Å; M50-Y52 HydrophobicContact CG-CE1 4.01Å; M50-Y52 HydrophobicContact CG-CE2 3.79Å; M50-Y52 HydrophobicContact SD-CE1 4.11Å; M50-Y52 HydrophobicContact SD-CE2 4.48Å; M50-Y52 PolarHBondContact SD-OH 3.48Å; M50-Y52 VanDerWaalsContact SD-OH 3.4Å; M50-E63 PolarHBondContact N-O 2.91Å; M50-E63 PolarHBondContact O-N 2.94Å; M50-L65 HydrophobicContact CB-CD1 3.91Å; M50-L65 HydrophobicContact CB-CG 4.4Å; M50-L65 HydrophobicContact CE-CD1 3.75Å; M50-L65 HydrophobicContact CE-CD2 3.81Å; M50-L65 HydrophobicContact CE-CG 4.36Å
51	F	58.8	Low	49.3	Very low	13 Å²	13	77.3 Å²	77.3	6%	0.057	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121.9	-179.3	-64.6	-92.3	0	0	0	110.4	N39 F41 V60 I62 I206	N39-F51 WeakPolarHBondContact CB-O 3.33Å; N39-F51 PolarHBondContact ND2-O 3.43Å; N39-F51 PolarHBondContact O-N 3.17Å; F41-F51 HydrophobicContact CB-CE2 4.31Å; F41-F51 AromaticContact CD2-CD2 3.34Å; F41-F51 HydrophobicContact CD2-CD2 3.34Å; F41-F51 AromaticContact CD2-CE2 3.36Å; F41-F51 HydrophobicContact CD2-CE2 3.36Å; F41-F51 AromaticContact CE2-CD2 3.5Å; F41-F51 HydrophobicContact CE2-CD2 3.5Å; F41-F51 VanDerWaalsContact CE2-CD2 3.5Å; F41-F51 AromaticContact CE2-CE2 3.85Å; F41-F51 HydrophobicContact CE2-CE2 3.85Å; F41-F51 HydrophobicContact CG-CD2 4.39Å; F41-F51 AromaticContact CG-CE2 3.99Å; F41-F51 HydrophobicContact CG-CE2 3.99Å; F51-V60 HydrophobicContact CD1-CG1 4.13Å; F51-I62 HydrophobicContact CD1-CG1 4.16Å; F51-I62 HydrophobicContact CE1-CD1 3.94Å; F51-I62 HydrophobicContact CE1-CG1 3.78Å; F51-I62 HydrophobicContact CE1-CG2 4.35Å; F51-I62 HydrophobicContact CZ-CG2 4.42Å; F51-I206 HydrophobicContact CE1-CB 4.42Å; F51-I206 HydrophobicContact CE1-CD1 3.71Å; F51-I206 HydrophobicContact CE1-CG1 3.64Å; F51-I206 HydrophobicContact CE1-CG2 3.91Å; F51-I206 HydrophobicContact CE2-CD1 4.32Å; F51-I206 HydrophobicContact CE2-CG1 4.21Å; F51-I206 HydrophobicContact CZ-CD1 3.32Å; F51-I206 HydrophobicContact CZ-CG1 3.45Å; F51-I206 VanDerWaalsContact CZ-CG1 3.45Å
52	Y	55.2	Low	48.6	Very low	81 Å²	81	80.8 Å²	80.8	32%	0.318	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.9	171.9	-57.7	-78.3	0	0	0	109.8	M50 T61 E63	M50-Y52 HydrophobicContact CB-CE2 4.21Å; M50-Y52 HydrophobicContact CE-CE2 4.24Å; M50-Y52 WeakPolarHBondContact CE-OH 3.42Å; M50-Y52 HydrophobicContact CG-CD2 4.44Å; M50-Y52 HydrophobicContact CG-CE1 4.01Å; M50-Y52 HydrophobicContact CG-CE2 3.79Å; M50-Y52 HydrophobicContact SD-CE1 4.11Å; M50-Y52 HydrophobicContact SD-CE2 4.48Å; M50-Y52 PolarHBondContact SD-OH 3.48Å; M50-Y52 VanDerWaalsContact SD-OH 3.4Å; Y52-T61 PolarHBondContact N-O 3.26Å; Y52-E63 HydrophobicContact CE2-CG 4.21Å
53	E	47.5	Very low	47.7	Very low	133 Å²	133	83.8 Å²	83.8	62%	0.621	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	108.3	161	-171.6	175.3	-173.7	0	0	106	P55	E53-P55 VanDerWaalsContact O-CD 3.23Å; E53-P55 WeakPolarHBondContact O-CD 3.34Å
54	D	49.8	Very low	47.4	Very low	56 Å²	56	86.1 Å²	86.1	30%	0.299	43%	0.425	S	S	.	.			trans	-81.2	109.9	168.1	-175.2	-13.1	0	0	0	107.5	M56 R57	D54-M56 PolarHBondContact O-N 2.77Å; D54-M56 VanDerWaalsContact O-N 3.09Å; D54-M56 WeakPolarHBondContact OD1-CA 3.18Å; D54-M56 WeakPolarHBondContact OD1-CB 3.38Å; D54-M56 PolarHBondContact OD1-N 2.89Å; D54-R57 HydrophobicContact CB-CB 4.02Å; D54-R57 PolarHBondContact O-N 2.74Å; D54-R57 VanDerWaalsContact O-N 3.16Å; D54-R57 WeakPolarHBondContact OD2-CD 3.41Å; D54-R57 WeakPolarHBondContact OD2-CG 3.36Å; D54-R57 IonicContact OD2-NE 3.14Å
55	P	46.4	Very low	46.8	Very low	121 Å²	121	83 Å²	83	79%	0.786	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.8	179.5	25.7	-33.2	0	0	0	112.9	E53	E53-P55 VanDerWaalsContact O-CD 3.23Å; E53-P55 WeakPolarHBondContact O-CD 3.34Å
56	M	39.1	Very low	46.4	Very low	164 Å²	164	80.6 Å²	80.6	81%	0.808	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-15.1	179.2	-64.7	-62.9	-63.1	0	0	113.6	D54	D54-M56 PolarHBondContact O-N 2.77Å; D54-M56 VanDerWaalsContact O-N 3.09Å; D54-M56 WeakPolarHBondContact OD1-CA 3.18Å; D54-M56 WeakPolarHBondContact OD1-CB 3.38Å; D54-M56 PolarHBondContact OD1-N 2.89Å
57	R	32.8	Very low	45.3	Very low	171 Å²	171	80.1 Å²	80.1	65%	0.645	40%	0.399	S	S	*	.	S	Bend	trans	-125.5	134.3	-177.9	-60.9	-179.7	-177.3	-135.4	-3	110.9	D54 T59	D54-R57 HydrophobicContact CB-CB 4.02Å; D54-R57 PolarHBondContact O-N 2.74Å; D54-R57 VanDerWaalsContact O-N 3.16Å; D54-R57 WeakPolarHBondContact OD2-CD 3.41Å; D54-R57 WeakPolarHBondContact OD2-CG 3.36Å; D54-R57 IonicContact OD2-NE 3.14Å; R57-T59 WeakPolarHBondContact CB-OG1 3.32Å; R57-T59 PolarHBondContact O-N 3.16Å
58	Y	38	Very low	44.4	Very low	190 Å²	190	82 Å²	82	75%	0.745	41%	0.414	S	S	*	.	S	Bend	trans	-75.1	35.5	175.8	-56.1	-58.4	0	0	0	113.1	R217	Y58-R217 VanDerWaalsContact CD1-CZ 3.43Å; Y58-R217 PolarHBondContact OH-NH2 3.47Å; Y58-R217 VanDerWaalsContact OH-NH2 3.14Å
59	T	34.2	Very low	43.3	Very low	77 Å²	77	85.2 Å²	85.2	47%	0.472	44%	0.438	S	S	.	.			trans	-130.5	124.2	-171.1	55.6	0	0	0	0	109.5	R57	R57-T59 WeakPolarHBondContact CB-OG1 3.32Å; R57-T59 PolarHBondContact O-N 3.16Å
60	V	37.6	Very low	42.4	Very low	70 Å²	70	87.9 Å²	87.9	42%	0.424	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	118.8	168.5	177.9	0	0	0	0	107.8	F51 I62 Q210	F51-V60 HydrophobicContact CD1-CG1 4.13Å; V60-I62 HydrophobicContact CG1-CG1 4.35Å; V60-Q210 HydrophobicContact CG2-CG 4.14Å
61	T	36.3	Very low	41.6	Very low	64 Å²	64	96.6 Å²	96.6	39%	0.393	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	124.8	174.2	-51.2	0	0	0	0	108.5	Y52 E63	Y52-T61 PolarHBondContact N-O 3.26Å; T61-E63 HydrophobicContact CG2-CG 4.25Å
62	I	46	Very low	40.5	Very low	86 Å²	86	99.4 Å²	99.4	44%	0.441	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	111	174.6	-53.6	177.7	0	0	0	106.8	Y49 F51 V60	Y49-I62 HydrophobicContact CD1-CG2 3.88Å; F51-I62 HydrophobicContact CD1-CG1 4.16Å; F51-I62 HydrophobicContact CE1-CD1 3.94Å; F51-I62 HydrophobicContact CE1-CG1 3.78Å; F51-I62 HydrophobicContact CE1-CG2 4.35Å; F51-I62 HydrophobicContact CZ-CG2 4.42Å; V60-I62 HydrophobicContact CG1-CG1 4.35Å
63	E	43.7	Very low	39.6	Very low	91 Å²	91	105.3 Å²	105.3	43%	0.425	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124.1	173	-66.6	-172.5	174	0	0	109.7	Y49 M50 Y52 T61 L65	Y49-E63 WeakPolarHBondContact CA-O 3.47Å; M50-E63 PolarHBondContact N-O 2.91Å; M50-E63 PolarHBondContact O-N 2.94Å; Y52-E63 HydrophobicContact CE2-CG 4.21Å; T61-E63 HydrophobicContact CG2-CG 4.25Å; E63-L65 HydrophobicContact CB-CD2 4.36Å
64	I	45.9	Very low	39	Very low	62 Å²	62	106.3 Å²	106.3	32%	0.318	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.9	113.7	169.5	-61.4	170.3	0	0	0	107.3	I47 E48 Y49 L78	I47-I64 HydrophobicContact CG2-CG2 3.39Å; E48-I64 CarbonylContact O-C 3.57Å; E48-I64 WeakPolarHBondContact O-CA 2.94Å; Y49-I64 HydrophobicContact CD1-CG1 4.09Å; Y49-I64 HydrophobicContact CE1-CD1 4.44Å; Y49-I64 HydrophobicContact CE1-CG1 3.95Å; I64-L78 HydrophobicContact CB-CD2 4.23Å; I64-L78 HydrophobicContact CD1-CD1 4.47Å; I64-L78 HydrophobicContact CD1-CD2 3.97Å; I64-L78 HydrophobicContact CG2-CD2 3.79Å
65	L	43.4	Very low	38.2	Very low	48 Å²	48	106 Å²	106	25%	0.251	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.7	-39.4	-168.1	-62.3	171.5	0	0	0	113.8	L40 E48 M50 E63	L40-L65 HydrophobicContact CD1-CD1 3.42Å; L40-L65 VanDerWaalsContact CD1-CD1 3.42Å; E48-L65 HydrophobicContact CB-CB 3.95Å; E48-L65 HydrophobicContact CB-CD1 4.27Å; E48-L65 PolarHBondContact O-N 3.23Å; M50-L65 HydrophobicContact CB-CD1 3.91Å; M50-L65 HydrophobicContact CB-CG 4.4Å; M50-L65 HydrophobicContact CE-CD1 3.75Å; M50-L65 HydrophobicContact CE-CD2 3.81Å; M50-L65 HydrophobicContact CE-CG 4.36Å; E63-L65 HydrophobicContact CB-CD2 4.36Å
66	D	44.1	Very low	37.7	Very low	82 Å²	82	102.9 Å²	102.9	44%	0.439	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	131.9	173.3	-132.6	-13.4	0	0	0	108.4	I47 E48	I47-D66 WeakPolarHBondContact CA-O 3.42Å; E48-D66 PolarHBondContact N-O 2.98Å; E48-D66 VanDerWaalsContact N-O 3.09Å
67	G	33.8	Very low	37.3	Very low	27 Å²	27	98.7 Å²	98.7	28%	0.278	52%	0.52	S	S	.	.			trans	-124.9	151.7	171.2	0	0	0	0	0	108.9	T69	G67-T69 PolarHBondContact O-N 3.1Å; G67-T69 VanDerWaalsContact O-N 3.1Å
