A0A077Z3V0_TRITR Loading...

Fork head domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z3V0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 275 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	39.7	Very low	38.5	Very low	238 Å²	238	150.1 Å²	150.1	100%	1.172	82%	0.823	S	S	*	*				0	81	0	-79.9	179.3	178.6	0	0	103.9
2	D	33.8	Very low	38.5	Very low	153 Å²	153	145.8 Å²	145.8	82%	0.818	81%	0.808	S	S	*	*			trans	-138.8	112.9	-171.3	-64.9	-75.7	0	0	0	106.6
3	V	43.4	Very low	38.5	Very low	147 Å²	147	147.8 Å²	147.8	89%	0.891	82%	0.815	S	S	*	*			trans	-148	103.9	149	-145.8	0	0	0	0	106.9
4	N	35.8	Very low	38.6	Very low	140 Å²	140	146.6 Å²	146.6	75%	0.749	81%	0.805	S	S	*	*			trans	-47.6	152.1	157.2	-71.6	-44.5	0	0	0	109.8
5	D	35.9	Very low	38.4	Very low	144 Å²	144	148.2 Å²	148.2	77%	0.77	80%	0.804	S	S	*	*				172	120.4	113	-86	-23.3	0	0	0	113.5
6	T	39.3	Very low	38.3	Very low	120 Å²	120	149.4 Å²	149.4	74%	0.736	79%	0.793	S	S	*	*			trans	78.1	87.7	139.4	-35.2	0	0	0	0	118.4	A8	T6-A8 PolarHBondContact O-N 3.43Å
7	F	35.3	Very low	38.7	Very low	214 Å²	214	146.2 Å²	146.2	94%	0.939	78%	0.78	S	S	*	*			trans	-51.2	113.6	147.2	-108.1	-104.3	0	0	0	109.8
8	A	44.8	Very low	39.1	Very low	79 Å²	79	140.8 Å²	140.8	65%	0.653	75%	0.754	S	S	*	*			trans	-110	141.8	164	0	0	0	0	0	109.2	T6	T6-A8 PolarHBondContact O-N 3.43Å
9	P	37.5	Very low	39.8	Very low	105 Å²	105	137.3 Å²	137.3	68%	0.682	74%	0.739	S	S	*	*			trans	-76.8	136.3	-152.9	30.2	-34.2	0	0	0	112.4	Y11	P9-Y11 PolarHBondContact O-N 2.92Å; P9-Y11 VanDerWaalsContact O-N 3.14Å
10	A	40.9	Very low	40.4	Very low	98 Å²	98	134.3 Å²	134.3	81%	0.81	73%	0.733	S	S	*	*			trans	-58.2	112.7	163.8	0	0	0	0	0	108.9	P12	A10-P12 VanDerWaalsContact O-CD 3.25Å; A10-P12 WeakPolarHBondContact O-CD 3.28Å
11	Y	37.2	Very low	40.7	Very low	213 Å²	213	131.5 Å²	131.5	84%	0.835	72%	0.724	S	S	*	*			trans	-66	115.6	166.7	-81	-85.9	0	0	0	108	P9 L13	P9-Y11 PolarHBondContact O-N 2.92Å; P9-Y11 VanDerWaalsContact O-N 3.14Å; Y11-L13 PolarHBondContact O-N 3.1Å
12	P	38.4	Very low	41.2	Very low	98 Å²	98	123.3 Å²	123.3	64%	0.636	68%	0.683	S	S	*	*			trans	-67.8	126.2	173.9	28.5	-29.2	0	0	0	107	A10 I14	A10-P12 VanDerWaalsContact O-CD 3.25Å; A10-P12 WeakPolarHBondContact O-CD 3.28Å; P12-I14 HydrophobicContact CG-CG1 4.4Å; P12-I14 PolarHBondContact O-N 3.11Å
13	L	38.6	Very low	41.8	Very low	173 Å²	173	123.4 Å²	123.4	91%	0.906	67%	0.672	S	S	*	*			trans	-64.8	85.3	165.2	-80.1	165.2	0	0	0	107.5	Y11 H15	Y11-L13 PolarHBondContact O-N 3.1Å; L13-H15 PolarHBondContact O-N 3.14Å; L13-H15 VanDerWaalsContact O-N 3.1Å
14	I	39.6	Very low	41.8	Very low	130 Å²	130	126.9 Å²	126.9	67%	0.667	67%	0.669	S	S	*	*			trans	-59.1	113.3	169.9	-66.1	167.3	0	0	0	106.3	P12 W16	P12-I14 HydrophobicContact CG-CG1 4.4Å; P12-I14 PolarHBondContact O-N 3.11Å; I14-W16 PolarHBondContact O-N 3.24Å
15	H	36.1	Very low	42.2	Very low	171 Å²	171	128.5 Å²	128.5	79%	0.792	67%	0.669	S	S	*	*			trans	-68.9	82	175.7	-155.7	-86.5	0	0	0	108.4	L13 V17	L13-H15 PolarHBondContact O-N 3.14Å; L13-H15 VanDerWaalsContact O-N 3.1Å; H15-V17 PolarHBondContact O-N 3.23Å
16	W	36.1	Very low	42.6	Very low	168 Å²	168	126.3 Å²	126.3	64%	0.636	66%	0.661	S	S	*	*			trans	-76.6	108.7	-178.3	-147.2	90.5	0	0	0	109.4	I14 P18 E22	I14-W16 PolarHBondContact O-N 3.24Å; W16-P18 HydrophobicContact CE3-CB 4.17Å; W16-P18 HydrophobicContact CE3-CG 3.81Å; W16-P18 VanDerWaalsContact CZ3-CA 3.49Å; W16-P18 HydrophobicContact CZ3-CB 3.62Å; W16-P18 HydrophobicContact CZ3-CG 3.69Å; W16-E22 HydrophobicContact CH2-CG 4.2Å; W16-E22 WeakPolarHBondContact CH2-OE1 3.43Å; W16-E22 VanDerWaalsContact CH2-OE2 3.31Å; W16-E22 WeakPolarHBondContact CH2-OE2 3.38Å; W16-E22 WeakPolarHBondContact CZ2-OE1 3.38Å
17	V	45.4	Very low	42.5	Very low	94 Å²	94	131.9 Å²	131.9	57%	0.57	67%	0.668	S	S	*	*			trans	-99.5	110.7	173	-179	0	0	0	0	107.7	H15 T19	H15-V17 PolarHBondContact O-N 3.23Å; V17-T19 PolarHBondContact O-N 3.24Å
18	P	46.5	Very low	42.6	Very low	49 Å²	49	125.2 Å²	125.2	32%	0.318	65%	0.653	S	S	.	*			trans	-63.3	130.1	178.2	-17.4	27.8	0	0	0	111.3	W16 E22 R23	W16-P18 HydrophobicContact CE3-CB 4.17Å; W16-P18 HydrophobicContact CE3-CG 3.81Å; W16-P18 VanDerWaalsContact CZ3-CA 3.49Å; W16-P18 HydrophobicContact CZ3-CB 3.62Å; W16-P18 HydrophobicContact CZ3-CG 3.69Å; P18-E22 HydrophobicContact CB-CB 4.18Å; P18-R23 HydrophobicContact CB-CG 4.48Å; P18-R23 PolarHBondContact O-NH2 3.04Å
19	T	52.1	Low	42.2	Very low	75 Å²	75	130.6 Å²	130.6	46%	0.46	66%	0.662	S	S	.	*			trans	-63.9	158.4	171.6	60.7	0	0	0	0	110.6	V17 S21 E22 R23	V17-T19 PolarHBondContact O-N 3.24Å; T19-S21 PolarHBondContact O-N 3.19Å; T19-S21 VanDerWaalsContact O-N 3.12Å; T19-S21 PolarHBondContact OG1-OG 3.08Å; T19-E22 WeakPolarHBondContact CB-OE2 3.32Å; T19-E22 PolarHBondContact N-OE2 3.16Å; T19-E22 PolarHBondContact O-N 3.43Å; T19-E22 VanDerWaalsContact OG1-CD 3.28Å; T19-E22 PolarHBondContact OG1-OE2 3.02Å; T19-R23 PolarHBondContact O-N 3.21Å
20	A	51	Low	42.2	Very low	76 Å²	76	129.2 Å²	129.2	63%	0.628	66%	0.655	S	S	*	*	H	α-helix	trans	-59.8	-24.9	-177.6	0	0	0	0	0	113.3
21	S	47.9	Very low	42.3	Very low	76 Å²	76	129 Å²	129	53%	0.531	64%	0.643	S	S	.	*	H	α-helix	trans	-76.8	-32.7	175.7	70.8	0	0	0	0	112.5	T19 R24 K25	T19-S21 PolarHBondContact O-N 3.19Å; T19-S21 VanDerWaalsContact O-N 3.12Å; T19-S21 PolarHBondContact OG1-OG 3.08Å; S21-R24 PolarHBondContact O-N 3.22Å; S21-K25 PolarHBondContact O-N 3.06Å