68	P	34.6	Very low	37.8	Very low	73 Å²	73	95.1 Å²	95.1	47%	0.474	51%	0.513	S	S	.	.			trans	-57.7	123.8	179.1	25.2	-32.9	0	0	0	109.4	F45 E70	F45-P68 WeakPolarHBondContact O-CD 3.37Å; F45-P68 WeakPolarHBondContact O-CG 3.47Å; P68-E70 HydrophobicContact CB-CG 4.21Å; P68-E70 HydrophobicContact CG-CG 4.44Å; P68-E70 PolarHBondContact O-N 3.1Å
69	T	35.3	Very low	37.7	Very low	128 Å²	128	93.9 Å²	93.9	79%	0.785	52%	0.519	S	S	*	.			trans	-67.8	75	163.7	-39.8	0	0	0	0	107.1	G67 E71	G67-T69 PolarHBondContact O-N 3.1Å; G67-T69 VanDerWaalsContact O-N 3.1Å; T69-E71 PolarHBondContact O-N 3.46Å; T69-E71 VanDerWaalsContact O-N 3.09Å
70	E	36.4	Very low	38	Very low	101 Å²	101	92.7 Å²	92.7	47%	0.472	51%	0.509	S	S	.	.			trans	-70	104	164.9	-68.4	-148	167.7	0	0	106.1	P68 T72 A75	P68-E70 HydrophobicContact CB-CG 4.21Å; P68-E70 HydrophobicContact CG-CG 4.44Å; P68-E70 PolarHBondContact O-N 3.1Å; E70-T72 HydrophobicContact CB-CG2 4.15Å; E70-T72 PolarHBondContact O-N 3.18Å; E70-A75 VanDerWaalsContact O-CB 3.28Å; E70-A75 WeakPolarHBondContact O-CB 3.46Å
71	E	34.9	Very low	38.2	Very low	191 Å²	191	92.5 Å²	92.5	89%	0.893	51%	0.505	S	S	*	.			trans	-65.8	64.3	157.6	-61.8	-154.2	-180	0	0	108.6	T69	T69-E71 PolarHBondContact O-N 3.46Å; T69-E71 VanDerWaalsContact O-N 3.09Å
72	T	35.8	Very low	38.6	Very low	71 Å²	71	93.2 Å²	93.2	44%	0.436	51%	0.509	S	S	.	.			trans	-93.5	127.7	157.2	53.8	0	0	0	0	104.5	E70 N74 A75	E70-T72 HydrophobicContact CB-CG2 4.15Å; E70-T72 PolarHBondContact O-N 3.18Å; T72-N74 PolarHBondContact O-N 3.05Å; T72-A75 WeakPolarHBondContact O-CB 3.39Å; T72-A75 PolarHBondContact O-N 2.91Å
73	E	36.5	Very low	38.5	Very low	205 Å²	205	94.8 Å²	94.8	96%	0.958	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	1.6	-178.2	-79	177.5	136.5	0	0	114.7
74	N	35.6	Very low	38.6	Very low	155 Å²	155	96.6 Å²	96.6	83%	0.829	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	10.4	173.5	-65.3	-46.9	0	0	0	113.7	T72 V76	T72-N74 PolarHBondContact O-N 3.05Å; N74-V76 PolarHBondContact O-N 3.14Å
75	A	32.2	Very low	38.6	Very low	50 Å²	50	100.7 Å²	100.7	41%	0.413	54%	0.542	S	S	.	.			trans	-71.7	112.1	172.5	0	0	0	0	0	109	E70 T72 P77	E70-A75 VanDerWaalsContact O-CB 3.28Å; E70-A75 WeakPolarHBondContact O-CB 3.46Å; T72-A75 WeakPolarHBondContact O-CB 3.39Å; T72-A75 PolarHBondContact O-N 2.91Å; A75-P77 VanDerWaalsContact O-CD 3.22Å; A75-P77 WeakPolarHBondContact O-CD 3.41Å; A75-P77 VanDerWaalsContact O-N 3.13Å
76	V	36.5	Very low	38.6	Very low	54 Å²	54	101.4 Å²	101.4	33%	0.327	55%	0.548	S	S	.	.			trans	-55.8	116.1	171.5	-171.8	0	0	0	0	107.7	N74 L78 T101	N74-V76 PolarHBondContact O-N 3.14Å; V76-L78 PolarHBondContact O-N 3.26Å; V76-T101 HydrophobicContact CB-CG2 3.72Å; V76-T101 HydrophobicContact CG1-CG2 3.58Å; V76-T101 HydrophobicContact CG2-CG2 3.08Å; V76-T101 WeakPolarHBondContact CG2-OG1 3.33Å
77	P	30.7	Very low	38.6	Very low	77 Å²	77	100.3 Å²	100.3	50%	0.5	55%	0.55	S	S	.	*			trans	-60.3	113.9	171	22.5	-29.4	0	0	0	108.1	A75 L79 D80	A75-P77 VanDerWaalsContact O-CD 3.22Å; A75-P77 WeakPolarHBondContact O-CD 3.41Å; A75-P77 VanDerWaalsContact O-N 3.13Å; P77-L79 PolarHBondContact O-N 3.14Å; P77-D80 PolarHBondContact O-N 3.07Å
78	L	43.6	Very low	39.2	Very low	96 Å²	96	105.2 Å²	105.2	50%	0.503	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-54.7	-16.9	-179.7	-147.7	83.2	0	0	0	113.3	I64 V76 D80 M81	I64-L78 HydrophobicContact CB-CD2 4.23Å; I64-L78 HydrophobicContact CD1-CD1 4.47Å; I64-L78 HydrophobicContact CD1-CD2 3.97Å; I64-L78 HydrophobicContact CG2-CD2 3.79Å; V76-L78 PolarHBondContact O-N 3.26Å; L78-D80 PolarHBondContact O-N 3.25Å; L78-D80 VanDerWaalsContact O-N 3.16Å; L78-M81 HydrophobicContact CD1-SD 3.5Å; L78-M81 WeakPolarHBondContact CD1-SD 3.45Å; L78-M81 HydrophobicContact CG-SD 3.56Å; L78-M81 VanDerWaalsContact CG-SD 3.56Å; L78-M81 WeakPolarHBondContact O-CG 3.13Å; L78-M81 PolarHBondContact O-N 3.09Å
79	L	34.8	Very low	40.2	Very low	164 Å²	164	109.6 Å²	109.6	86%	0.859	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-59.4	-18.7	177.9	-81.8	146.9	0	0	0	114.1	P77	P77-L79 PolarHBondContact O-N 3.14Å
80	D	41.2	Very low	40.7	Very low	52 Å²	52	106.7 Å²	106.7	28%	0.278	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-111.5	31.6	-175.1	-73.3	-45.4	0	0	0	113.3	P77 L78 K100	P77-D80 PolarHBondContact O-N 3.07Å; L78-D80 PolarHBondContact O-N 3.25Å; L78-D80 VanDerWaalsContact O-N 3.16Å; D80-K100 HydrophobicContact CB-CB 3.87Å; D80-K100 HydrophobicContact CB-CD 3.94Å; D80-K100 HydrophobicContact CB-CG 3.79Å; D80-K100 VanDerWaalsContact CG-CE 3.43Å; D80-K100 PolarHBondContact O-N 2.99Å; D80-K100 WeakPolarHBondContact OD1-CE 3.47Å; D80-K100 IonicContact OD1-NZ 2.89Å; D80-K100 PolarHBondContact OD1-NZ 2.85Å; D80-K100 VanDerWaalsContact OD2-CD 3.23Å; D80-K100 WeakPolarHBondContact OD2-CD 3.31Å; D80-K100 WeakPolarHBondContact OD2-CE 3.45Å; D80-K100 IonicContact OD2-NZ 2.77Å; D80-K100 PolarHBondContact OD2-NZ 3.5Å
81	M	41.8	Very low	41.1	Very low	66 Å²	66	107.9 Å²	107.9	33%	0.325	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.5	114	172.7	-63.9	-179.7	72.9	0	0	109.8	L78 L97 T98 T99	L78-M81 HydrophobicContact CD1-SD 3.5Å; L78-M81 WeakPolarHBondContact CD1-SD 3.45Å; L78-M81 HydrophobicContact CG-SD 3.56Å; L78-M81 VanDerWaalsContact CG-SD 3.56Å; L78-M81 WeakPolarHBondContact O-CG 3.13Å; L78-M81 PolarHBondContact O-N 3.09Å; M81-L97 HydrophobicContact CB-CD1 4.28Å; M81-L97 HydrophobicContact CE-CD1 3.57Å; M81-L97 HydrophobicContact CE-CD2 3.52Å; M81-L97 HydrophobicContact CE-CG 3.86Å; M81-T98 WeakPolarHBondContact CA-O 3.3Å; M81-T99 HydrophobicContact CE-CG2 4.41Å; M81-T99 HydrophobicContact CG-CG2 4.05Å
82	T	43.3	Very low	41.3	Very low	79 Å²	79	104.1 Å²	104.1	49%	0.485	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.1	125.1	175.4	-48.5	0	0	0	0	109.4	T98	T82-T98 PolarHBondContact N-O 2.73Å; T82-T98 PolarHBondContact O-N 3.08Å; T82-T98 PolarHBondContact O-OG1 3.24Å
83	L	44.6	Very low	41.7	Very low	119 Å²	119	102 Å²	102	62%	0.623	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.8	120.4	169.3	-64.7	172.3	0	0	0	108.2	V95 L97	L83-V95 HydrophobicContact CB-CG1 4.24Å; L83-V95 HydrophobicContact CD2-CG1 3.82Å; L83-V95 HydrophobicContact CG-CG1 4.5Å; L83-L97 HydrophobicContact CD2-CB 4.33Å; L83-L97 HydrophobicContact CD2-CD1 3.61Å; L83-L97 HydrophobicContact CG-CD1 4.45Å
84	K	45.2	Very low	42	Very low	128 Å²	128	92.4 Å²	92.4	56%	0.557	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	124.2	168.4	-75.2	-174.2	177.9	178.3	0	109.2	V86 V96 T98	K84-V86 PolarHBondContact O-N 2.93Å; K84-V96 PolarHBondContact N-O 2.95Å; K84-V96 PolarHBondContact O-N 2.85Å; K84-T98 HydrophobicContact CD-CG2 4.48Å
85	E	45.9	Very low	42.3	Very low	149 Å²	149	87.4 Å²	87.4	70%	0.696	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	126.4	166.8	-72.3	176.9	-175.5	0	0	108.5	L92	E85-L92 HydrophobicContact CB-CD2 3.59Å; E85-L92 HydrophobicContact CG-CD2 3.7Å
86	V	44.7	Very low	42.9	Very low	63 Å²	63	85.7 Å²	85.7	38%	0.382	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.7	169.7	175.2	0	0	0	0	106.5	K84 T93 A94 V96	K84-V86 PolarHBondContact O-N 2.93Å; V86-T93 PolarHBondContact O-N 2.9Å; V86-T93 PolarHBondContact O-OG1 3.38Å; V86-A94 HydrophobicContact CB-CB 4.25Å; V86-A94 PolarHBondContact N-O 3.18Å; V86-A94 PolarHBondContact O-N 3.04Å; V86-A94 VanDerWaalsContact O-N 3.08Å; V86-V96 HydrophobicContact CB-CG2 4.35Å; V86-V96 HydrophobicContact CG2-CB 4.42Å; V86-V96 HydrophobicContact CG2-CG2 3.45Å; V86-V96 VanDerWaalsContact CG2-CG2 3.45Å
87	A	44.1	Very low	43.3	Very low	58 Å²	58	85 Å²	85	48%	0.479	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.2	172.7	0	0	0	0	0	108.7	D91	A87-D91 CarbonylContact C-O 3.49Å; A87-D91 WeakPolarHBondContact CA-O 3.41Å; A87-D91 WeakPolarHBondContact CB-O 3.25Å
88	E	46.8	Very low	43.8	Very low	130 Å²	130	82.5 Å²	82.5	61%	0.607	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	128.3	166.9	-165.1	176.6	171.7	0	0	107	G90 D91 T93	E88-G90 PolarHBondContact O-N 2.9Å; E88-D91 PolarHBondContact N-O 3.2Å; E88-D91 VanDerWaalsContact N-O 3.08Å; E88-D91 PolarHBondContact O-N 3.34Å; E88-D91 VanDerWaalsContact O-N 3.09Å; E88-T93 HydrophobicContact CB-CG2 3.61Å; E88-T93 PolarHBondContact N-OG1 3.44Å
89	D	53.9	Low	43.6	Very low	166 Å²	166	79 Å²	79	89%	0.888	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	20.9	-178.5	-63.1	-24.3	0	0	0	116.2