22	E	49.2	Very low	42.4	Very low	66 Å²	66	120.8 Å²	120.8	31%	0.308	62%	0.617	S	S	.	*	H	α-helix	trans	-70.6	-35.8	174.6	-78.5	156.2	154.8	0	0	112	W16 P18 T19 R24 K25 T26	W16-E22 HydrophobicContact CH2-CG 4.2Å; W16-E22 WeakPolarHBondContact CH2-OE1 3.43Å; W16-E22 VanDerWaalsContact CH2-OE2 3.31Å; W16-E22 WeakPolarHBondContact CH2-OE2 3.38Å; W16-E22 WeakPolarHBondContact CZ2-OE1 3.38Å; P18-E22 HydrophobicContact CB-CB 4.18Å; T19-E22 WeakPolarHBondContact CB-OE2 3.32Å; T19-E22 PolarHBondContact N-OE2 3.16Å; T19-E22 PolarHBondContact O-N 3.43Å; T19-E22 VanDerWaalsContact OG1-CD 3.28Å; T19-E22 PolarHBondContact OG1-OE2 3.02Å; E22-R24 PolarHBondContact O-N 3.18Å; E22-K25 PolarHBondContact O-N 3.01Å; E22-K25 VanDerWaalsContact O-N 3.08Å; E22-T26 WeakPolarHBondContact O-CG2 3.43Å; E22-T26 PolarHBondContact O-N 3.08Å; E22-T26 PolarHBondContact O-OG1 3.34Å
23	R	47	Very low	42.8	Very low	156 Å²	156	120.5 Å²	120.5	59%	0.589	61%	0.609	S	S	*	*	H	α-helix	trans	-59	-29.7	172.7	-82.3	-178.7	-124.1	-148.1	-2.3	113.7	P18 T19 T26	P18-R23 HydrophobicContact CB-CG 4.48Å; P18-R23 PolarHBondContact O-NH2 3.04Å; T19-R23 PolarHBondContact O-N 3.21Å; R23-T26 PolarHBondContact O-OG1 3.03Å; R23-T26 VanDerWaalsContact O-OG1 3.08Å
24	R	42.6	Very low	43.2	Very low	219 Å²	219	114.1 Å²	114.1	83%	0.826	59%	0.585	S	S	*	*	H	α-helix	trans	-79	-28	177	-71.2	-177	-175.1	165.1	2.1	112.4	S21 E22	S21-R24 PolarHBondContact O-N 3.22Å; E22-R24 PolarHBondContact O-N 3.18Å
25	K	44.6	Very low	43.7	Very low	175 Å²	175	113 Å²	113	76%	0.761	58%	0.575	S	S	*	*	H	α-helix	trans	-82	-25.6	176.3	-70.8	-179.9	179.2	177	0	113.4	S21 E22 R27	S21-K25 PolarHBondContact O-N 3.06Å; E22-K25 PolarHBondContact O-N 3.01Å; E22-K25 VanDerWaalsContact O-N 3.08Å; K25-R27 PolarHBondContact O-N 3.42Å
26	T	44	Very low	44.6	Very low	97 Å²	97	105.4 Å²	105.4	60%	0.595	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-2.8	177.2	53.8	0	0	0	0	115	E22 R23 A28	E22-T26 WeakPolarHBondContact O-CG2 3.43Å; E22-T26 PolarHBondContact O-N 3.08Å; E22-T26 PolarHBondContact O-OG1 3.34Å; R23-T26 PolarHBondContact O-OG1 3.03Å; R23-T26 VanDerWaalsContact O-OG1 3.08Å; T26-A28 PolarHBondContact O-N 3.04Å
27	R	38.1	Very low	45.3	Very low	237 Å²	237	100.2 Å²	100.2	89%	0.894	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.5	176.3	-160.8	171.4	-177.6	-177.8	0.1	112.6	K25	K25-R27 PolarHBondContact O-N 3.42Å
28	A	37.4	Very low	45.6	Very low	75 Å²	75	100.8 Å²	100.8	62%	0.62	53%	0.529	S	S	*	.	S	Bend	trans	-102.8	119.2	172.5	0	0	0	0	0	109.6	T26	T26-A28 PolarHBondContact O-N 3.04Å
29	K	36.7	Very low	45.9	Very low	191 Å²	191	99.9 Å²	99.9	83%	0.83	52%	0.524	S	S	*	.			trans	78.7	68.1	-177.4	-52.7	177	-179.5	177.4	0	115.3	T31	K29-T31 PolarHBondContact O-N 2.81Å
30	S	37.3	Very low	46.2	Very low	76 Å²	76	98.4 Å²	98.4	53%	0.531	51%	0.513	S	S	.	.			trans	-68.8	83.9	160.2	70.1	0	0	0	0	109.7	C32 K35	S30-C32 PolarHBondContact O-N 3.3Å; S30-K35 WeakPolarHBondContact OG-CE 3.47Å; S30-K35 PolarHBondContact OG-NZ 3.14Å
31	T	41.5	Very low	46.5	Very low	94 Å²	94	102 Å²	102	58%	0.577	51%	0.514	S	S	*	.			trans	-59.3	135.8	168.9	48.5	0	0	0	0	108.8	K29 L33 G34	K29-T31 PolarHBondContact O-N 2.81Å; T31-L33 PolarHBondContact O-N 3.04Å; T31-G34 PolarHBondContact O-N 3.16Å
32	C	41.3	Very low	46.6	Very low	41 Å²	41	104.4 Å²	104.4	28%	0.277	52%	0.519	S	S	.	.	H	α-helix	trans	-42.6	-37	-176.5	-162.1	0	0	0	0	113.2	S30 G34 K35 L36 D136	S30-C32 PolarHBondContact O-N 3.3Å; C32-G34 PolarHBondContact O-N 2.98Å; C32-K35 PolarHBondContact O-N 3.24Å; C32-L36 WeakPolarHBondContact O-CD1 3.35Å; C32-L36 PolarHBondContact O-N 3.39Å; C32-L36 VanDerWaalsContact O-N 3.15Å; C32-D136 PolarHBondContact SG-OD1 3.02Å
33	L	46.2	Very low	46.7	Very low	92 Å²	92	101.7 Å²	101.7	48%	0.482	51%	0.507	S	S	.	.	H	α-helix	trans	-58.9	-38.1	177.2	-75	163.2	0	0	0	115.4	T31 L36 C37	T31-L33 PolarHBondContact O-N 3.04Å; L33-L36 WeakPolarHBondContact O-CB 3.43Å; L33-L36 PolarHBondContact O-N 3.01Å; L33-C37 PolarHBondContact O-N 3.01Å
34	G	45.9	Very low	46.8	Very low	38 Å²	38	96.1 Å²	96.1	39%	0.392	50%	0.499	S	S	.	.	H	α-helix	trans	-69.5	-34.6	-178.5	0	0	0	0	0	112.5	T31 C32 C37 N38	T31-G34 PolarHBondContact O-N 3.16Å; C32-G34 PolarHBondContact O-N 2.98Å; G34-C37 PolarHBondContact O-N 3.23Å; G34-N38 PolarHBondContact O-N 3.4Å
35	K	51.3	Low	47.2	Very low	107 Å²	107	94.2 Å²	94.2	47%	0.465	50%	0.504	S	S	.	.	H	α-helix	trans	-71.1	-39.8	173.8	-66.5	178.7	-178.4	169.4	0	111.1	S30 C32 C37 N38 S39	S30-K35 WeakPolarHBondContact OG-CE 3.47Å; S30-K35 PolarHBondContact OG-NZ 3.14Å; C32-K35 PolarHBondContact O-N 3.24Å; K35-C37 VanDerWaalsContact C-N 3.35Å; K35-C37 PolarHBondContact O-N 3.05Å; K35-N38 PolarHBondContact O-N 3.41Å; K35-S39 PolarHBondContact O-N 3.37Å
36	L	55.5	Low	47.9	Very low	12 Å²	12	89.1 Å²	89.1	6%	0.063	49%	0.49	C	S	.	.	H	α-helix	trans	-60	-42.1	171.7	-94	125.7	0	0	0	111.9	C32 L33 N38 S39 L40 V61 L64 L140	C32-L36 WeakPolarHBondContact O-CD1 3.35Å; C32-L36 PolarHBondContact O-N 3.39Å; C32-L36 VanDerWaalsContact O-N 3.15Å; L33-L36 WeakPolarHBondContact O-CB 3.43Å; L33-L36 PolarHBondContact O-N 3.01Å; L36-N38 PolarHBondContact O-N 3.43Å; L36-S39 PolarHBondContact O-N 2.73Å; L36-L40 WeakPolarHBondContact O-CB 3.44Å; L36-L40 WeakPolarHBondContact O-CG 3.38Å; L36-L40 PolarHBondContact O-N 3.15Å; L36-V61 HydrophobicContact CD2-CB 4.12Å; L36-V61 HydrophobicContact CD2-CG1 3.96Å; L36-V61 HydrophobicContact CD2-CG2 3.54Å; L36-L64 HydrophobicContact CD1-CD1 3.98Å; L36-L140 HydrophobicContact CD2-CD1 4.04Å; L36-L140 HydrophobicContact CD2-CD2 4.31Å