90	G	47.4	Very low	43.6	Very low	67 Å²	67	78.7 Å²	78.7	69%	0.691	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.9	-6.4	178.6	0	0	0	0	0	114.8	E88	E88-G90 PolarHBondContact O-N 2.9Å
91	D	43.8	Very low	43.4	Very low	126 Å²	126	78.7 Å²	78.7	67%	0.674	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	133.6	172	-72.6	-28.8	0	0	0	109.7	A87 E88 T93	A87-D91 CarbonylContact C-O 3.49Å; A87-D91 WeakPolarHBondContact CA-O 3.41Å; A87-D91 WeakPolarHBondContact CB-O 3.25Å; E88-D91 PolarHBondContact N-O 3.2Å; E88-D91 VanDerWaalsContact N-O 3.08Å; E88-D91 PolarHBondContact O-N 3.34Å; E88-D91 VanDerWaalsContact O-N 3.09Å; D91-T93 PolarHBondContact O-N 3.18Å
92	L	39.8	Very low	43.1	Very low	112 Å²	112	80.7 Å²	80.7	59%	0.586	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	108.7	174	-79	160.9	0	0	0	109.6	E85	E85-L92 HydrophobicContact CB-CD2 3.59Å; E85-L92 HydrophobicContact CG-CD2 3.7Å
93	T	42.9	Very low	43	Very low	27 Å²	27	81.3 Å²	81.3	17%	0.166	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-32.2	-179.4	51.9	0	0	0	0	112.6	V86 E88 D91 V109	V86-T93 PolarHBondContact O-N 2.9Å; V86-T93 PolarHBondContact O-OG1 3.38Å; E88-T93 HydrophobicContact CB-CG2 3.61Å; E88-T93 PolarHBondContact N-OG1 3.44Å; D91-T93 PolarHBondContact O-N 3.18Å; T93-V109 PolarHBondContact O-N 3.07Å; T93-V109 VanDerWaalsContact O-N 3.07Å
94	A	42.6	Very low	42.6	Very low	3 Å²	3	77.7 Å²	77.7	3%	0.025	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	152	-178.6	0	0	0	0	0	112.7	V86 L107	V86-A94 HydrophobicContact CB-CB 4.25Å; V86-A94 PolarHBondContact N-O 3.18Å; V86-A94 PolarHBondContact O-N 3.04Å; V86-A94 VanDerWaalsContact O-N 3.08Å; A94-L107 WeakPolarHBondContact CA-O 3.42Å; A94-L107 WeakPolarHBondContact CB-O 3.32Å
95	V	43.7	Very low	42.4	Very low	49 Å²	49	73.2 Å²	73.2	30%	0.297	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	110.8	165.4	-179.7	0	0	0	0	107	L83 L107	L83-V95 HydrophobicContact CB-CG1 4.24Å; L83-V95 HydrophobicContact CD2-CG1 3.82Å; L83-V95 HydrophobicContact CG-CG1 4.5Å; V95-L107 PolarHBondContact N-O 3.37Å; V95-L107 WeakPolarHBondContact O-CB 3.34Å; V95-L107 PolarHBondContact O-N 3.09Å; V95-L107 VanDerWaalsContact O-N 3.14Å
96	V	43	Very low	41.9	Very low	15 Å²	15	67.1 Å²	67.1	9%	0.091	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	118.5	-179.5	-175.2	0	0	0	0	108.7	K84 V86 T98 T106	K84-V96 PolarHBondContact N-O 2.95Å; K84-V96 PolarHBondContact O-N 2.85Å; V86-V96 HydrophobicContact CB-CG2 4.35Å; V86-V96 HydrophobicContact CG2-CB 4.42Å; V86-V96 HydrophobicContact CG2-CG2 3.45Å; V86-V96 VanDerWaalsContact CG2-CG2 3.45Å; V96-T98 HydrophobicContact CB-CG2 4.49Å; V96-T98 HydrophobicContact CG1-CG2 3.7Å; V96-T98 PolarHBondContact O-N 3.06Å; V96-T106 HydrophobicContact CB-CG2 4.34Å; V96-T106 HydrophobicContact CG1-CG2 3.75Å; V96-T106 HydrophobicContact CG2-CG2 3.7Å
97	L	45.9	Very low	41.5	Very low	40 Å²	40	66.3 Å²	66.3	21%	0.209	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	92.3	169.4	-178	66.6	0	0	0	107.8	M81 L83 T99 T105	M81-L97 HydrophobicContact CB-CD1 4.28Å; M81-L97 HydrophobicContact CE-CD1 3.57Å; M81-L97 HydrophobicContact CE-CD2 3.52Å; M81-L97 HydrophobicContact CE-CG 3.86Å; L83-L97 HydrophobicContact CD2-CB 4.33Å; L83-L97 HydrophobicContact CD2-CD1 3.61Å; L83-L97 HydrophobicContact CG-CD1 4.45Å; L97-T99 HydrophobicContact CG-CG2 4.46Å; L97-T105 PolarHBondContact N-O 3.08Å; L97-T105 PolarHBondContact O-N 2.91Å; L97-T105 VanDerWaalsContact O-N 3.1Å
98	T	40.9	Very low	40.8	Very low	24 Å²	24	66.5 Å²	66.5	15%	0.147	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.3	172.8	59	0	0	0	0	108.8	M81 T82 K84 V96 D104	M81-T98 WeakPolarHBondContact CA-O 3.3Å; T82-T98 PolarHBondContact N-O 2.73Å; T82-T98 PolarHBondContact O-N 3.08Å; T82-T98 PolarHBondContact O-OG1 3.24Å; K84-T98 HydrophobicContact CD-CG2 4.48Å; V96-T98 HydrophobicContact CB-CG2 4.49Å; V96-T98 HydrophobicContact CG1-CG2 3.7Å; V96-T98 PolarHBondContact O-N 3.06Å; T98-D104 WeakPolarHBondContact CA-OD1 3.49Å; T98-D104 WeakPolarHBondContact CB-OD1 3.41Å
99	T	38.8	Very low	40.2	Very low	22 Å²	22	63.8 Å²	63.8	14%	0.135	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	151.8	169.8	73.5	0	0	0	0	106.7	M81 L97 T101 I103	M81-T99 HydrophobicContact CE-CG2 4.41Å; M81-T99 HydrophobicContact CG-CG2 4.05Å; L97-T99 HydrophobicContact CG-CG2 4.46Å; T99-T101 PolarHBondContact O-N 2.89Å; T99-T101 PolarHBondContact OG1-N 2.81Å; T99-T101 PolarHBondContact OG1-OG1 3.05Å; T99-I103 PolarHBondContact OG1-O 2.99Å
100	K	35.8	Very low	39.1	Very low	158 Å²	158	60 Å²	60	69%	0.687	35%	0.346	S	S	*	.	S	Bend	trans	-63.8	-2.7	172.5	-91.5	-167.3	-154.7	148.5	0	114.4	D80	D80-K100 HydrophobicContact CB-CB 3.87Å; D80-K100 HydrophobicContact CB-CD 3.94Å; D80-K100 HydrophobicContact CB-CG 3.79Å; D80-K100 VanDerWaalsContact CG-CE 3.43Å; D80-K100 PolarHBondContact O-N 2.99Å; D80-K100 WeakPolarHBondContact OD1-CE 3.47Å; D80-K100 IonicContact OD1-NZ 2.89Å; D80-K100 PolarHBondContact OD1-NZ 2.85Å; D80-K100 VanDerWaalsContact OD2-CD 3.23Å; D80-K100 WeakPolarHBondContact OD2-CD 3.31Å; D80-K100 WeakPolarHBondContact OD2-CE 3.45Å; D80-K100 IonicContact OD2-NZ 2.77Å; D80-K100 PolarHBondContact OD2-NZ 3.5Å
101	T	36.1	Very low	38.3	Very low	51 Å²	51	62.4 Å²	62.4	31%	0.313	35%	0.346	S	S	.	.	S	Bend	trans	-77.9	152.5	167.2	48.8	0	0	0	0	112.1	V76 T99 I103	V76-T101 HydrophobicContact CB-CG2 3.72Å; V76-T101 HydrophobicContact CG1-CG2 3.58Å; V76-T101 HydrophobicContact CG2-CG2 3.08Å; V76-T101 WeakPolarHBondContact CG2-OG1 3.33Å; T99-T101 PolarHBondContact O-N 2.89Å; T99-T101 PolarHBondContact OG1-N 2.81Å; T99-T101 PolarHBondContact OG1-OG1 3.05Å; T101-I103 PolarHBondContact O-N 3.09Å
102	S	36.5	Very low	37.7	Very low	108 Å²	108	62.1 Å²	62.1	76%	0.755	35%	0.351	S	S	*	.	S	Bend	trans	-59.3	7.6	-177.3	65.3	0	0	0	0	115.3
103	I	40.1	Very low	37.1	Very low	93 Å²	93	58.9 Å²	58.9	48%	0.477	34%	0.341	S	S	.	.			trans	-122.4	91.7	179.1	-49.9	176.2	0	0	0	106.4	T99 T101	T99-I103 PolarHBondContact OG1-O 2.99Å; T101-I103 PolarHBondContact O-N 3.09Å
104	D	36.8	Very low	36.4	Very low	42 Å²	42	61.4 Å²	61.4	23%	0.225	35%	0.353	C	S	.	.			trans	-68.3	130.4	163.5	-74.1	-40.2	0	0	0	107.9	T98 A119	T98-D104 WeakPolarHBondContact CA-OD1 3.49Å; T98-D104 WeakPolarHBondContact CB-OD1 3.41Å; D104-A119 HydrophobicContact CB-CB 4.23Å; D104-A119 WeakPolarHBondContact O-CB 3.41Å; D104-A119 PolarHBondContact O-N 3.07Å
105	T	40.6	Very low	35.6	Very low	34 Å²	34	64.6 Å²	64.6	21%	0.209	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	106.7	176.1	-53	0	0	0	0	108.7	L97 I116	L97-T105 PolarHBondContact N-O 3.08Å; L97-T105 PolarHBondContact O-N 2.91Å; L97-T105 VanDerWaalsContact O-N 3.1Å; T105-I116 HydrophobicContact CG2-CG2 3.4Å
106	T	34.6	Very low	35.1	Very low	22 Å²	22	66.6 Å²	66.6	14%	0.135	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	118.1	174.7	42.6	0	0	0	0	109.6	V96 S117 A119	V96-T106 HydrophobicContact CB-CG2 4.34Å; V96-T106 HydrophobicContact CG1-CG2 3.75Å; V96-T106 HydrophobicContact CG2-CG2 3.7Å; T106-S117 PolarHBondContact O-N 3.08Å; T106-S117 PolarHBondContact OG1-O 2.87Å; T106-S117 VanDerWaalsContact OG1-O 3.07Å; T106-A119 HydrophobicContact CG2-CB 3.7Å
107	L	37.1	Very low	34.5	Very low	45 Å²	45	68.4 Å²	68.4	24%	0.236	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	102	168.1	-52.6	169.3	0	0	0	107.9	A94 V95 I116	A94-L107 WeakPolarHBondContact CA-O 3.42Å; A94-L107 WeakPolarHBondContact CB-O 3.32Å; V95-L107 PolarHBondContact N-O 3.37Å; V95-L107 WeakPolarHBondContact O-CB 3.34Å; V95-L107 PolarHBondContact O-N 3.09Å; V95-L107 VanDerWaalsContact O-N 3.14Å; L107-I116 HydrophobicContact CD2-CB 4.5Å; L107-I116 HydrophobicContact CD2-CD1 4.43Å; L107-I116 HydrophobicContact CD2-CG1 3.74Å
108	H	29.1	Very low	33.7	Very low	62 Å²	62	73.1 Å²	73.1	29%	0.287	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	127.3	173.1	-85.2	-95.7	0	0	0	109.3	D110 T115	H108-D110 VanDerWaalsContact C-N 3.27Å; H108-D110 IonicContact CG-OD2 3.61Å; H108-D110 IonicContact ND1-OD2 3.91Å; H108-D110 PolarHBondContact ND1-OD2 2.93Å; H108-D110 VanDerWaalsContact ND1-OD2 3.14Å; H108-T115 PolarHBondContact N-O 3.19Å; H108-T115 VanDerWaalsContact N-O 3.09Å; H108-T115 PolarHBondContact O-N 2.74Å
109	V	34.4	Very low	33.1	Very low	73 Å²	73	73 Å²	73	44%	0.442	42%	0.421	S	S	.	.			trans	-100.9	44.1	173	-162.1	0	0	0	0	108.6	T93 V111 L114	T93-V109 PolarHBondContact O-N 3.07Å; T93-V109 VanDerWaalsContact O-N 3.07Å; V109-V111 PolarHBondContact O-N 2.63Å; V109-L114 HydrophobicContact CG2-CD2 4.06Å
110	D	32	Very low	32.4	Very low	88 Å²	88	80.3 Å²	80.3	47%	0.471	45%	0.453	S	S	.	.	S	Bend	trans	-86.1	106	172.8	-70.2	-45.3	0	0	0	107.6	H108	H108-D110 VanDerWaalsContact C-N 3.27Å; H108-D110 IonicContact CG-OD2 3.61Å; H108-D110 IonicContact ND1-OD2 3.91Å; H108-D110 PolarHBondContact ND1-OD2 2.93Å; H108-D110 VanDerWaalsContact ND1-OD2 3.14Å
111	V	28.9	Very low	31.9	Very low	116 Å²	116	76.8 Å²	76.8	70%	0.703	45%	0.446	S	S	*	.	S	Bend	trans	76.4	152.6	-178.7	-167.3	0	0	0	0	110.5	V109 A113	V109-V111 PolarHBondContact O-N 2.63Å; V111-A113 CarbonylContact O-C 3.55Å; V111-A113 PolarHBondContact O-N 2.91Å
112	P	32.9	Very low	31.6	Very low	120 Å²	120	81 Å²	81	78%	0.779	47%	0.466	S	S	*	.	S	Bend	trans	-60.8	16.9	-174	20.6	-35.6	0	0	0	117	Q207	P112-Q207 PolarHBondContact O-NE2 3.14Å
113	A	25.8	Very low	31.1	Very low	44 Å²	44	82.5 Å²	82.5	36%	0.364	47%	0.465	S	S	.	.	S	Bend	trans	-106.6	114.5	165.1	0	0	0	0	0	110.3	V111 T115	V111-A113 CarbonylContact O-C 3.55Å; V111-A113 PolarHBondContact O-N 2.91Å; A113-T115 PolarHBondContact O-N 2.92Å
114	L	28.1	Very low	30.4	Very low	81 Å²	81	83.6 Å²	83.6	42%	0.424	48%	0.481	S	S	.	.			trans	-62	117	167.1	-69.8	164.9	0	0	0	108.8	V109	V109-L114 HydrophobicContact CG2-CD2 4.06Å
115	T	25.9	Very low	29.9	Very low	70 Å²	70	86.8 Å²	86.8	43%	0.429	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	121.9	171.6	42	0	0	0	0	109.4	H108 A113 S117	H108-T115 PolarHBondContact N-O 3.19Å; H108-T115 VanDerWaalsContact N-O 3.09Å; H108-T115 PolarHBondContact O-N 2.74Å; A113-T115 PolarHBondContact O-N 2.92Å; T115-S117 PolarHBondContact O-N 3.24Å
116	I	33.7	Very low	29.1	Very low	90 Å²	90	92.3 Å²	92.3	46%	0.462	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	108.4	171	-53.2	-179.3	0	0	0	106	T105 L107 F203	T105-I116 HydrophobicContact CG2-CG2 3.4Å; L107-I116 HydrophobicContact CD2-CB 4.5Å; L107-I116 HydrophobicContact CD2-CD1 4.43Å; L107-I116 HydrophobicContact CD2-CG1 3.74Å; I116-F203 HydrophobicContact CD1-CE1 4.24Å; I116-F203 HydrophobicContact CD1-CE2 4.32Å; I116-F203 HydrophobicContact CD1-CZ 3.93Å
117	S	29.4	Very low	28.7	Very low	53 Å²	53	99.8 Å²	99.8	37%	0.371	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.3	132.7	168.7	-62.5	0	0	0	0	108	T106 T115 A119	T106-S117 PolarHBondContact O-N 3.08Å; T106-S117 PolarHBondContact OG1-O 2.87Å; T106-S117 VanDerWaalsContact OG1-O 3.07Å; T115-S117 PolarHBondContact O-N 3.24Å; S117-A119 PolarHBondContact O-N 2.88Å
118	D	29.2	Very low	28.1	Very low	139 Å²	139	104.9 Å²	104.9	74%	0.743	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-57.8	107.3	162.2	-72.8	-28.4	0	0	0	106.1	Q120	D118-Q120 PolarHBondContact O-N 3.12Å; D118-Q120 VanDerWaalsContact O-N 3.16Å
119	A	28.7	Very low	27.9	Very low	23 Å²	23	106.6 Å²	106.6	19%	0.19	62%	0.615	C	S	.	*			trans	-65.7	122.6	172.4	0	0	0	0	0	105.9	D104 T106 S117	D104-A119 HydrophobicContact CB-CB 4.23Å; D104-A119 WeakPolarHBondContact O-CB 3.41Å; D104-A119 PolarHBondContact O-N 3.07Å; T106-A119 HydrophobicContact CG2-CB 3.7Å; S117-A119 PolarHBondContact O-N 2.88Å
120	Q	24.7	Very low	27.5	Very low	174 Å²	174	111.8 Å²	111.8	81%	0.813	63%	0.634	S	S	*	*			trans	-55.7	136.1	166.1	-79.5	-163.6	-24.8	0	0	107.3	D118 I122	D118-Q120 PolarHBondContact O-N 3.12Å; D118-Q120 VanDerWaalsContact O-N 3.16Å; Q120-I122 PolarHBondContact O-N 3.09Å
121	P	26.1	Very low	27.2	Very low	84 Å²	84	115.3 Å²	115.3	55%	0.545	65%	0.648	S	S	.	*			trans	-55.7	109.2	179.1	22.4	-31.9	0	0	0	107.4	N123	P121-N123 PolarHBondContact O-N 3.38Å
122	I	28.8	Very low	27	Very low	141 Å²	141	120.2 Å²	120.2	72%	0.723	65%	0.654	S	S	*	*			trans	-66.3	96.4	163.9	30.6	169.7	0	0	0	104.3	Q120 S124	Q120-I122 PolarHBondContact O-N 3.09Å; I122-S124 PolarHBondContact O-N 3.29Å
123	N	25.2	Very low	26.7	Very low	138 Å²	138	121.6 Å²	121.6	74%	0.738	66%	0.655	S	S	*	*			trans	-53.3	95.4	170.2	-62.5	-32.6	0	0	0	106.6	P121 T125	P121-N123 PolarHBondContact O-N 3.38Å; N123-T125 PolarHBondContact O-N 2.82Å
124	S	26.3	Very low	26.8	Very low	116 Å²	116	128.7 Å²	128.7	81%	0.811	68%	0.678	S	S	*	*			trans	-76.6	86.5	173.6	-158.4	0	0	0	0	106.6	I122	I122-S124 PolarHBondContact O-N 3.29Å
125	T	25.7	Very low	26.6	Very low	110 Å²	110	128.8 Å²	128.8	68%	0.675	70%	0.699	S	S	*	*			trans	-44.5	135.8	154.2	3.2	0	0	0	0	109.5	N123	N123-T125 PolarHBondContact O-N 2.82Å
126	H	24.8	Very low	26.7	Very low	149 Å²	149	129.2 Å²	129.2	69%	0.69	72%	0.717	S	S	*	*			trans	76.5	83.9	166.2	-65.4	-80.7	0	0	0	118.1
127	L	25.8	Very low	26.4	Very low	179 Å²	179	132.3 Å²	132.3	94%	0.937	73%	0.734	S	S	*	*				-123.4	110.5	122.6	-78.9	178.4	0	0	0	109.3	A129	L127-A129 PolarHBondContact O-N 3.06Å
128	L	24.3	Very low	26.4	Very low	153 Å²	153	135.4 Å²	135.4	80%	0.801	75%	0.75	S	S	*	*			trans	-50.4	115.4	171.8	-72.7	146.9	0	0	0	110.5
129	A	26.2	Very low	26.5	Very low	97 Å²	97	136.9 Å²	136.9	80%	0.802	76%	0.757	S	S	*	*			trans	-115.9	109.6	143.9	0	0	0	0	0	105.7	L127 E131	L127-A129 PolarHBondContact O-N 3.06Å; A129-E131 PolarHBondContact O-N 3.47Å
130	E	25.3	Very low	26.4	Very low	182 Å²	182	141.5 Å²	141.5	85%	0.85	78%	0.783	S	S	*	*			trans	-45.8	129.9	170.6	-62.9	170.8	116.5	0	0	110.7
131	E	25.8	Very low	26.8	Very low	162 Å²	162	139 Å²	139	76%	0.757	78%	0.784	S	S	*	*				-157.7	99.9	128.5	-113.7	-172	149	0	0	110.6	A129	A129-E131 PolarHBondContact O-N 3.47Å
132	R	23.5	Very low	26.8	Very low	220 Å²	220	141 Å²	141	83%	0.83	80%	0.795	S	S	*	*			trans	58.3	96.7	141.7	-59.8	179.8	-176.4	-176.4	3.9	116.5
133	D	26.7	Very low	26.7	Very low	148 Å²	148	142.3 Å²	142.3	79%	0.791	80%	0.803	S	S	*	*			trans	-119.2	130.8	143.2	-153.2	29.4	0	0	0	110.3
134	F	29.6	Very low	26.9	Very low	193 Å²	193	140 Å²	140	85%	0.846	80%	0.795	S	S	*	*			trans	16.3	135.2	166.4	-81.3	-112.9	0	0	0	121.7
135	G	22.9	Very low	27.2	Very low	84 Å²	84	140.7 Å²	140.7	87%	0.866	80%	0.797	S	S	*	*			trans	-59.3	141.4	169.1	0	0	0	0	0	113.4
136	G	27.8	Very low	27.4	Very low	78 Å²	78	140.8 Å²	140.8	80%	0.804	80%	0.797	S	S	*	*			trans	166.2	99.9	172.8	0	0	0	0	0	111.2
137	D	27.9	Very low	27.5	Very low	155 Å²	155	141.8 Å²	141.8	83%	0.829	80%	0.802	S	S	*	*			trans	0.1	123.8	168.9	-79.6	-37.7	0	0	0	121.7
138	V	29.8	Very low	27.8	Very low	118 Å²	118	142.5 Å²	142.5	72%	0.715	80%	0.8	S	S	*	*				29	110.1	127.8	-175.5	0	0	0	0	117.5
139	I	30.2	Very low	28.3	Very low	170 Å²	170	140.6 Å²	140.6	87%	0.872	80%	0.8	S	S	*	*				-146.1	124.6	115.6	-31.6	172.4	0	0	0	110
140	T	27.2	Very low	28.6	Very low	120 Å²	120	142 Å²	142	74%	0.736	80%	0.799	S	S	*	*			trans	-70.6	126.8	166.8	27.9	0	0	0	0	111.3
141	S	33.3	Very low	28.7	Very low	122 Å²	122	139.1 Å²	139.1	85%	0.853	80%	0.795	S	S	*	*			trans	-135.7	88	151.2	61.1	0	0	0	0	109
142	V	26.5	Very low	28.9	Very low	126 Å²	126	139.5 Å²	139.5	76%	0.764	80%	0.802	S	S	*	*			trans	-79.1	119.1	165.7	172.6	0	0	0	0	107.4
143	L	26.7	Very low	29.2	Very low	169 Å²	169	136.2 Å²	136.2	89%	0.885	80%	0.8	S	S	*	*			trans	-139.3	146.6	155.6	-86.4	173	0	0	0	109.3
144	P	28.3	Very low	29.6	Very low	89 Å²	89	136.4 Å²	136.4	58%	0.578	80%	0.799	S	S	*	*			trans	-104.3	167.1	-131.2	38.1	-34.1	0	0	0	113.9	V146	P144-V146 PolarHBondContact O-N 3.2Å
145	P	33.8	Very low	29.6	Very low	131 Å²	131	135.7 Å²	135.7	85%	0.851	80%	0.799	S	S	*	*			trans	-71.6	126	174.8	29.9	-33.2	0	0	0	110.2
146	V	29.4	Very low	30.1	Very low	111 Å²	111	140.4 Å²	140.4	67%	0.673	80%	0.796	S	S	*	*			trans	-119.2	104.3	176.8	178.3	0	0	0	0	109.3	P144	P144-V146 PolarHBondContact O-N 3.2Å
147	Q	27.3	Very low	30.5	Very low	170 Å²	170	141.8 Å²	141.8	79%	0.794	79%	0.79	S	S	*	*			trans	80.6	87	146.3	-64.4	175.9	-4.2	0	0	117.9	S149	Q147-S149 PolarHBondContact O-N 2.81Å
148	E	30.6	Very low	30.8	Very low	195 Å²	195	142.4 Å²	142.4	91%	0.911	79%	0.793	S	S	*	*			trans	-46.5	114.3	135.5	-73.2	179.3	147.1	0	0	109.4	T150	E148-T150 PolarHBondContact O-N 2.91Å; E148-T150 VanDerWaalsContact O-N 3.09Å
149	S	36.1	Very low	31.4	Very low	113 Å²	113	145 Å²	145	79%	0.79	80%	0.798	S	S	*	*			trans	-64	109	167.2	-53.8	0	0	0	0	108.6	Q147	Q147-S149 PolarHBondContact O-N 2.81Å