37	C	50.5	Low	48.7	Very low	59 Å²	59	92.7 Å²	92.7	40%	0.399	50%	0.497	S	S	.	.	H	α-helix	trans	-60.4	-41.8	177.5	-172.8	0	0	0	0	112.5	L33 G34 K35 L40 K41	L33-C37 PolarHBondContact O-N 3.01Å; G34-C37 PolarHBondContact O-N 3.23Å; K35-C37 VanDerWaalsContact C-N 3.35Å; K35-C37 PolarHBondContact O-N 3.05Å; C37-L40 PolarHBondContact O-N 3.33Å; C37-K41 WeakPolarHBondContact O-CB 3.34Å; C37-K41 WeakPolarHBondContact O-CG 3.42Å; C37-K41 PolarHBondContact O-N 3.16Å
38	N	50.8	Low	50.2	Low	105 Å²	105	86.2 Å²	86.2	56%	0.561	48%	0.48	S	S	*	.	H	α-helix	trans	-68.3	-38.6	175.9	-73.7	-21.1	0	0	0	112.5	G34 K35 L36 K41 M42	G34-N38 PolarHBondContact O-N 3.4Å; K35-N38 PolarHBondContact O-N 3.41Å; L36-N38 PolarHBondContact O-N 3.43Å; N38-K41 PolarHBondContact O-N 3.22Å; N38-M42 WeakPolarHBondContact O-CG 3.46Å; N38-M42 PolarHBondContact O-N 3.35Å
39	S	53.2	Low	52.1	Low	31 Å²	31	84.6 Å²	84.6	22%	0.217	47%	0.467	C	S	.	.	H	α-helix	trans	-64.9	-41.4	174.7	-165.1	0	0	0	0	111.2	K35 L36 M42 C43 G138	K35-S39 PolarHBondContact O-N 3.37Å; L36-S39 PolarHBondContact O-N 2.73Å; S39-M42 PolarHBondContact O-N 3.05Å; S39-C43 PolarHBondContact O-N 2.93Å; S39-C43 PolarHBondContact O-SG 2.96Å; S39-G138 PolarHBondContact OG-O 2.94Å
40	L	59	Low	54.3	Low	44 Å²	44	82.6 Å²	82.6	23%	0.23	45%	0.454	C	S	.	.	H	α-helix	trans	-65.9	-36.5	175.1	-70.7	170.9	0	0	0	113.1	L36 C37 M42 C43 L53 V61 F84	L36-L40 WeakPolarHBondContact O-CB 3.44Å; L36-L40 WeakPolarHBondContact O-CG 3.38Å; L36-L40 PolarHBondContact O-N 3.15Å; C37-L40 PolarHBondContact O-N 3.33Å; L40-M42 PolarHBondContact O-N 3.22Å; L40-C43 WeakPolarHBondContact O-CB 3.4Å; L40-C43 PolarHBondContact O-N 2.76Å; L40-L53 HydrophobicContact CD2-CD1 4Å; L40-V61 HydrophobicContact CD1-CG1 3.96Å; L40-V61 HydrophobicContact CD2-CG1 4.34Å; L40-V61 HydrophobicContact CD2-CG2 4.45Å; L40-F84 HydrophobicContact CD2-CE1 4.16Å; L40-F84 HydrophobicContact CD2-CZ 3.63Å
41	K	55.8	Low	56.4	Low	150 Å²	150	79.3 Å²	79.3	65%	0.652	43%	0.431	S	S	*	.	H	α-helix	trans	-64.3	-27	173.4	-81.2	-179	179.9	-177.9	0	113	C37 N38 C43	C37-K41 WeakPolarHBondContact O-CB 3.34Å; C37-K41 WeakPolarHBondContact O-CG 3.42Å; C37-K41 PolarHBondContact O-N 3.16Å; N38-K41 PolarHBondContact O-N 3.22Å; K41-C43 VanDerWaalsContact C-N 3.3Å
42	M	50.5	Low	58.2	Low	128 Å²	128	83.6 Å²	83.6	63%	0.631	44%	0.437	S	S	*	.	H	α-helix	trans	-75.6	-22.8	170.6	-60.7	-78.1	78.7	0	0	111.3	N38 S39 L40 G44 W52	N38-M42 WeakPolarHBondContact O-CG 3.46Å; N38-M42 PolarHBondContact O-N 3.35Å; S39-M42 PolarHBondContact O-N 3.05Å; L40-M42 PolarHBondContact O-N 3.22Å; M42-G44 PolarHBondContact O-N 3.11Å; M42-W52 VanDerWaalsContact C-CZ2 3.44Å; M42-W52 HydrophobicContact CB-CZ2 4.14Å; M42-W52 WeakPolarHBondContact O-CH2 3.42Å; M42-W52 WeakPolarHBondContact O-CZ2 3.32Å
43	C	51.6	Low	60.2	Low	8 Å²	8	82.4 Å²	82.4	5%	0.054	43%	0.428	C	S	.	.	S	Bend	trans	-80.8	13.9	-166	-64.8	0	0	0	0	121.1	S39 L40 K41 W52 L53	S39-C43 PolarHBondContact O-N 2.93Å; S39-C43 PolarHBondContact O-SG 2.96Å; L40-C43 WeakPolarHBondContact O-CB 3.4Å; L40-C43 PolarHBondContact O-N 2.76Å; K41-C43 VanDerWaalsContact C-N 3.3Å; C43-W52 VanDerWaalsContact CB-CD1 3.49Å; C43-W52 VanDerWaalsContact CB-NE1 3.3Å; C43-W52 PolarHBondContact SG-NE1 3.01Å; C43-L53 HydrophobicContact CB-CD1 4.34Å; C43-L53 HydrophobicContact CB-CG 4.29Å
44	G	49.2	Very low	62.2	Low	40 Å²	40	79 Å²	79	41%	0.412	41%	0.411	S	S	.	.			trans	165.8	99.5	174.1	0	0	0	0	0	111.9	M42 S46	M42-G44 PolarHBondContact O-N 3.11Å; G44-S46 PolarHBondContact O-N 2.74Å
45	L	51.3	Low	64.5	Low	178 Å²	178	79.6 Å²	79.6	93%	0.932	40%	0.402	S	S	*	.	S	Bend	trans	-65.7	11.7	179	-82.9	138.9	0	0	0	114.8
46	S	58.5	Low	66.4	Low	68 Å²	68	75.6 Å²	75.6	48%	0.476	39%	0.387	S	S	.	.	S	Bend	trans	-153.4	144.1	167.1	64.9	0	0	0	0	111	G44 D48 A49	G44-S46 PolarHBondContact O-N 2.74Å; S46-D48 PolarHBondContact O-N 3.44Å; S46-A49 PolarHBondContact O-N 3.21Å; S46-A49 WeakPolarHBondContact OG-CB 3.39Å; S46-A49 PolarHBondContact OG-N 3.15Å
47	K	61.9	Low	68	Low	173 Å²	173	75.2 Å²	75.2	75%	0.752	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.8	-174.6	-70.1	179.6	178.5	176.3	0	113.9
48	D	69.4	Low	69.9	Low	100 Å²	100	72.4 Å²	72.4	54%	0.535	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-1.5	-175.1	-57.2	-57.1	0	0	0	113.6	S46 Y86	S46-D48 PolarHBondContact O-N 3.44Å; D48-Y86 WeakPolarHBondContact O-CD2 2.99Å
49	A	77.6	Confident	72	Confident	41 Å²	41	67.4 Å²	67.4	34%	0.339	34%	0.34	S	S	.	.	S	Bend	trans	-76.8	146.2	175.2	0	0	0	0	0	111.5	S46 P51	S46-A49 PolarHBondContact O-N 3.21Å; S46-A49 WeakPolarHBondContact OG-CB 3.39Å; S46-A49 PolarHBondContact OG-N 3.15Å; A49-P51 WeakPolarHBondContact O-CD 3.41Å
50	R	81.1	Confident	73.8	Confident	149 Å²	149	66 Å²	66	56%	0.562	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-60.8	122.5	170.7	-176.8	175.2	175	179.1	0.7	109.3	Y86	R50-Y86 HydrophobicContact CB-CD1 3.97Å; R50-Y86 HydrophobicContact CB-CD2 4.14Å; R50-Y86 HydrophobicContact CB-CE1 3.67Å; R50-Y86 HydrophobicContact CB-CE2 3.85Å; R50-Y86 HydrophobicContact CB-CG 4.2Å; R50-Y86 HydrophobicContact CG-CD1 4.03Å; R50-Y86 HydrophobicContact CG-CE1 3.57Å
51	P	81.4	Confident	75.2	Confident	7 Å²	7	64.1 Å²	64.1	5%	0.045	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-60.4	142.3	177.1	-22.4	33.2	0	0	0	111	A49 L53 F84 Y87	A49-P51 WeakPolarHBondContact O-CD 3.41Å; P51-L53 HydrophobicContact CB-CB 4.3Å; P51-L53 HydrophobicContact CB-CD1 4.42Å; P51-L53 HydrophobicContact CB-CG 4.39Å; P51-L53 PolarHBondContact O-N 2.68Å; P51-F84 HydrophobicContact CB-CD1 4.03Å; P51-F84 HydrophobicContact CB-CE1 4.1Å; P51-F84 HydrophobicContact CG-CB 3.88Å; P51-F84 HydrophobicContact CG-CD1 3.27Å; P51-F84 HydrophobicContact CG-CE1 3.85Å; P51-F84 HydrophobicContact CG-CG 3.65Å; P51-Y87 HydrophobicContact CG-CE2 4.1Å