150	T	31.3	Very low	31.7	Very low	126 Å²	126	144.2 Å²	144.2	77%	0.773	80%	0.795	S	S	*	*			trans	-15	124.9	166.4	-19.3	0	0	0	0	114.9	E148 L152	E148-T150 PolarHBondContact O-N 2.91Å; E148-T150 VanDerWaalsContact O-N 3.09Å; T150-L152 PolarHBondContact O-N 3.09Å
151	P	28.5	Very low	32.1	Very low	121 Å²	121	144.2 Å²	144.2	79%	0.786	80%	0.795	S	S	*	*			trans	-62	124.1	168.9	25.3	-31.2	0	0	0	108.8	L153	P151-L153 PolarHBondContact O-N 3.18Å; P151-L153 VanDerWaalsContact O-N 3.13Å
152	L	29.7	Very low	31.9	Very low	171 Å²	171	144.3 Å²	144.3	90%	0.895	79%	0.79	S	S	*	*			trans	-51.6	122.1	170	-107.2	156.6	0	0	0	108.3	T150 I154	T150-L152 PolarHBondContact O-N 3.09Å; L152-I154 PolarHBondContact O-N 3.45Å; L152-I154 VanDerWaalsContact O-N 3.13Å
153	L	29.3	Very low	32.2	Very low	151 Å²	151	143.5 Å²	143.5	79%	0.791	79%	0.789	S	S	*	*			trans	-40.5	113.1	-179.8	-155.2	117.8	0	0	0	110.1	P151 E155	P151-L153 PolarHBondContact O-N 3.18Å; P151-L153 VanDerWaalsContact O-N 3.13Å; L153-E155 VanDerWaalsContact C-N 3.26Å; L153-E155 PolarHBondContact O-N 2.88Å
154	I	34.7	Very low	32.4	Very low	151 Å²	151	139.9 Å²	139.9	77%	0.774	78%	0.778	S	S	*	*			trans	-63.6	97.5	162.9	-65.9	165.7	0	0	0	105.3	L152 K156	L152-I154 PolarHBondContact O-N 3.45Å; L152-I154 VanDerWaalsContact O-N 3.13Å; I154-K156 PolarHBondContact O-N 2.88Å; I154-K156 VanDerWaalsContact O-N 3.13Å
155	E	30.6	Very low	32.5	Very low	178 Å²	178	142 Å²	142	83%	0.832	79%	0.789	S	S	*	*			trans	-63.2	112.5	163.4	-146.5	170.5	-161.4	0	0	106.1	L153	L153-E155 VanDerWaalsContact C-N 3.26Å; L153-E155 PolarHBondContact O-N 2.88Å
156	K	33.6	Very low	32.4	Very low	184 Å²	184	143.7 Å²	143.7	80%	0.8	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67.5	151.8	175.4	-90.7	-168.4	176.4	179.6	0	109.6	I154	I154-K156 PolarHBondContact O-N 2.88Å; I154-K156 VanDerWaalsContact O-N 3.13Å
157	P	35.8	Very low	32.4	Very low	107 Å²	107	142.9 Å²	142.9	70%	0.695	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80.8	140.4	-147.4	31.7	-34.4	0	0	0	112.1	E159	P157-E159 PolarHBondContact O-N 2.9Å
158	D	33.6	Very low	32.9	Very low	167 Å²	167	144.6 Å²	144.6	89%	0.893	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-62.8	119.3	155.7	-89.1	-30.8	0	0	0	108.2
159	E	42	Very low	32.9	Very low	173 Å²	173	143.8 Å²	143.8	81%	0.808	79%	0.79	S	S	*	*	S	Bend	trans	-54.2	147.3	168.9	-60	172.9	161.6	0	0	108.6	P157	P157-E159 PolarHBondContact O-N 2.9Å
160	D	36.6	Very low	32.6	Very low	153 Å²	153	147.5 Å²	147.5	82%	0.818	80%	0.795	S	S	*	*			trans	89.7	36.5	171.9	-50.6	-30.6	0	0	0	120.1
161	V	35.7	Very low	32.6	Very low	121 Å²	121	150.1 Å²	150.1	73%	0.733	80%	0.804	S	S	*	*			trans	-116.7	83.3	143.1	-168.9	0	0	0	0	109.3	C163	V161-C163 PolarHBondContact O-N 3.36Å
162	T	30.6	Very low	32.5	Very low	123 Å²	123	147.2 Å²	147.2	76%	0.755	80%	0.796	S	S	*	*			trans	-51.1	92	150	36.4	0	0	0	0	108.2	S164	T162-S164 PolarHBondContact O-N 3.25Å
163	C	32.5	Very low	32.6	Very low	109 Å²	109	148 Å²	148	74%	0.736	80%	0.795	S	S	*	*			trans	-67	79.4	154.1	-75.5	0	0	0	0	105.8	V161 V165	V161-C163 PolarHBondContact O-N 3.36Å; C163-V165 PolarHBondContact O-N 3.16Å
164	S	30.2	Very low	32.8	Very low	94 Å²	94	145.8 Å²	145.8	66%	0.657	80%	0.799	S	S	*	*			trans	-47.9	110.4	163.9	-62.2	0	0	0	0	106.4	T162 L166	T162-S164 PolarHBondContact O-N 3.25Å; S164-L166 VanDerWaalsContact C-N 3.28Å; S164-L166 PolarHBondContact O-N 2.76Å
165	V	31.3	Very low	32.5	Very low	133 Å²	133	144.6 Å²	144.6	81%	0.806	80%	0.798	S	S	*	*			trans	-50.5	103.3	163.1	174.2	0	0	0	0	104.7	C163 S167	C163-V165 PolarHBondContact O-N 3.16Å; V165-S167 PolarHBondContact O-N 3.01Å
166	L	30.9	Very low	32.8	Very low	166 Å²	166	140.8 Å²	140.8	87%	0.869	80%	0.797	S	S	*	*			trans	-61.2	94.5	172.3	-84.9	162.4	0	0	0	106	S164 K168	S164-L166 VanDerWaalsContact C-N 3.28Å; S164-L166 PolarHBondContact O-N 2.76Å; L166-K168 PolarHBondContact O-N 3.01Å
167	S	29.5	Very low	32.8	Very low	95 Å²	95	141.2 Å²	141.2	66%	0.664	80%	0.799	S	S	*	*			trans	-53.4	133.9	169.4	34	0	0	0	0	108.4	V165 E169	V165-S167 PolarHBondContact O-N 3.01Å; S167-E169 VanDerWaalsContact C-N 3.26Å; S167-E169 PolarHBondContact O-N 2.84Å
168	K	37.5	Very low	32.3	Very low	205 Å²	205	139.4 Å²	139.4	89%	0.891	80%	0.799	S	S	*	*	S	Bend	trans	-63.7	81.2	177.9	-72.4	175.6	174	175.6	0	110.5	L166	L166-K168 PolarHBondContact O-N 3.01Å
169	E	30.7	Very low	32.4	Very low	178 Å²	178	139.3 Å²	139.3	83%	0.832	80%	0.799	S	S	*	*			trans	-165	137.4	162.1	-105.2	150.9	166.8	0	0	107.2	S167	S167-E169 VanDerWaalsContact C-N 3.26Å; S167-E169 PolarHBondContact O-N 2.84Å
170	E	29.6	Very low	31.8	Very low	191 Å²	191	141.6 Å²	141.6	89%	0.893	80%	0.8	S	S	*	*			trans	74.9	68.4	-176.7	-71.6	-175.1	100.5	0	0	118.1
171	L	32.1	Very low	31.8	Very low	182 Å²	182	138.7 Å²	138.7	95%	0.953	80%	0.797	S	S	*	*				-130	68.2	122.4	-128.5	140.8	0	0	0	109
172	G	26.2	Very low	31.8	Very low	60 Å²	60	140.9 Å²	140.9	62%	0.619	80%	0.797	S	S	*	*			trans	-77.9	145.7	162	0	0	0	0	0	110.2
173	Q	31.5	Very low	31.9	Very low	186 Å²	186	143.9 Å²	143.9	87%	0.869	80%	0.802	S	S	*	*			trans	84.1	83.8	163.4	-53.5	-175.1	44.4	0	0	117.8
174	A	34.4	Very low	31.9	Very low	106 Å²	106	144.6 Å²	144.6	88%	0.876	80%	0.804	S	S	*	*			trans	-130.8	85.4	131.5	0	0	0	0	0	108.8	A176	A174-A176 PolarHBondContact O-N 3.18Å
175	V	28.5	Very low	32	Very low	126 Å²	126	146 Å²	146	76%	0.764	81%	0.811	S	S	*	*			trans	-66.2	102.6	169.9	172.8	0	0	0	0	108.6
176	A	36.9	Very low	32	Very low	98 Å²	98	143.7 Å²	143.7	81%	0.81	81%	0.805	S	S	*	*			trans	-108.1	93.7	157.6	0	0	0	0	0	108.5	A174	A174-A176 PolarHBondContact O-N 3.18Å
177	K	33.6	Very low	32.1	Very low	193 Å²	193	142.5 Å²	142.5	84%	0.839	81%	0.805	S	S	*	*			trans	-6.1	126	162	-65.6	173.5	177.6	176.6	0	116.3
178	G	24.1	Very low	32.2	Very low	68 Å²	68	141.6 Å²	141.6	70%	0.701	81%	0.811	S	S	*	*			trans	-69.4	159.1	179.7	0	0	0	0	0	115.6
179	N	36.9	Very low	32	Very low	165 Å²	165	136.9 Å²	136.9	88%	0.882	80%	0.803	S	S	*	*			trans	-112.2	98	148.8	-70.8	-25.6	0	0	0	107.2	A181	N179-A181 PolarHBondContact O-N 3.2Å
180	R	29.6	Very low	32.4	Very low	221 Å²	221	132.6 Å²	132.6	83%	0.834	80%	0.799	S	S	*	*			trans	-68.5	83.7	165.6	-176.8	-177.3	-171.6	173.3	4.1	107.8	K182	R180-K182 PolarHBondContact O-N 3.16Å
181	A	36.1	Very low	33.2	Very low	92 Å²	92	127.2 Å²	127.2	76%	0.76	79%	0.786	S	S	*	*			trans	-75.2	103.8	160.7	0	0	0	0	0	107.3	N179 E183	N179-A181 PolarHBondContact O-N 3.2Å; A181-E183 PolarHBondContact O-N 3.13Å; A181-E183 VanDerWaalsContact O-N 3.14Å
182	K	35.1	Very low	33.8	Very low	167 Å²	167	127.6 Å²	127.6	73%	0.726	78%	0.78	S	S	*	*			trans	-66.3	101.2	161.9	-75.4	-165.9	175.5	-173.4	0	107.5	R180	R180-K182 PolarHBondContact O-N 3.16Å
183	E	33.1	Very low	34.9	Very low	186 Å²	186	128.5 Å²	128.5	87%	0.869	78%	0.782	S	S	*	*			trans	-113.9	112.1	148.9	-79.9	-166.3	156.1	0	0	108.1	A181	A181-E183 PolarHBondContact O-N 3.13Å; A181-E183 VanDerWaalsContact O-N 3.14Å
184	T	31.4	Very low	36.1	Very low	124 Å²	124	122.7 Å²	122.7	76%	0.761	76%	0.76	S	S	*	*			trans	-57.6	153.1	170.6	37.8	0	0	0	0	111.6	A186	T184-A186 PolarHBondContact O-N 2.74Å
185	P	32.5	Very low	37.4	Very low	124 Å²	124	125.5 Å²	125.5	81%	0.805	75%	0.753	S	S	*	*			trans	-73.1	102.5	-169.4	30.8	-32.5	0	0	0	110.1	V187	P185-V187 VanDerWaalsContact C-N 3.27Å; P185-V187 PolarHBondContact O-N 2.82Å
186	A	32.5	Very low	39	Very low	84 Å²	84	128.7 Å²	128.7	69%	0.694	76%	0.756	S	S	*	*			trans	-72	91.4	163.6	0	0	0	0	0	108.3	T184 G188	T184-A186 PolarHBondContact O-N 2.74Å; A186-G188 PolarHBondContact O-N 2.86Å
187	V	32.9	Very low	40.5	Very low	142 Å²	142	125.2 Å²	125.2	86%	0.861	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	7.9	109.5	141.9	179.1	0	0	0	0	113.4	P185 S189	P185-V187 VanDerWaalsContact C-N 3.27Å; P185-V187 PolarHBondContact O-N 2.82Å; V187-S189 PolarHBondContact O-N 3.4Å
188	G	31.1	Very low	42.2	Very low	76 Å²	76	118.9 Å²	118.9	78%	0.784	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.7	45.6	152	0	0	0	0	0	116.5	A186 A190	A186-G188 PolarHBondContact O-N 2.86Å; G188-A190 PolarHBondContact O-N 3.08Å
189	S	33.5	Very low	44.2	Very low	105 Å²	105	117.4 Å²	117.4	73%	0.734	68%	0.682	S	S	*	*			trans	-75.5	102.5	153	21.7	0	0	0	0	106.2	V187 A191	V187-S189 PolarHBondContact O-N 3.4Å; S189-A191 PolarHBondContact O-N 3.26Å