52	W	79.8	Confident	77	Confident	184 Å²	184	57 Å²	57	70%	0.697	29%	0.289	S	S	*	.	S	Bend	trans	-77.1	35.8	173.3	60.2	18.6	0	0	0	112.6	M42 C43	M42-W52 VanDerWaalsContact C-CZ2 3.44Å; M42-W52 HydrophobicContact CB-CZ2 4.14Å; M42-W52 WeakPolarHBondContact O-CH2 3.42Å; M42-W52 WeakPolarHBondContact O-CZ2 3.32Å; C43-W52 VanDerWaalsContact CB-CD1 3.49Å; C43-W52 VanDerWaalsContact CB-NE1 3.3Å; C43-W52 PolarHBondContact SG-NE1 3.01Å
53	L	83.6	Confident	79	Confident	16 Å²	16	50.9 Å²	50.9	8%	0.084	26%	0.259	C	S	.	.			trans	-106.1	144.6	179.8	-70.3	175	0	0	0	110.1	L40 C43 P51 L58 F84 L140	L40-L53 HydrophobicContact CD2-CD1 4Å; C43-L53 HydrophobicContact CB-CD1 4.34Å; C43-L53 HydrophobicContact CB-CG 4.29Å; P51-L53 HydrophobicContact CB-CB 4.3Å; P51-L53 HydrophobicContact CB-CD1 4.42Å; P51-L53 HydrophobicContact CB-CG 4.39Å; P51-L53 PolarHBondContact O-N 2.68Å; L53-L58 HydrophobicContact CB-CD2 3.93Å; L53-L58 HydrophobicContact CB-CG 4.11Å; L53-L58 HydrophobicContact CD1-CD2 3.82Å; L53-F84 HydrophobicContact CD1-CE1 4.19Å; L53-F84 HydrophobicContact CD1-CZ 3.7Å; L53-L140 HydrophobicContact CD2-CB 3.76Å; L53-L140 HydrophobicContact CD2-CD1 4.44Å
54	S	89.1	Confident	80.8	Confident	20 Å²	20	51 Å²	51	14%	0.14	26%	0.259	C	S	.	.			trans	-75.2	158.4	169.5	79.1	0	0	0	0	110.5	V56 S57 L58	S54-V56 PolarHBondContact O-N 3.33Å; S54-V56 PolarHBondContact OG-N 2.9Å; S54-S57 WeakPolarHBondContact O-CA 3.33Å; S54-S57 WeakPolarHBondContact O-CB 3.48Å; S54-S57 PolarHBondContact O-N 3.43Å; S54-S57 PolarHBondContact OG-N 3.44Å; S54-S57 VanDerWaalsContact OG-N 3.1Å; S54-S57 PolarHBondContact OG-OG 3.21Å; S54-L58 WeakPolarHBondContact O-CG 3.43Å; S54-L58 PolarHBondContact O-N 2.89Å
55	Y	92.7	Very high	82.7	Confident	51 Å²	51	51.2 Å²	51.2	20%	0.2	25%	0.254	C	S	.	.	H	α-helix	trans	-58.2	-36.5	173.7	-69.8	-61.2	0	0	0	112.4	S57 L58 I59 Y87 W94 V98	Y55-S57 VanDerWaalsContact C-N 3.32Å; Y55-S57 PolarHBondContact O-N 3.18Å; Y55-L58 HydrophobicContact CD1-CD1 4.03Å; Y55-L58 PolarHBondContact O-N 3.43Å; Y55-I59 WeakPolarHBondContact O-CD1 3.16Å; Y55-I59 WeakPolarHBondContact O-CG1 3.32Å; Y55-I59 PolarHBondContact O-N 2.96Å; Y55-Y87 HydrophobicContact CE1-CE1 4.2Å; Y55-W94 HydrophobicContact CE1-CB 4.02Å; Y55-V98 HydrophobicContact CD1-CG2 4.18Å
56	V	91.1	Very high	84.6	Confident	24 Å²	24	44.6 Å²	44.6	15%	0.145	22%	0.22	C	C	.	.	H	α-helix	trans	-57.3	-48.3	172.5	179.7	0	0	0	0	110.1	S54 L58 I59 T60 N101 F108 F135	S54-V56 PolarHBondContact O-N 3.33Å; S54-V56 PolarHBondContact OG-N 2.9Å; V56-L58 PolarHBondContact O-N 3.33Å; V56-I59 PolarHBondContact O-N 3.23Å; V56-T60 PolarHBondContact O-N 2.76Å; V56-T60 PolarHBondContact O-OG1 3.33Å; V56-N101 WeakPolarHBondContact CG2-OD1 3.38Å; V56-F108 HydrophobicContact CB-CE2 4.44Å; V56-F108 HydrophobicContact CB-CZ 4.43Å; V56-F108 HydrophobicContact CG1-CE2 4.04Å; V56-F108 HydrophobicContact CG1-CZ 3.83Å; V56-F108 HydrophobicContact CG2-CE2 4.42Å; V56-F135 HydrophobicContact CG1-CE1 4.46Å; V56-F135 HydrophobicContact CG1-CZ 4.12Å
57	S	89.2	Confident	86.2	Confident	3 Å²	3	47 Å²	47	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-44.6	178.8	-44.8	0	0	0	0	111.9	S54 Y55 I59 T60 V61 L140	S54-S57 WeakPolarHBondContact O-CA 3.33Å; S54-S57 WeakPolarHBondContact O-CB 3.48Å; S54-S57 PolarHBondContact O-N 3.43Å; S54-S57 PolarHBondContact OG-N 3.44Å; S54-S57 VanDerWaalsContact OG-N 3.1Å; S54-S57 PolarHBondContact OG-OG 3.21Å; Y55-S57 VanDerWaalsContact C-N 3.32Å; Y55-S57 PolarHBondContact O-N 3.18Å; S57-I59 PolarHBondContact O-N 3.39Å; S57-T60 PolarHBondContact O-N 3.34Å; S57-V61 VanDerWaalsContact O-CG2 3.24Å; S57-V61 WeakPolarHBondContact O-CG2 3.3Å; S57-V61 PolarHBondContact O-N 3.1Å; S57-L140 WeakPolarHBondContact CB-O 3.37Å; S57-L140 PolarHBondContact OG-O 3.44Å
58	L	91.4	Very high	87.5	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-58.9	-46.6	177.8	-67.1	173.6	0	0	0	111.9	L53 S54 Y55 V56 V61 A62 I80 F84 Y87	L53-L58 HydrophobicContact CB-CD2 3.93Å; L53-L58 HydrophobicContact CB-CG 4.11Å; L53-L58 HydrophobicContact CD1-CD2 3.82Å; S54-L58 WeakPolarHBondContact O-CG 3.43Å; S54-L58 PolarHBondContact O-N 2.89Å; Y55-L58 HydrophobicContact CD1-CD1 4.03Å; Y55-L58 PolarHBondContact O-N 3.43Å; V56-L58 PolarHBondContact O-N 3.33Å; L58-V61 PolarHBondContact O-N 2.94Å; L58-A62 PolarHBondContact O-N 3.16Å; L58-A62 VanDerWaalsContact O-N 3.09Å; L58-I80 HydrophobicContact CB-CD1 4.1Å; L58-I80 HydrophobicContact CB-CG1 4.38Å; L58-F84 HydrophobicContact CD2-CD2 3.63Å; L58-F84 HydrophobicContact CD2-CE2 3.22Å; L58-F84 HydrophobicContact CD2-CG 4.45Å; L58-F84 HydrophobicContact CD2-CZ 3.74Å; L58-Y87 HydrophobicContact CD1-CE2 3.86Å; L58-Y87 WeakPolarHBondContact CD1-OH 3.46Å
59	I	93.8	Very high	88.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-45	177.7	-64.3	161.3	0	0	0	110.3	Y55 V56 S57 V61 A62 L63 I76 V98 N101 L102 F108	Y55-I59 WeakPolarHBondContact O-CD1 3.16Å; Y55-I59 WeakPolarHBondContact O-CG1 3.32Å; Y55-I59 PolarHBondContact O-N 2.96Å; V56-I59 PolarHBondContact O-N 3.23Å; S57-I59 PolarHBondContact O-N 3.39Å; I59-V61 PolarHBondContact O-N 3.4Å; I59-A62 WeakPolarHBondContact O-CB 3.43Å; I59-A62 PolarHBondContact O-N 2.99Å; I59-A62 VanDerWaalsContact O-N 3.16Å; I59-L63 HydrophobicContact CG2-CD1 3.96Å; I59-L63 HydrophobicContact CG2-CG 4.36Å; I59-L63 WeakPolarHBondContact O-CG 3.45Å; I59-L63 PolarHBondContact O-N 2.86Å; I59-I76 HydrophobicContact CG1-CG2 4.28Å; I59-I76 HydrophobicContact CG2-CD1 4.39Å; I59-V98 HydrophobicContact CD1-CG1 4.11Å; I59-V98 HydrophobicContact CG1-CG1 4.16Å; I59-N101 HydrophobicContact CD1-CB 3.88Å; I59-L102 HydrophobicContact CD1-CD2 4.18Å; I59-L102 HydrophobicContact CD1-CG 4.13Å; I59-L102 HydrophobicContact CG2-CD2 3.73Å; I59-F108 HydrophobicContact CB-CE1 3.99Å; I59-F108 HydrophobicContact CB-CE2 4.32Å; I59-F108 HydrophobicContact CB-CZ 3.68Å; I59-F108 HydrophobicContact CD1-CE2 4.05Å; I59-F108 HydrophobicContact CD1-CZ 4.27Å; I59-F108 HydrophobicContact CG2-CD1 3.85Å; I59-F108 HydrophobicContact CG2-CE1 3.37Å; I59-F108 HydrophobicContact CG2-CE2 4.16Å; I59-F108 HydrophobicContact CG2-CG 4.44Å; I59-F108 HydrophobicContact CG2-CZ 3.54Å
60	T	91.7	Very high	89.2	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.8	-46.1	177.3	-60.5	0	0	0	0	111.4	V56 S57 A62 L63 L64 L127 F135	V56-T60 PolarHBondContact O-N 2.76Å; V56-T60 PolarHBondContact O-OG1 3.33Å; S57-T60 PolarHBondContact O-N 3.34Å; T60-A62 VanDerWaalsContact C-N 3.28Å; T60-A62 PolarHBondContact O-N 3.28Å; T60-L63 PolarHBondContact O-N 3.33Å; T60-L64 HydrophobicContact CG2-CD1 3.71Å; T60-L64 HydrophobicContact CG2-CG 4.06Å; T60-L64 WeakPolarHBondContact O-CB 3.25Å; T60-L64 VanDerWaalsContact O-CG 3.3Å; T60-L64 WeakPolarHBondContact O-CG 3.37Å; T60-L64 PolarHBondContact O-N 2.88Å; T60-L127 HydrophobicContact CG2-CD1 4Å; T60-F135 HydrophobicContact CG2-CB 3.81Å; T60-F135 HydrophobicContact CG2-CD1 3.58Å; T60-F135 HydrophobicContact CG2-CD2 3.56Å; T60-F135 HydrophobicContact CG2-CE1 3.91Å; T60-F135 HydrophobicContact CG2-CE2 3.9Å; T60-F135 HydrophobicContact CG2-CG 3.37Å; T60-F135 HydrophobicContact CG2-CZ 4.06Å; T60-F135 WeakPolarHBondContact OG1-CE1 3.34Å; T60-F135 WeakPolarHBondContact OG1-CZ 3.5Å
61	V	89.4	Confident	89.9	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.03	19%	0.193	C	C	.	.	H	α-helix	trans	-59.6	-41.4	177.4	177	0	0	0	0	110.9	L36 L40 S57 L58 I59 L64 S65 F79 L140	L36-V61 HydrophobicContact CD2-CB 4.12Å; L36-V61 HydrophobicContact CD2-CG1 3.96Å; L36-V61 HydrophobicContact CD2-CG2 3.54Å; L40-V61 HydrophobicContact CD1-CG1 3.96Å; L40-V61 HydrophobicContact CD2-CG1 4.34Å; L40-V61 HydrophobicContact CD2-CG2 4.45Å; S57-V61 VanDerWaalsContact O-CG2 3.24Å; S57-V61 WeakPolarHBondContact O-CG2 3.3Å; S57-V61 PolarHBondContact O-N 3.1Å; L58-V61 PolarHBondContact O-N 2.94Å; I59-V61 PolarHBondContact O-N 3.4Å; V61-L64 PolarHBondContact O-N 3.35Å; V61-S65 WeakPolarHBondContact O-CB 3.49Å; V61-S65 PolarHBondContact O-N 3.09Å; V61-F79 HydrophobicContact CB-CE1 4.43Å; V61-F79 HydrophobicContact CG1-CE1 3.9Å; V61-F79 HydrophobicContact CG1-CZ 3.91Å; V61-L140 HydrophobicContact CG2-CD1 3.78Å; V61-L140 HydrophobicContact CG2-CD2 3.9Å
62	A	93.1	Very high	90.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-46.3	175.7	0	0	0	0	0	112.2	L58 I59 T60 S65 L71 I76 F79	L58-A62 PolarHBondContact O-N 3.16Å; L58-A62 VanDerWaalsContact O-N 3.09Å; I59-A62 WeakPolarHBondContact O-CB 3.43Å; I59-A62 PolarHBondContact O-N 2.99Å; I59-A62 VanDerWaalsContact O-N 3.16Å; T60-A62 VanDerWaalsContact C-N 3.28Å; T60-A62 PolarHBondContact O-N 3.28Å; A62-S65 PolarHBondContact O-N 2.83Å; A62-S65 PolarHBondContact O-OG 3.01Å; A62-L71 HydrophobicContact CB-CD1 4.08Å; A62-L71 VanDerWaalsContact O-CD1 3.22Å; A62-L71 WeakPolarHBondContact O-CD1 3.48Å; A62-I76 HydrophobicContact CB-CG2 4.44Å; A62-F79 VanDerWaalsContact CA-CD1 3.44Å; A62-F79 VanDerWaalsContact CA-CE1 3.44Å; A62-F79 HydrophobicContact CB-CB 4.12Å; A62-F79 HydrophobicContact CB-CD1 3.28Å; A62-F79 HydrophobicContact CB-CE1 3.8Å; A62-F79 HydrophobicContact CB-CG 3.73Å
63	L	92.4	Very high	91.3	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-42.7	178.8	-68.1	171.9	0	0	0	111.6	I59 T60 S65 N66 K69 L71 F108 W125 L127	I59-L63 HydrophobicContact CG2-CD1 3.96Å; I59-L63 HydrophobicContact CG2-CG 4.36Å; I59-L63 WeakPolarHBondContact O-CG 3.45Å; I59-L63 PolarHBondContact O-N 2.86Å; T60-L63 PolarHBondContact O-N 3.33Å; L63-S65 VanDerWaalsContact C-N 3.29Å; L63-S65 PolarHBondContact O-N 3.46Å; L63-N66 PolarHBondContact O-N 3.5Å; L63-K69 WeakPolarHBondContact O-CA 2.92Å; L63-L71 HydrophobicContact CD2-CB 4Å; L63-L71 HydrophobicContact CD2-CD1 4.5Å; L63-L71 HydrophobicContact CD2-CG 4.31Å; L63-F108 HydrophobicContact CD1-CD1 3.78Å; L63-F108 HydrophobicContact CD1-CE1 3.9Å; L63-W125 WeakPolarHBondContact CD2-O 3.21Å; L63-L127 HydrophobicContact CD1-CD1 3.9Å
64	L	89.7	Confident	91.8	Very high	10 Å²	10	40.4 Å²	40.4	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-70.7	-23.8	179.7	-67	-179.9	0	0	0	113	L36 T60 V61 K69 F132 F135	L36-L64 HydrophobicContact CD1-CD1 3.98Å; T60-L64 HydrophobicContact CG2-CD1 3.71Å; T60-L64 HydrophobicContact CG2-CG 4.06Å; T60-L64 WeakPolarHBondContact O-CB 3.25Å; T60-L64 VanDerWaalsContact O-CG 3.3Å; T60-L64 WeakPolarHBondContact O-CG 3.37Å; T60-L64 PolarHBondContact O-N 2.88Å; V61-L64 PolarHBondContact O-N 3.35Å; L64-K69 HydrophobicContact CD2-CD 4.17Å; L64-K69 PolarHBondContact O-NZ 2.86Å; L64-F132 HydrophobicContact CD2-CD1 3.89Å; L64-F132 HydrophobicContact CD2-CE1 3.92Å; L64-F135 HydrophobicContact CD1-CB 4.29Å