190	A	39.7	Very low	45.9	Very low	89 Å²	89	117.3 Å²	117.3	74%	0.736	68%	0.676	S	S	*	*			trans	-37.3	117.8	174.8	0	0	0	0	0	108.8	G188 K192	G188-A190 PolarHBondContact O-N 3.08Å; A190-K192 PolarHBondContact O-N 3.2Å
191	A	44.8	Very low	48	Very low	77 Å²	77	109.7 Å²	109.7	64%	0.636	66%	0.657	S	S	*	*			trans	-44	112	173.4	0	0	0	0	0	105.9	S189 A193	S189-A191 PolarHBondContact O-N 3.26Å; A191-A193 VanDerWaalsContact C-N 3.31Å; A191-A193 PolarHBondContact O-N 2.64Å
192	K	44.9	Very low	49.9	Very low	191 Å²	191	105.9 Å²	105.9	83%	0.83	62%	0.623	S	S	*	*			trans	-56.2	108	-179	-86.8	-180	177.4	171.8	0	104.4	A190	A190-K192 PolarHBondContact O-N 3.2Å
193	A	49.8	Very low	51.7	Low	78 Å²	78	103.2 Å²	103.2	65%	0.645	61%	0.612	S	S	*	*			trans	-51.4	140.8	179.4	0	0	0	0	0	107.3	A191 K195	A191-A193 VanDerWaalsContact C-N 3.31Å; A191-A193 PolarHBondContact O-N 2.64Å; A193-K195 PolarHBondContact O-N 3.14Å; A193-K195 VanDerWaalsContact O-N 3.12Å
194	P	56.2	Low	54.1	Low	64 Å²	64	101.5 Å²	101.5	42%	0.416	60%	0.602	S	S	.	*			trans	-46.8	128.4	174.9	16.3	-28.4	0	0	0	108.2	V42 K196	V42-P194 HydrophobicContact CG2-CB 4.06Å; V42-P194 HydrophobicContact CG2-CG 4.06Å; P194-K196 PolarHBondContact O-N 2.88Å
195	K	63.2	Low	56.4	Low	166 Å²	166	100 Å²	100	72%	0.722	58%	0.584	S	S	*	*			trans	-61.9	106.3	-175.2	-74.8	-179.4	178.9	177.5	0	107.2	A193 M197	A193-K195 PolarHBondContact O-N 3.14Å; A193-K195 VanDerWaalsContact O-N 3.12Å; K195-M197 PolarHBondContact O-N 3.05Å; K195-M197 VanDerWaalsContact O-N 3.08Å
196	K	61.1	Low	58.6	Low	192 Å²	192	95 Å²	95	84%	0.835	55%	0.551	S	S	*	*			trans	-56.5	117.2	168.3	-64.7	-159.7	175.6	-160.1	0	107.3	P194	P194-K196 PolarHBondContact O-N 2.88Å
197	M	68.8	Low	60.9	Low	26 Å²	26	94.4 Å²	94.4	13%	0.128	53%	0.534	C	S	.	.			trans	-123.7	144.6	178.1	62.1	-175.7	78.2	0	0	108	F41 K195 L202 K205	F41-M197 HydrophobicContact CD1-CE 3.65Å; F41-M197 HydrophobicContact CD1-SD 4.05Å; F41-M197 HydrophobicContact CE1-CE 3.98Å; F41-M197 HydrophobicContact CE1-SD 4.48Å; K195-M197 PolarHBondContact O-N 3.05Å; K195-M197 VanDerWaalsContact O-N 3.08Å; M197-L202 HydrophobicContact CG-CB 3.9Å; M197-L202 HydrophobicContact CG-CD1 4.35Å; M197-L202 VanDerWaalsContact SD-CA 3.52Å; M197-L202 HydrophobicContact SD-CB 3.71Å; M197-L202 HydrophobicContact SD-CD1 3.47Å; M197-L202 WeakPolarHBondContact SD-CD1 3.26Å; M197-L202 HydrophobicContact SD-CG 4.18Å; M197-K205 HydrophobicContact CE-CD 4.33Å; M197-K205 HydrophobicContact SD-CD 4.43Å
198	S	68.8	Low	63.2	Low	59 Å²	59	93.6 Å²	93.6	41%	0.413	52%	0.52	S	S	.	.			trans	-64.8	154.7	173.9	86.3	0	0	0	0	109.5	Q200 S201 L202	S198-Q200 PolarHBondContact O-N 2.83Å; S198-Q200 VanDerWaalsContact O-N 3.17Å; S198-S201 WeakPolarHBondContact O-CA 3.24Å; S198-S201 WeakPolarHBondContact O-CB 3.5Å; S198-S201 PolarHBondContact O-N 2.93Å; S198-S201 PolarHBondContact OG-N 2.74Å; S198-L202 PolarHBondContact O-N 3.5Å
199	P	65.8	Low	65.5	Low	38 Å²	38	94.9 Å²	94.9	25%	0.247	50%	0.502	C	S	.	.	H	α-helix	trans	-49.8	-42.8	177.5	-29.3	35.1	0	0	0	112.7	E44 S201 L202 F203	E44-P199 HydrophobicContact CG-CG 4.17Å; E44-P199 WeakPolarHBondContact OE1-CD 3.47Å; E44-P199 VanDerWaalsContact OE1-CG 3.24Å; E44-P199 WeakPolarHBondContact OE1-CG 3.38Å; P199-S201 VanDerWaalsContact C-N 3.34Å; P199-S201 PolarHBondContact O-N 2.83Å; P199-L202 WeakPolarHBondContact O-CB 3.33Å; P199-L202 PolarHBondContact O-N 3.11Å; P199-F203 HydrophobicContact CB-CE2 4.17Å; P199-F203 WeakPolarHBondContact O-CD2 2.81Å; P199-F203 WeakPolarHBondContact O-CG 3.35Å; P199-F203 PolarHBondContact O-N 3.42Å
200	Q	72.9	Confident	67.8	Low	162 Å²	162	93 Å²	93	76%	0.757	48%	0.481	S	S	*	.	H	α-helix	trans	-61.7	-38.6	176.6	-69.4	-175.4	-18.5	0	0	113.5	S198 K204	S198-Q200 PolarHBondContact O-N 2.83Å; S198-Q200 VanDerWaalsContact O-N 3.17Å; Q200-K204 WeakPolarHBondContact O-CB 3.41Å; Q200-K204 PolarHBondContact O-N 2.95Å
201	S	73.4	Confident	69.7	Low	62 Å²	62	95.1 Å²	95.1	43%	0.434	48%	0.476	S	S	.	.	H	α-helix	trans	-70.1	-36.6	176.3	-173.5	0	0	0	0	111.6	S198 P199 K205	S198-S201 WeakPolarHBondContact O-CA 3.24Å; S198-S201 WeakPolarHBondContact O-CB 3.5Å; S198-S201 PolarHBondContact O-N 2.93Å; S198-S201 PolarHBondContact OG-N 2.74Å; P199-S201 VanDerWaalsContact C-N 3.34Å; P199-S201 PolarHBondContact O-N 2.83Å; S201-K205 WeakPolarHBondContact O-CB 3.42Å; S201-K205 PolarHBondContact O-N 3.23Å
202	L	77	Confident	71.4	Confident	11 Å²	11	94.2 Å²	94.2	6%	0.058	47%	0.469	C	S	.	.	H	α-helix	trans	-62.2	-49.5	172.8	-177.6	62.1	0	0	0	111	F41 Y49 M197 S198 P199 K204 K205 I206	F41-L202 HydrophobicContact CB-CD1 3.76Å; F41-L202 HydrophobicContact CD1-CD1 3.41Å; F41-L202 VanDerWaalsContact CD1-CD1 3.41Å; F41-L202 HydrophobicContact CE1-CD1 4.18Å; F41-L202 HydrophobicContact CG-CD1 3.72Å; Y49-L202 HydrophobicContact CD2-CD2 4.39Å; Y49-L202 HydrophobicContact CE2-CD2 4.45Å; M197-L202 HydrophobicContact CG-CB 3.9Å; M197-L202 HydrophobicContact CG-CD1 4.35Å; M197-L202 VanDerWaalsContact SD-CA 3.52Å; M197-L202 HydrophobicContact SD-CB 3.71Å; M197-L202 HydrophobicContact SD-CD1 3.47Å; M197-L202 WeakPolarHBondContact SD-CD1 3.26Å; M197-L202 HydrophobicContact SD-CG 4.18Å; S198-L202 PolarHBondContact O-N 3.5Å; P199-L202 WeakPolarHBondContact O-CB 3.33Å; P199-L202 PolarHBondContact O-N 3.11Å; L202-K204 PolarHBondContact O-N 3.21Å; L202-K205 WeakPolarHBondContact O-CB 3.23Å; L202-K205 PolarHBondContact O-N 3.43Å; L202-K205 VanDerWaalsContact O-N 3.07Å; L202-I206 HydrophobicContact CD1-CD1 4.24Å; L202-I206 HydrophobicContact CD1-CG1 4.38Å; L202-I206 HydrophobicContact CG-CD1 3.88Å; L202-I206 HydrophobicContact CG-CG1 4.45Å; L202-I206 VanDerWaalsContact O-CG1 3.31Å; L202-I206 WeakPolarHBondContact O-CG1 3.4Å; L202-I206 PolarHBondContact O-N 2.93Å
203	F	72.9	Confident	73	Confident	112 Å²	112	86.3 Å²	86.3	49%	0.491	44%	0.439	S	S	.	.	H	α-helix	trans	-57.5	-48.6	177.2	-72.9	-59.1	0	0	0	112.2	I116 P199 K205 I206 Q207	I116-F203 HydrophobicContact CD1-CE1 4.24Å; I116-F203 HydrophobicContact CD1-CE2 4.32Å; I116-F203 HydrophobicContact CD1-CZ 3.93Å; P199-F203 HydrophobicContact CB-CE2 4.17Å; P199-F203 WeakPolarHBondContact O-CD2 2.81Å; P199-F203 WeakPolarHBondContact O-CG 3.35Å; P199-F203 PolarHBondContact O-N 3.42Å; F203-K205 PolarHBondContact O-N 2.86Å; F203-I206 PolarHBondContact O-N 3.29Å; F203-Q207 WeakPolarHBondContact O-CB 3.4Å; F203-Q207 PolarHBondContact O-N 3.27Å
204	K	81.9	Confident	74.3	Confident	150 Å²	150	85.3 Å²	85.3	65%	0.652	43%	0.431	S	S	*	.	H	α-helix	trans	-55.7	-40.2	176.1	-176.2	176.8	178.7	178.9	0	111.7	Q200 L202 E208	Q200-K204 WeakPolarHBondContact O-CB 3.41Å; Q200-K204 PolarHBondContact O-N 2.95Å; L202-K204 PolarHBondContact O-N 3.21Å; K204-E208 WeakPolarHBondContact O-CB 3.31Å; K204-E208 PolarHBondContact O-N 3.16Å
205	K	79.9	Confident	75.6	Confident	91 Å²	91	89.3 Å²	89.3	40%	0.396	44%	0.441	S	S	.	.	H	α-helix	trans	-74.3	-35.1	-179.2	-168.2	169.7	175.8	-165	0	113.2	F41 M197 S201 L202 F203 R209	F41-K205 HydrophobicContact CE1-CD 3.9Å; F41-K205 HydrophobicContact CE1-CG 4.5Å; M197-K205 HydrophobicContact CE-CD 4.33Å; M197-K205 HydrophobicContact SD-CD 4.43Å; S201-K205 WeakPolarHBondContact O-CB 3.42Å; S201-K205 PolarHBondContact O-N 3.23Å; L202-K205 WeakPolarHBondContact O-CB 3.23Å; L202-K205 PolarHBondContact O-N 3.43Å; L202-K205 VanDerWaalsContact O-N 3.07Å; F203-K205 PolarHBondContact O-N 2.86Å; K205-R209 WeakPolarHBondContact O-CB 3.36Å; K205-R209 PolarHBondContact O-N 2.85Å
206	I	78.8	Confident	76.6	Confident	20 Å²	20	89.5 Å²	89.5	10%	0.103	44%	0.438	C	S	.	.	H	α-helix	trans	-63	-47.8	172.2	-66.8	164.7	0	0	0	109.4	F51 L202 F203 R209 Q210	F51-I206 HydrophobicContact CE1-CB 4.42Å; F51-I206 HydrophobicContact CE1-CD1 3.71Å; F51-I206 HydrophobicContact CE1-CG1 3.64Å; F51-I206 HydrophobicContact CE1-CG2 3.91Å; F51-I206 HydrophobicContact CE2-CD1 4.32Å; F51-I206 HydrophobicContact CE2-CG1 4.21Å; F51-I206 HydrophobicContact CZ-CD1 3.32Å; F51-I206 HydrophobicContact CZ-CG1 3.45Å; F51-I206 VanDerWaalsContact CZ-CG1 3.45Å; L202-I206 HydrophobicContact CD1-CD1 4.24Å; L202-I206 HydrophobicContact CD1-CG1 4.38Å; L202-I206 HydrophobicContact CG-CD1 3.88Å; L202-I206 HydrophobicContact CG-CG1 4.45Å; L202-I206 VanDerWaalsContact O-CG1 3.31Å; L202-I206 WeakPolarHBondContact O-CG1 3.4Å; L202-I206 PolarHBondContact O-N 2.93Å; F203-I206 PolarHBondContact O-N 3.29Å; I206-R209 PolarHBondContact O-N 2.94Å; I206-Q210 WeakPolarHBondContact O-CG 3.46Å; I206-Q210 PolarHBondContact O-N 3.1Å