65	S	89.2	Confident	92.2	Very high	45 Å²	45	43.1 Å²	43.1	32%	0.315	21%	0.214	S	C	.	.	H	α-helix	trans	-72	-30.6	175.6	75.9	0	0	0	0	112.6	V61 A62 L63 F79	V61-S65 WeakPolarHBondContact O-CB 3.49Å; V61-S65 PolarHBondContact O-N 3.09Å; A62-S65 PolarHBondContact O-N 2.83Å; A62-S65 PolarHBondContact O-OG 3.01Å; L63-S65 VanDerWaalsContact C-N 3.29Å; L63-S65 PolarHBondContact O-N 3.46Å; S65-F79 WeakPolarHBondContact OG-CD2 3.37Å; S65-F79 WeakPolarHBondContact OG-CE2 3.45Å
66	N	91.2	Very high	92.3	Very high	39 Å²	39	40.7 Å²	40.7	21%	0.209	21%	0.205	C	C	.	.	S	Bend	trans	-75.9	134.9	176.9	-168.7	-69	0	0	0	111.3	L63 R68 K69 L71	L63-N66 PolarHBondContact O-N 3.5Å; N66-R68 VanDerWaalsContact C-N 3.27Å; N66-R68 PolarHBondContact O-N 2.99Å; N66-R68 WeakPolarHBondContact OD1-CA 3.24Å; N66-R68 WeakPolarHBondContact OD1-CB 3.46Å; N66-R68 PolarHBondContact OD1-N 3.48Å; N66-K69 WeakPolarHBondContact O-CD 3.11Å; N66-K69 PolarHBondContact O-N 3.48Å; N66-K69 VanDerWaalsContact O-N 3.07Å; N66-L71 HydrophobicContact CB-CD1 4.42Å; N66-L71 HydrophobicContact CB-CD2 3.88Å; N66-L71 HydrophobicContact CB-CG 4.04Å; N66-L71 WeakPolarHBondContact ND2-CD2 3.47Å
67	P	90.6	Very high	92.6	Very high	119 Å²	119	40.1 Å²	40.1	77%	0.773	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-31.7	178.4	23.5	-34.2	0	0	0	113.6	K69	P67-K69 VanDerWaalsContact C-N 3.3Å; P67-K69 PolarHBondContact O-N 2.79Å
68	R	90.1	Very high	92.9	Very high	184 Å²	184	43.7 Å²	43.7	69%	0.694	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-5.5	177.7	-60.3	-177.3	176.4	175.9	-1.1	113.5	N66 M70	N66-R68 VanDerWaalsContact C-N 3.27Å; N66-R68 PolarHBondContact O-N 2.99Å; N66-R68 WeakPolarHBondContact OD1-CA 3.24Å; N66-R68 WeakPolarHBondContact OD1-CB 3.46Å; N66-R68 PolarHBondContact OD1-N 3.48Å; R68-M70 HydrophobicContact CB-CG 3.89Å; R68-M70 PolarHBondContact O-N 3.22Å
69	K	90.5	Very high	93.1	Very high	64 Å²	64	45.6 Å²	45.6	28%	0.278	23%	0.227	S	C	.	.	S	Bend	trans	56.9	17	-176.5	-51.7	-63.1	172.6	-177.9	0	115.3	L63 L64 N66 P67 T126 F132	L63-K69 WeakPolarHBondContact O-CA 2.92Å; L64-K69 HydrophobicContact CD2-CD 4.17Å; L64-K69 PolarHBondContact O-NZ 2.86Å; N66-K69 WeakPolarHBondContact O-CD 3.11Å; N66-K69 PolarHBondContact O-N 3.48Å; N66-K69 VanDerWaalsContact O-N 3.07Å; P67-K69 VanDerWaalsContact C-N 3.3Å; P67-K69 PolarHBondContact O-N 2.79Å; K69-T126 PolarHBondContact O-OG1 3.11Å; K69-F132 HydrophobicContact CB-CE1 4.22Å; K69-F132 HydrophobicContact CB-CZ 4.19Å; K69-F132 HydrophobicContact CD-CE1 4.44Å; K69-F132 HydrophobicContact CG-CE1 4.26Å
70	M	92.8	Very high	93	Very high	64 Å²	64	45.6 Å²	45.6	32%	0.315	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	140.8	179.6	66.4	-176.7	70.2	0	0	110.6	R68 Y124 W125	R68-M70 HydrophobicContact CB-CG 3.89Å; R68-M70 PolarHBondContact O-N 3.22Å; M70-Y124 HydrophobicContact CB-CD1 4.44Å; M70-Y124 HydrophobicContact CG-CD1 4.08Å; M70-Y124 HydrophobicContact SD-CD1 4.35Å; M70-W125 CarbonylContact C-O 3.49Å; M70-W125 WeakPolarHBondContact CA-O 3.34Å
71	L	95.2	Very high	93.1	Very high	9 Å²	9	46.4 Å²	46.4	5%	0.047	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	151	-178.7	-72.6	176.9	0	0	0	110.7	A62 L63 N66 E75 I76 W125	A62-L71 HydrophobicContact CB-CD1 4.08Å; A62-L71 VanDerWaalsContact O-CD1 3.22Å; A62-L71 WeakPolarHBondContact O-CD1 3.48Å; L63-L71 HydrophobicContact CD2-CB 4Å; L63-L71 HydrophobicContact CD2-CD1 4.5Å; L63-L71 HydrophobicContact CD2-CG 4.31Å; N66-L71 HydrophobicContact CB-CD1 4.42Å; N66-L71 HydrophobicContact CB-CD2 3.88Å; N66-L71 HydrophobicContact CB-CG 4.04Å; N66-L71 WeakPolarHBondContact ND2-CD2 3.47Å; L71-E75 WeakPolarHBondContact CA-OE2 3.17Å; L71-E75 HydrophobicContact CB-CB 4.23Å; L71-E75 HydrophobicContact CD2-CB 3.86Å; L71-E75 WeakPolarHBondContact CD2-OE2 3.49Å; L71-E75 HydrophobicContact CG-CB 4.49Å; L71-I76 HydrophobicContact CB-CD1 4.46Å; L71-I76 HydrophobicContact CB-CG1 3.88Å; L71-I76 HydrophobicContact CD1-CG1 4.18Å; L71-W125 PolarHBondContact N-O 2.95Å; L71-W125 PolarHBondContact O-N 3.17Å
72	K	95	Very high	93.1	Very high	59 Å²	59	52.8 Å²	52.8	26%	0.257	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	158.9	164.5	-68.2	175.9	-176.8	159	0	110	N74 E75 I76 Y124	K72-N74 VanDerWaalsContact C-N 3.25Å; K72-N74 PolarHBondContact O-N 2.94Å; K72-E75 HydrophobicContact CB-CG 4.19Å; K72-E75 PolarHBondContact N-OE2 2.73Å; K72-E75 WeakPolarHBondContact O-CB 3.3Å; K72-E75 PolarHBondContact O-N 3.04Å; K72-I76 PolarHBondContact O-N 3.5Å; K72-I76 VanDerWaalsContact O-N 3.08Å; K72-Y124 VanDerWaalsContact CE-CZ 3.44Å; K72-Y124 VanDerWaalsContact CE-OH 3.3Å; K72-Y124 WeakPolarHBondContact CE-OH 3.5Å; K72-Y124 HydrophobicContact CG-CD1 4.12Å; K72-Y124 HydrophobicContact CG-CE1 3.96Å; K72-Y124 HydrophobicContact CG-CE2 4.49Å; K72-Y124 HydrophobicContact CG-CG 4.46Å; K72-Y124 PolarHBondContact NZ-OH 3.36Å
73	I	95.4	Very high	92.9	Very high	47 Å²	47	55.3 Å²	55.3	24%	0.241	28%	0.276	C	S	.	.	H	α-helix	trans	-57.6	-37.2	179.8	-159.9	166.1	0	0	0	113.6	I76 Y77 R99 L102	I73-I76 PolarHBondContact O-N 3.07Å; I73-Y77 HydrophobicContact CG1-CE1 4.08Å; I73-Y77 HydrophobicContact CG1-CE2 4.19Å; I73-Y77 WeakPolarHBondContact O-CD2 3.22Å; I73-Y77 PolarHBondContact O-N 3.31Å; I73-Y77 VanDerWaalsContact O-N 3.17Å; I73-R99 HydrophobicContact CD1-CG 3.58Å; I73-L102 HydrophobicContact CD1-CD1 4.06Å; I73-L102 HydrophobicContact CG1-CD1 3.97Å
74	N	95.2	Very high	92.8	Very high	104 Å²	104	56.3 Å²	56.3	56%	0.556	28%	0.28	S	S	*	.	H	α-helix	trans	-67.2	-39.9	176.9	-66.9	-12.7	0	0	0	111.5	K72 I76 Y77 D78	K72-N74 VanDerWaalsContact C-N 3.25Å; K72-N74 PolarHBondContact O-N 2.94Å; N74-I76 VanDerWaalsContact C-N 3.28Å; N74-I76 PolarHBondContact O-N 2.81Å; N74-Y77 WeakPolarHBondContact O-CB 3.18Å; N74-Y77 PolarHBondContact O-N 3.29Å; N74-Y77 VanDerWaalsContact O-N 3.07Å; N74-D78 PolarHBondContact O-N 3.36Å