207	Q	81.7	Confident	77.3	Confident	71 Å²	71	85.7 Å²	85.7	33%	0.332	42%	0.418	S	S	.	.	H	α-helix	trans	-60.4	-49	177.5	-171.5	-175.8	9.3	0	0	111.5	P112 F203 R209 Q210 E211	P112-Q207 PolarHBondContact O-NE2 3.14Å; F203-Q207 WeakPolarHBondContact O-CB 3.4Å; F203-Q207 PolarHBondContact O-N 3.27Å; Q207-R209 PolarHBondContact O-N 3.39Å; Q207-Q210 PolarHBondContact O-N 3.13Å; Q207-Q210 VanDerWaalsContact O-N 3.16Å; Q207-E211 WeakPolarHBondContact O-CB 3.17Å; Q207-E211 PolarHBondContact O-N 2.86Å
208	E	80.7	Confident	77.8	Confident	125 Å²	125	91 Å²	91	58%	0.584	44%	0.442	S	S	*	.	H	α-helix	trans	-56.6	-38.8	176.1	-177	-177.4	178.9	0	0	111.6	K204 A212	K204-E208 WeakPolarHBondContact O-CB 3.31Å; K204-E208 PolarHBondContact O-N 3.16Å; E208-A212 VanDerWaalsContact O-CB 3.26Å; E208-A212 WeakPolarHBondContact O-CB 3.35Å; E208-A212 PolarHBondContact O-N 3.38Å
209	R	80	Confident	78.6	Confident	103 Å²	103	91 Å²	91	39%	0.389	45%	0.446	S	S	.	.	H	α-helix	trans	-70.8	-40.2	178.7	-163.7	174.3	-162.4	160.5	7.8	112.4	P38 N39 K205 I206 Q207 A212 A213	P38-R209 PolarHBondContact O-NH1 3.09Å; P38-R209 VanDerWaalsContact O-NH1 3.1Å; N39-R209 PolarHBondContact OD1-NH1 3.35Å; N39-R209 VanDerWaalsContact OD1-NH1 3.14Å; N39-R209 PolarHBondContact OD1-NH2 3.48Å; K205-R209 WeakPolarHBondContact O-CB 3.36Å; K205-R209 PolarHBondContact O-N 2.85Å; I206-R209 PolarHBondContact O-N 2.94Å; Q207-R209 PolarHBondContact O-N 3.39Å; R209-A212 PolarHBondContact O-N 2.94Å; R209-A213 WeakPolarHBondContact O-CB 3.37Å; R209-A213 PolarHBondContact O-N 3.44Å
210	Q	81.5	Confident	79.6	Confident	66 Å²	66	94.4 Å²	94.4	31%	0.308	46%	0.459	S	S	.	.	H	α-helix	trans	-63.3	-43.7	174.2	-73.3	175.8	-13.8	0	0	111.1	V60 I206 Q207 A213 A214	V60-Q210 HydrophobicContact CG2-CG 4.14Å; I206-Q210 WeakPolarHBondContact O-CG 3.46Å; I206-Q210 PolarHBondContact O-N 3.1Å; Q207-Q210 PolarHBondContact O-N 3.13Å; Q207-Q210 VanDerWaalsContact O-N 3.16Å; Q210-A213 PolarHBondContact O-N 3.26Å; Q210-A214 WeakPolarHBondContact O-CB 3.36Å; Q210-A214 PolarHBondContact O-N 3.44Å
211	E	80.4	Confident	80.3	Confident	134 Å²	134	90.9 Å²	90.9	63%	0.626	45%	0.445	S	S	*	.	H	α-helix	trans	-63.9	-44.5	175.8	-170.4	-174.6	166.2	0	0	111.4	Q207 A213 A214 K215	Q207-E211 WeakPolarHBondContact O-CB 3.17Å; Q207-E211 PolarHBondContact O-N 2.86Å; E211-A213 VanDerWaalsContact C-N 3.33Å; E211-A213 PolarHBondContact O-N 3.47Å; E211-A214 PolarHBondContact O-N 2.99Å; E211-K215 WeakPolarHBondContact O-CB 3.18Å; E211-K215 PolarHBondContact O-N 3.13Å
212	A	79.4	Confident	81	Confident	58 Å²	58	90.6 Å²	90.6	48%	0.479	45%	0.446	S	S	.	.	H	α-helix	trans	-62.4	-39.5	176.7	0	0	0	0	0	112.3	E208 R209 R216	E208-A212 VanDerWaalsContact O-CB 3.26Å; E208-A212 WeakPolarHBondContact O-CB 3.35Å; E208-A212 PolarHBondContact O-N 3.38Å; R209-A212 PolarHBondContact O-N 2.94Å; A212-R216 WeakPolarHBondContact O-CB 3.23Å; A212-R216 PolarHBondContact O-N 3.22Å
213	A	78.9	Confident	81.6	Confident	24 Å²	24	95.1 Å²	95.1	20%	0.198	47%	0.467	C	S	.	.	H	α-helix	trans	-65	-46.4	174.5	0	0	0	0	0	111.5	R209 Q210 E211 K215 R216 R217	R209-A213 WeakPolarHBondContact O-CB 3.37Å; R209-A213 PolarHBondContact O-N 3.44Å; Q210-A213 PolarHBondContact O-N 3.26Å; E211-A213 VanDerWaalsContact C-N 3.33Å; E211-A213 PolarHBondContact O-N 3.47Å; A213-K215 VanDerWaalsContact C-N 3.35Å; A213-K215 PolarHBondContact O-N 3.43Å; A213-R216 PolarHBondContact O-N 3.02Å; A213-R217 PolarHBondContact O-N 3.48Å
214	A	77.2	Confident	82.4	Confident	58 Å²	58	95.3 Å²	95.3	48%	0.479	47%	0.468	S	S	.	.	H	α-helix	trans	-58.9	-44.7	175.7	0	0	0	0	0	111.9	Q210 E211 R216 R217 E218	Q210-A214 WeakPolarHBondContact O-CB 3.36Å; Q210-A214 PolarHBondContact O-N 3.44Å; E211-A214 PolarHBondContact O-N 2.99Å; A214-R216 PolarHBondContact O-N 2.96Å; A214-R217 WeakPolarHBondContact O-CB 3.49Å; A214-R217 PolarHBondContact O-N 2.99Å; A214-E218 PolarHBondContact O-N 2.91Å
215	K	83.3	Confident	82.8	Confident	147 Å²	147	92.7 Å²	92.7	64%	0.639	46%	0.46	S	S	*	.	H	α-helix	trans	-64.5	-40	176.4	-172.2	173.5	-175	171.2	0	112.5	E211 A213 R217 E218 A219	E211-K215 WeakPolarHBondContact O-CB 3.18Å; E211-K215 PolarHBondContact O-N 3.13Å; A213-K215 VanDerWaalsContact C-N 3.35Å; A213-K215 PolarHBondContact O-N 3.43Å; K215-R217 VanDerWaalsContact C-N 3.3Å; K215-R217 PolarHBondContact O-N 3.42Å; K215-E218 PolarHBondContact O-N 2.88Å; K215-A219 WeakPolarHBondContact O-CB 3.46Å; K215-A219 PolarHBondContact O-N 3.41Å
216	R	83.8	Confident	83.3	Confident	170 Å²	170	95.5 Å²	95.5	64%	0.642	47%	0.468	S	S	*	.	H	α-helix	trans	-62.3	-39.9	175	-172.7	177.4	-174.1	167.9	1.6	111.1	A212 A213 A214 A219 Q220	A212-R216 WeakPolarHBondContact O-CB 3.23Å; A212-R216 PolarHBondContact O-N 3.22Å; A213-R216 PolarHBondContact O-N 3.02Å; A214-R216 PolarHBondContact O-N 2.96Å; R216-A219 PolarHBondContact O-N 2.88Å; R216-Q220 WeakPolarHBondContact O-CG 3.37Å; R216-Q220 PolarHBondContact O-N 3.21Å
217	R	75.5	Confident	83.7	Confident	112 Å²	112	99 Å²	99	42%	0.423	49%	0.486	S	S	.	.	H	α-helix	trans	-65.2	-45.7	175.3	177.8	-177.8	171.5	-160.9	-4.6	112.2	Y58 A213 A214 K215 A219 Q220 L221	Y58-R217 VanDerWaalsContact CD1-CZ 3.43Å; Y58-R217 PolarHBondContact OH-NH2 3.47Å; Y58-R217 VanDerWaalsContact OH-NH2 3.14Å; A213-R217 PolarHBondContact O-N 3.48Å; A214-R217 WeakPolarHBondContact O-CB 3.49Å; A214-R217 PolarHBondContact O-N 2.99Å; K215-R217 VanDerWaalsContact C-N 3.3Å; K215-R217 PolarHBondContact O-N 3.42Å; R217-A219 VanDerWaalsContact C-N 3.31Å; R217-A219 PolarHBondContact O-N 2.94Å; R217-Q220 PolarHBondContact O-N 3.48Å; R217-L221 HydrophobicContact CG-CD1 4.33Å; R217-L221 WeakPolarHBondContact O-CG 3.48Å; R217-L221 PolarHBondContact O-N 2.88Å
218	E	80	Confident	84	Confident	137 Å²	137	103.6 Å²	103.6	64%	0.64	50%	0.5	S	S	*	.	H	α-helix	trans	-59	-44.2	176.1	-171.3	-175.3	178.1	0	0	111	A214 K215 Q220 L221 A222	A214-E218 PolarHBondContact O-N 2.91Å; K215-E218 PolarHBondContact O-N 2.88Å; E218-Q220 PolarHBondContact O-N 3.43Å; E218-L221 PolarHBondContact O-N 3.39Å; E218-A222 WeakPolarHBondContact O-CB 3.33Å; E218-A222 PolarHBondContact O-N 3.03Å
219	A	85.3	Confident	84.4	Confident	59 Å²	59	103.2 Å²	103.2	49%	0.488	50%	0.499	S	S	.	.	H	α-helix	trans	-61.2	-42.1	175.8	0	0	0	0	0	112.5	K215 R216 R217 A222 E223	K215-A219 WeakPolarHBondContact O-CB 3.46Å; K215-A219 PolarHBondContact O-N 3.41Å; R216-A219 PolarHBondContact O-N 2.88Å; R217-A219 VanDerWaalsContact C-N 3.31Å; R217-A219 PolarHBondContact O-N 2.94Å; A219-A222 PolarHBondContact O-N 3.25Å; A219-E223 WeakPolarHBondContact O-CB 3.35Å; A219-E223 PolarHBondContact O-N 3.25Å
220	Q	87.1	Confident	84.6	Confident	110 Å²	110	100.5 Å²	100.5	51%	0.514	50%	0.498	S	S	.	.	H	α-helix	trans	-65.1	-39.4	176.2	-75.5	176.5	-14.5	0	0	112.5	R216 R217 E218 E223 K224	R216-Q220 WeakPolarHBondContact O-CG 3.37Å; R216-Q220 PolarHBondContact O-N 3.21Å; R217-Q220 PolarHBondContact O-N 3.48Å; E218-Q220 PolarHBondContact O-N 3.43Å; Q220-E223 PolarHBondContact O-N 2.89Å; Q220-K224 WeakPolarHBondContact O-CB 3.28Å; Q220-K224 PolarHBondContact O-N 3.16Å
221	L	87.1	Confident	84.7	Confident	88 Å²	88	104.4 Å²	104.4	46%	0.461	51%	0.511	S	S	.	.	H	α-helix	trans	-66.7	-45.2	175.3	-73.3	172.7	0	0	0	111.3	R217 E218 E223 K224 I225	R217-L221 HydrophobicContact CG-CD1 4.33Å; R217-L221 WeakPolarHBondContact O-CG 3.48Å; R217-L221 PolarHBondContact O-N 2.88Å; E218-L221 PolarHBondContact O-N 3.39Å; L221-E223 VanDerWaalsContact C-N 3.31Å; L221-E223 PolarHBondContact O-N 3.4Å; L221-K224 PolarHBondContact O-N 2.87Å; L221-I225 VanDerWaalsContact O-CG1 3.28Å; L221-I225 WeakPolarHBondContact O-CG1 3.31Å; L221-I225 PolarHBondContact O-N 2.9Å
222	A	88.3	Confident	84.7	Confident	56 Å²	56	100.6 Å²	100.6	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-59.3	-42.2	175.3	0	0	0	0	0	111.4	E218 A219 I225 R226	E218-A222 WeakPolarHBondContact O-CB 3.33Å; E218-A222 PolarHBondContact O-N 3.03Å; A219-A222 PolarHBondContact O-N 3.25Å; A222-I225 PolarHBondContact O-N 3.23Å; A222-R226 WeakPolarHBondContact O-CB 3.38Å; A222-R226 PolarHBondContact O-N 2.97Å