75	E	96.2	Very high	92.7	Very high	76 Å²	76	57.4 Å²	57.4	36%	0.355	29%	0.288	S	S	.	.	H	α-helix	trans	-66.4	-32.5	178	-59.6	171.3	147.2	0	0	111.4	L71 K72 F79	L71-E75 WeakPolarHBondContact CA-OE2 3.17Å; L71-E75 HydrophobicContact CB-CB 4.23Å; L71-E75 HydrophobicContact CD2-CB 3.86Å; L71-E75 WeakPolarHBondContact CD2-OE2 3.49Å; L71-E75 HydrophobicContact CG-CB 4.49Å; K72-E75 HydrophobicContact CB-CG 4.19Å; K72-E75 PolarHBondContact N-OE2 2.73Å; K72-E75 WeakPolarHBondContact O-CB 3.3Å; K72-E75 PolarHBondContact O-N 3.04Å; E75-F79 WeakPolarHBondContact O-CB 3.18Å; E75-F79 PolarHBondContact O-N 3.06Å
76	I	96.4	Very high	92.7	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65	-40.8	171.8	-62.5	168.9	0	0	0	110.6	I59 A62 L71 K72 I73 N74 I80 V98 L102 W125	I59-I76 HydrophobicContact CG1-CG2 4.28Å; I59-I76 HydrophobicContact CG2-CD1 4.39Å; A62-I76 HydrophobicContact CB-CG2 4.44Å; L71-I76 HydrophobicContact CB-CD1 4.46Å; L71-I76 HydrophobicContact CB-CG1 3.88Å; L71-I76 HydrophobicContact CD1-CG1 4.18Å; K72-I76 PolarHBondContact O-N 3.5Å; K72-I76 VanDerWaalsContact O-N 3.08Å; I73-I76 PolarHBondContact O-N 3.07Å; N74-I76 VanDerWaalsContact C-N 3.28Å; N74-I76 PolarHBondContact O-N 2.81Å; I76-I80 HydrophobicContact CG2-CD1 3.91Å; I76-I80 VanDerWaalsContact O-CG1 3.32Å; I76-I80 WeakPolarHBondContact O-CG1 3.41Å; I76-I80 PolarHBondContact O-N 3.04Å; I76-I80 VanDerWaalsContact O-N 3.12Å; I76-V98 HydrophobicContact CG2-CG1 4.09Å; I76-L102 HydrophobicContact CD1-CD1 4.23Å; I76-L102 HydrophobicContact CD1-CD2 4.19Å; I76-W125 HydrophobicContact CD1-CB 4.29Å
77	Y	96.5	Very high	92.7	Very high	13 Å²	13	58.1 Å²	58.1	5%	0.051	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-48.7	176.3	-58.9	-28.6	0	0	0	111.6	I73 N74 F79 I80 E81 W94 R95 V98 R99	I73-Y77 HydrophobicContact CG1-CE1 4.08Å; I73-Y77 HydrophobicContact CG1-CE2 4.19Å; I73-Y77 WeakPolarHBondContact O-CD2 3.22Å; I73-Y77 PolarHBondContact O-N 3.31Å; I73-Y77 VanDerWaalsContact O-N 3.17Å; N74-Y77 WeakPolarHBondContact O-CB 3.18Å; N74-Y77 PolarHBondContact O-N 3.29Å; N74-Y77 VanDerWaalsContact O-N 3.07Å; Y77-F79 VanDerWaalsContact C-N 3.34Å; Y77-F79 PolarHBondContact O-N 3.26Å; Y77-I80 PolarHBondContact O-N 3.22Å; Y77-E81 PolarHBondContact O-N 2.86Å; Y77-W94 AromaticContact CD1-CH2 3.97Å; Y77-W94 HydrophobicContact CD1-CH2 3.97Å; Y77-W94 AromaticContact CD1-CZ3 3.69Å; Y77-W94 HydrophobicContact CD1-CZ3 3.69Å; Y77-W94 HydrophobicContact CE1-CZ3 4.42Å; Y77-W94 HydrophobicContact CG-CH2 4.21Å; Y77-W94 HydrophobicContact CG-CZ3 4.39Å; Y77-R95 HydrophobicContact CD1-CB 4.33Å; Y77-R95 HydrophobicContact CD1-CG 3.76Å; Y77-R95 HydrophobicContact CD2-CG 4.31Å; Y77-R95 HydrophobicContact CE1-CB 3.8Å; Y77-R95 HydrophobicContact CE1-CG 3.75Å; Y77-R95 HydrophobicContact CE2-CG 4.32Å; Y77-R95 HydrophobicContact CG-CG 4.03Å; Y77-V98 HydrophobicContact CD1-CG1 4.37Å; Y77-V98 HydrophobicContact CE1-CB 4.16Å; Y77-V98 HydrophobicContact CE1-CG1 3.89Å; Y77-R99 WeakPolarHBondContact OH-CD 3.41Å; Y77-R99 WeakPolarHBondContact OH-CG 3.15Å; Y77-R99 PolarHBondContact OH-NH1 2.85Å
78	D	95.8	Very high	92.7	Very high	77 Å²	77	58.2 Å²	58.2	41%	0.412	27%	0.267	S	S	.	.	H	α-helix	trans	-63.2	-41.9	-178.5	-61.8	-25.6	0	0	0	111	N74 I80 E81 Q82	N74-D78 PolarHBondContact O-N 3.36Å; D78-I80 PolarHBondContact O-N 3.49Å; D78-E81 PolarHBondContact O-N 3.26Å; D78-Q82 WeakPolarHBondContact O-CB 3.24Å; D78-Q82 WeakPolarHBondContact O-CG 3.37Å; D78-Q82 PolarHBondContact O-N 3.08Å
79	F	95	Very high	92.5	Very high	41 Å²	41	58.6 Å²	58.6	18%	0.18	27%	0.27	C	S	.	.	H	α-helix	trans	-60	-45.4	175.9	-179.4	-89.5	0	0	0	112.6	V61 A62 S65 E75 Y77 Q82 T83	V61-F79 HydrophobicContact CB-CE1 4.43Å; V61-F79 HydrophobicContact CG1-CE1 3.9Å; V61-F79 HydrophobicContact CG1-CZ 3.91Å; A62-F79 VanDerWaalsContact CA-CD1 3.44Å; A62-F79 VanDerWaalsContact CA-CE1 3.44Å; A62-F79 HydrophobicContact CB-CB 4.12Å; A62-F79 HydrophobicContact CB-CD1 3.28Å; A62-F79 HydrophobicContact CB-CE1 3.8Å; A62-F79 HydrophobicContact CB-CG 3.73Å; S65-F79 WeakPolarHBondContact OG-CD2 3.37Å; S65-F79 WeakPolarHBondContact OG-CE2 3.45Å; E75-F79 WeakPolarHBondContact O-CB 3.18Å; E75-F79 PolarHBondContact O-N 3.06Å; Y77-F79 VanDerWaalsContact C-N 3.34Å; Y77-F79 PolarHBondContact O-N 3.26Å; F79-Q82 PolarHBondContact O-N 3.48Å; F79-T83 VanDerWaalsContact O-CB 3.3Å; F79-T83 WeakPolarHBondContact O-CB 3.43Å; F79-T83 PolarHBondContact O-N 3.24Å; F79-T83 PolarHBondContact O-OG1 3.33Å
80	I	92.9	Very high	92.2	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-66.5	-44.1	-179.7	-67.6	170.8	0	0	0	110.5	L58 I76 Y77 D78 Q82 T83 F84 Y87 W94 V98	L58-I80 HydrophobicContact CB-CD1 4.1Å; L58-I80 HydrophobicContact CB-CG1 4.38Å; I76-I80 HydrophobicContact CG2-CD1 3.91Å; I76-I80 VanDerWaalsContact O-CG1 3.32Å; I76-I80 WeakPolarHBondContact O-CG1 3.41Å; I76-I80 PolarHBondContact O-N 3.04Å; I76-I80 VanDerWaalsContact O-N 3.12Å; Y77-I80 PolarHBondContact O-N 3.22Å; D78-I80 PolarHBondContact O-N 3.49Å; I80-Q82 VanDerWaalsContact C-N 3.32Å; I80-Q82 PolarHBondContact O-N 3.3Å; I80-T83 PolarHBondContact O-N 3.08Å; I80-F84 HydrophobicContact CG2-CD2 4.44Å; I80-F84 PolarHBondContact O-N 3.43Å; I80-Y87 HydrophobicContact CG2-CD2 3.52Å; I80-Y87 HydrophobicContact CG2-CE2 4.12Å; I80-Y87 HydrophobicContact CG2-CG 3.91Å; I80-W94 HydrophobicContact CB-CZ3 4.34Å; I80-W94 HydrophobicContact CD1-CZ3 4.26Å; I80-W94 HydrophobicContact CG2-CZ3 4.26Å; I80-V98 HydrophobicContact CD1-CG2 4.06Å