223	E	90.4	Very high	84.5	Confident	107 Å²	107	104.4 Å²	104.4	50%	0.5	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-44.3	175.2	-174.2	174.1	-165.4	0	0	111.9	A219 Q220 L221 I225 R226 L227	A219-E223 WeakPolarHBondContact O-CB 3.35Å; A219-E223 PolarHBondContact O-N 3.25Å; Q220-E223 PolarHBondContact O-N 2.89Å; L221-E223 VanDerWaalsContact C-N 3.31Å; L221-E223 PolarHBondContact O-N 3.4Å; E223-I225 VanDerWaalsContact C-N 3.33Å; E223-I225 PolarHBondContact O-N 2.79Å; E223-R226 PolarHBondContact O-N 2.82Å; E223-L227 HydrophobicContact CG-CD1 4.24Å; E223-L227 HydrophobicContact CG-CG 4.5Å; E223-L227 WeakPolarHBondContact O-CB 3.48Å; E223-L227 WeakPolarHBondContact O-CG 3.38Å; E223-L227 PolarHBondContact O-N 2.83Å
224	K	89.5	Confident	84.4	Confident	116 Å²	116	107.7 Å²	107.7	50%	0.504	53%	0.532	S	S	.	.	H	α-helix	trans	-61.9	-40.1	176.6	-171	175.4	-177.5	177	0	111.8	Q220 L221 R228	Q220-K224 WeakPolarHBondContact O-CB 3.28Å; Q220-K224 PolarHBondContact O-N 3.16Å; L221-K224 PolarHBondContact O-N 2.87Å; K224-R228 VanDerWaalsContact O-CG 3.31Å; K224-R228 WeakPolarHBondContact O-CG 3.35Å; K224-R228 PolarHBondContact O-N 3.14Å
225	I	90.2	Very high	83.9	Confident	95 Å²	95	110.3 Å²	110.3	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-65.4	-46.8	175	-68.4	165.1	0	0	0	110.2	L221 A222 E223 L227 R228 Q229	L221-I225 VanDerWaalsContact O-CG1 3.28Å; L221-I225 WeakPolarHBondContact O-CG1 3.31Å; L221-I225 PolarHBondContact O-N 2.9Å; A222-I225 PolarHBondContact O-N 3.23Å; E223-I225 VanDerWaalsContact C-N 3.33Å; E223-I225 PolarHBondContact O-N 2.79Å; I225-L227 VanDerWaalsContact C-N 3.33Å; I225-L227 PolarHBondContact O-N 2.77Å; I225-R228 PolarHBondContact O-N 3.47Å; I225-R228 VanDerWaalsContact O-N 3.16Å; I225-Q229 HydrophobicContact CG2-CG 4.39Å; I225-Q229 WeakPolarHBondContact O-CG 3.37Å; I225-Q229 PolarHBondContact O-N 3.38Å
226	R	90.8	Very high	82.8	Confident	149 Å²	149	109.4 Å²	109.4	56%	0.562	54%	0.54	S	S	*	.	H	α-helix	trans	-58.3	-44.1	177.3	-170.8	-171.2	73.6	90.7	-0.5	111.8	A222 E223 Q229 A230	A222-R226 WeakPolarHBondContact O-CB 3.38Å; A222-R226 PolarHBondContact O-N 2.97Å; E223-R226 PolarHBondContact O-N 2.82Å; R226-Q229 PolarHBondContact O-N 3.02Å; R226-A230 WeakPolarHBondContact O-CB 3.39Å; R226-A230 PolarHBondContact O-N 2.92Å
227	L	87.5	Confident	81.1	Confident	93 Å²	93	115.3 Å²	115.3	49%	0.487	56%	0.562	S	S	.	*	H	α-helix	trans	-64.3	-40.9	176.8	-72.7	173.5	0	0	0	111.8	E223 I225 A230 Y231	E223-L227 HydrophobicContact CG-CD1 4.24Å; E223-L227 HydrophobicContact CG-CG 4.5Å; E223-L227 WeakPolarHBondContact O-CB 3.48Å; E223-L227 WeakPolarHBondContact O-CG 3.38Å; E223-L227 PolarHBondContact O-N 2.83Å; I225-L227 VanDerWaalsContact C-N 3.33Å; I225-L227 PolarHBondContact O-N 2.77Å; L227-A230 PolarHBondContact O-N 3.5Å; L227-Y231 VanDerWaalsContact O-CB 3.26Å; L227-Y231 WeakPolarHBondContact O-CB 3.35Å; L227-Y231 PolarHBondContact O-N 3.49Å
228	R	88	Confident	81.4	Confident	168 Å²	168	115.5 Å²	115.5	63%	0.634	57%	0.569	S	S	*	*	H	α-helix	trans	-63.9	-42.9	175.3	-76.3	177.3	175.2	-148.7	-3.8	112.3	K224 I225 Y231 A232	K224-R228 VanDerWaalsContact O-CG 3.31Å; K224-R228 WeakPolarHBondContact O-CG 3.35Å; K224-R228 PolarHBondContact O-N 3.14Å; I225-R228 PolarHBondContact O-N 3.47Å; I225-R228 VanDerWaalsContact O-N 3.16Å; R228-Y231 PolarHBondContact O-N 3.41Å; R228-A232 WeakPolarHBondContact O-CB 3.06Å; R228-A232 PolarHBondContact O-N 3.17Å
229	Q	87.2	Confident	81.5	Confident	118 Å²	118	114.3 Å²	114.3	55%	0.551	57%	0.566	S	S	*	*	H	α-helix	trans	-64.5	-44	175.9	-71.6	174.5	-11.7	0	0	111.5	I225 R226 Y231 A232 L233	I225-Q229 HydrophobicContact CG2-CG 4.39Å; I225-Q229 WeakPolarHBondContact O-CG 3.37Å; I225-Q229 PolarHBondContact O-N 3.38Å; R226-Q229 PolarHBondContact O-N 3.02Å; Q229-Y231 PolarHBondContact O-N 2.86Å; Q229-A232 PolarHBondContact O-N 3.42Å; Q229-L233 WeakPolarHBondContact O-CG 3.35Å; Q229-L233 PolarHBondContact O-N 3.5Å
230	A	85.9	Confident	81.3	Confident	45 Å²	45	117.4 Å²	117.4	37%	0.372	57%	0.57	S	S	.	*	H	α-helix	trans	-62.3	-42.5	175.8	0	0	0	0	0	111.9	R226 L227 L233 T234	R226-A230 WeakPolarHBondContact O-CB 3.39Å; R226-A230 PolarHBondContact O-N 2.92Å; L227-A230 PolarHBondContact O-N 3.5Å; A230-L233 PolarHBondContact O-N 3.17Å; A230-T234 WeakPolarHBondContact O-CG2 3.46Å; A230-T234 PolarHBondContact O-N 3.37Å; A230-T234 PolarHBondContact O-OG1 2.9Å
231	Y	83.4	Confident	80.9	Confident	149 Å²	149	117.8 Å²	117.8	58%	0.584	57%	0.573	S	S	*	*	H	α-helix	trans	-65.3	-40.9	176.9	-174.8	-94.4	0	0	0	112.4	L227 R228 Q229 L233 T234 H235	L227-Y231 VanDerWaalsContact O-CB 3.26Å; L227-Y231 WeakPolarHBondContact O-CB 3.35Å; L227-Y231 PolarHBondContact O-N 3.49Å; R228-Y231 PolarHBondContact O-N 3.41Å; Q229-Y231 PolarHBondContact O-N 2.86Å; Y231-L233 VanDerWaalsContact C-N 3.35Å; Y231-L233 PolarHBondContact O-N 3.38Å; Y231-T234 PolarHBondContact O-N 3.48Å; Y231-T234 PolarHBondContact O-OG1 2.94Å; Y231-H235 AromaticContact CD2-CE1 3.5Å; Y231-H235 VanDerWaalsContact CD2-CE1 3.5Å; Y231-H235 WeakPolarHBondContact CD2-CE1 3.14Å; Y231-H235 AromaticContact CD2-ND1 3.77Å; Y231-H235 AromaticContact CE1-ND1 3.97Å; Y231-H235 AromaticContact CE2-CE1 3.06Å; Y231-H235 WeakPolarHBondContact CE2-CE1 3.26Å; Y231-H235 AromaticContact CE2-ND1 3.6Å; Y231-H235 AromaticContact CE2-NE2 3.58Å; Y231-H235 AromaticContact CZ-CE1 3.44Å; Y231-H235 VanDerWaalsContact CZ-CE1 3.44Å; Y231-H235 AromaticContact CZ-ND1 3.69Å; Y231-H235 AromaticContact CZ-NE2 3.65Å; Y231-H235 PolarHBondContact O-N 3.28Å; Y231-H235 PolarHBondContact O-ND1 2.98Å; Y231-H235 PolarHBondContact OH-NE2 3.28Å
232	A	79.2	Confident	80.5	Confident	53 Å²	53	119.7 Å²	119.7	44%	0.438	58%	0.58	S	S	.	*	H	α-helix	trans	-64.2	-38.5	175.7	0	0	0	0	0	112	R228 Q229 T234 V236	R228-A232 WeakPolarHBondContact O-CB 3.06Å; R228-A232 PolarHBondContact O-N 3.17Å; Q229-A232 PolarHBondContact O-N 3.42Å; A232-T234 VanDerWaalsContact C-N 3.34Å; A232-T234 PolarHBondContact O-N 2.82Å; A232-V236 WeakPolarHBondContact O-CB 3.5Å; A232-V236 WeakPolarHBondContact O-CG2 3.5Å; A232-V236 PolarHBondContact O-N 3.35Å
233	L	74.9	Confident	80	Confident	139 Å²	139	123.9 Å²	123.9	73%	0.728	59%	0.588	S	S	*	*	H	α-helix	trans	-69.7	-28.8	177.6	-72.5	168.3	0	0	0	113.3	Q229 A230 Y231	Q229-L233 WeakPolarHBondContact O-CG 3.35Å; Q229-L233 PolarHBondContact O-N 3.5Å; A230-L233 PolarHBondContact O-N 3.17Å; Y231-L233 VanDerWaalsContact C-N 3.35Å; Y231-L233 PolarHBondContact O-N 3.38Å
234	T	77.1	Confident	79.3	Confident	93 Å²	93	125.1 Å²	125.1	57%	0.571	59%	0.594	S	S	*	*	H	α-helix	trans	-82.2	-23	179.5	52.2	0	0	0	0	114	A230 Y231 A232	A230-T234 WeakPolarHBondContact O-CG2 3.46Å; A230-T234 PolarHBondContact O-N 3.37Å; A230-T234 PolarHBondContact O-OG1 2.9Å; Y231-T234 PolarHBondContact O-N 3.48Å; Y231-T234 PolarHBondContact O-OG1 2.94Å; A232-T234 VanDerWaalsContact C-N 3.34Å; A232-T234 PolarHBondContact O-N 2.82Å
235	H	67.6	Low	78.5	Confident	112 Å²	112	125.8 Å²	125.8	52%	0.519	60%	0.601	S	S	.	*	H	α-helix	trans	-105.4	4.1	-177.3	-64.5	74.2	0	0	0	114.1	Y231	Y231-H235 AromaticContact CD2-CE1 3.5Å; Y231-H235 VanDerWaalsContact CD2-CE1 3.5Å; Y231-H235 WeakPolarHBondContact CD2-CE1 3.14Å; Y231-H235 AromaticContact CD2-ND1 3.77Å; Y231-H235 AromaticContact CE1-ND1 3.97Å; Y231-H235 AromaticContact CE2-CE1 3.06Å; Y231-H235 WeakPolarHBondContact CE2-CE1 3.26Å; Y231-H235 AromaticContact CE2-ND1 3.6Å; Y231-H235 AromaticContact CE2-NE2 3.58Å; Y231-H235 AromaticContact CZ-CE1 3.44Å; Y231-H235 VanDerWaalsContact CZ-CE1 3.44Å; Y231-H235 AromaticContact CZ-ND1 3.69Å; Y231-H235 AromaticContact CZ-NE2 3.65Å; Y231-H235 PolarHBondContact O-N 3.28Å; Y231-H235 PolarHBondContact O-ND1 2.98Å; Y231-H235 PolarHBondContact OH-NE2 3.28Å
236	V	59.6	Low	77.5	Confident	128 Å²	128	128.4 Å²	128.4	78%	0.776	61%	0.611	S	S	*	*			trans	-97.7	12.1	173.1	175.2	0	0	0	0	111.6	A232	A232-V236 WeakPolarHBondContact O-CB 3.5Å; A232-V236 WeakPolarHBondContact O-CG2 3.5Å; A232-V236 PolarHBondContact O-N 3.35Å
237	R	49	Very low	76.3	Confident	294 Å²	294	126.5 Å²	126.5	100%	1.109	62%	0.615	S	S	*	*			trans	-111.1	0	165.1	-91.7	-172.1	179.6	170.9	1	110.3

Retrieved 237 of 237 residues in 86 ms (Link to these results)

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