81	E	92.2	Very high	92	Very high	16 Å²	16	61.4 Å²	61.4	8%	0.075	28%	0.284	C	S	.	.	H	α-helix	trans	-64.7	-34.5	177.7	-74.7	-175.4	-159.6	0	0	112.6	Y77 D78 R88 R91 W94 R95	Y77-E81 PolarHBondContact O-N 2.86Å; D78-E81 PolarHBondContact O-N 3.26Å; E81-R88 HydrophobicContact CB-CG 4.07Å; E81-R88 HydrophobicContact CG-CG 4.27Å; E81-R88 PolarHBondContact O-NE 2.94Å; E81-R88 PolarHBondContact O-NH2 2.94Å; E81-R88 VanDerWaalsContact O-NH2 3.1Å; E81-R91 IonicContact OE1-NE 3.17Å; E81-R91 PolarHBondContact OE1-NE 2.83Å; E81-R91 IonicContact OE2-CZ 3.17Å; E81-R91 IonicContact OE2-NE 3.72Å; E81-R91 PolarHBondContact OE2-NE 2.69Å; E81-R91 IonicContact OE2-NH2 3.64Å; E81-R91 PolarHBondContact OE2-NH2 3.19Å; E81-W94 HydrophobicContact CG-CH2 4.03Å; E81-W94 HydrophobicContact CG-CZ2 3.7Å; E81-W94 VanDerWaalsContact OE1-CZ2 3.31Å; E81-W94 WeakPolarHBondContact OE1-CZ2 3.03Å; E81-R95 IonicContact OE1-CZ 3.41Å; E81-R95 IonicContact OE1-NE 3.51Å; E81-R95 IonicContact OE1-NH2 3.27Å; E81-R95 PolarHBondContact OE1-NH2 3.41Å
82	Q	90.6	Very high	91.8	Very high	139 Å²	139	66.5 Å²	66.5	65%	0.65	32%	0.315	S	S	*	.	H	α-helix	trans	-73.9	-42.3	177.5	-72.7	171.7	17.6	0	0	111.9	D78 F79 I80	D78-Q82 WeakPolarHBondContact O-CB 3.24Å; D78-Q82 WeakPolarHBondContact O-CG 3.37Å; D78-Q82 PolarHBondContact O-N 3.08Å; F79-Q82 PolarHBondContact O-N 3.48Å; I80-Q82 VanDerWaalsContact C-N 3.32Å; I80-Q82 PolarHBondContact O-N 3.3Å
83	T	88.9	Confident	91.6	Very high	54 Å²	54	69 Å²	69	33%	0.331	33%	0.331	S	S	.	.	H	α-helix	trans	-78.5	-36.4	-176.2	-51.9	0	0	0	0	112.4	F79 I80	F79-T83 VanDerWaalsContact O-CB 3.3Å; F79-T83 WeakPolarHBondContact O-CB 3.43Å; F79-T83 PolarHBondContact O-N 3.24Å; F79-T83 PolarHBondContact O-OG1 3.33Å; I80-T83 PolarHBondContact O-N 3.08Å
84	F	89.2	Confident	91.5	Very high	21 Å²	21	67.1 Å²	67.1	9%	0.092	32%	0.321	C	S	.	.			trans	-130	88.7	-174.2	-53.8	-73	0	0	0	110.2	L40 P51 L53 L58 I80 Y86 Y87	L40-F84 HydrophobicContact CD2-CE1 4.16Å; L40-F84 HydrophobicContact CD2-CZ 3.63Å; P51-F84 HydrophobicContact CB-CD1 4.03Å; P51-F84 HydrophobicContact CB-CE1 4.1Å; P51-F84 HydrophobicContact CG-CB 3.88Å; P51-F84 HydrophobicContact CG-CD1 3.27Å; P51-F84 HydrophobicContact CG-CE1 3.85Å; P51-F84 HydrophobicContact CG-CG 3.65Å; L53-F84 HydrophobicContact CD1-CE1 4.19Å; L53-F84 HydrophobicContact CD1-CZ 3.7Å; L58-F84 HydrophobicContact CD2-CD2 3.63Å; L58-F84 HydrophobicContact CD2-CE2 3.22Å; L58-F84 HydrophobicContact CD2-CG 4.45Å; L58-F84 HydrophobicContact CD2-CZ 3.74Å; I80-F84 HydrophobicContact CG2-CD2 4.44Å; I80-F84 PolarHBondContact O-N 3.43Å; F84-Y86 PolarHBondContact O-N 2.78Å; F84-Y87 HydrophobicContact CB-CD2 3.78Å; F84-Y87 HydrophobicContact CB-CE2 4.11Å; F84-Y87 PolarHBondContact O-N 3.22Å; F84-Y87 VanDerWaalsContact O-N 3.09Å
85	P	88.4	Confident	91.6	Very high	34 Å²	34	64.9 Å²	64.9	22%	0.221	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-53.6	-27.4	-175.7	-28.6	35.7	0	0	0	115	Y87 R88	P85-Y87 PolarHBondContact O-N 3.09Å; P85-R88 WeakPolarHBondContact O-CB 3.41Å; P85-R88 WeakPolarHBondContact O-CG 3.42Å; P85-R88 PolarHBondContact O-N 3.14Å
86	Y	88.8	Confident	91.6	Very high	91 Å²	91	65.5 Å²	65.5	36%	0.357	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-43.6	-38.8	172.3	174.4	-100.8	0	0	0	113.8	D48 R50 F84 R88	D48-Y86 WeakPolarHBondContact O-CD2 2.99Å; R50-Y86 HydrophobicContact CB-CD1 3.97Å; R50-Y86 HydrophobicContact CB-CD2 4.14Å; R50-Y86 HydrophobicContact CB-CE1 3.67Å; R50-Y86 HydrophobicContact CB-CE2 3.85Å; R50-Y86 HydrophobicContact CB-CG 4.2Å; R50-Y86 HydrophobicContact CG-CD1 4.03Å; R50-Y86 HydrophobicContact CG-CE1 3.57Å; F84-Y86 PolarHBondContact O-N 2.78Å; Y86-R88 VanDerWaalsContact C-N 3.33Å; Y86-R88 PolarHBondContact O-N 2.73Å
87	Y	90.2	Very high	91.6	Very high	7 Å²	7	67.2 Å²	67.2	3%	0.027	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-80	-7	-175.5	-68.2	-71.4	0	0	0	114.7	P51 Y55 L58 I80 F84 P85 Y89 W94	P51-Y87 HydrophobicContact CG-CE2 4.1Å; Y55-Y87 HydrophobicContact CE1-CE1 4.2Å; L58-Y87 HydrophobicContact CD1-CE2 3.86Å; L58-Y87 WeakPolarHBondContact CD1-OH 3.46Å; I80-Y87 HydrophobicContact CG2-CD2 3.52Å; I80-Y87 HydrophobicContact CG2-CE2 4.12Å; I80-Y87 HydrophobicContact CG2-CG 3.91Å; F84-Y87 HydrophobicContact CB-CD2 3.78Å; F84-Y87 HydrophobicContact CB-CE2 4.11Å; F84-Y87 PolarHBondContact O-N 3.22Å; F84-Y87 VanDerWaalsContact O-N 3.09Å; P85-Y87 PolarHBondContact O-N 3.09Å; Y87-Y89 VanDerWaalsContact C-N 3.32Å; Y87-Y89 PolarHBondContact O-N 2.79Å; Y87-W94 HydrophobicContact CD1-CB 3.79Å; Y87-W94 AromaticContact CD1-CD1 3.7Å; Y87-W94 HydrophobicContact CD1-CD2 4.06Å; Y87-W94 AromaticContact CD1-CG 3.59Å; Y87-W94 HydrophobicContact CD1-CG 3.59Å; Y87-W94 HydrophobicContact CE1-CB 4.04Å; Y87-W94 HydrophobicContact CE1-CG 4.32Å; Y87-W94 HydrophobicContact CG-CD2 4.44Å; Y87-W94 HydrophobicContact CG-CG 4.37Å; Y87-W94 PolarHBondContact O-NE1 2.83Å
88	R	90.7	Very high	91.5	Very high	121 Å²	121	66.6 Å²	66.6	46%	0.457	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-66.9	-31.6	-178	-66.7	179.2	-173.9	179.2	2.9	113.2	E81 P85 Y86	E81-R88 HydrophobicContact CB-CG 4.07Å; E81-R88 HydrophobicContact CG-CG 4.27Å; E81-R88 PolarHBondContact O-NE 2.94Å; E81-R88 PolarHBondContact O-NH2 2.94Å; E81-R88 VanDerWaalsContact O-NH2 3.1Å; P85-R88 WeakPolarHBondContact O-CB 3.41Å; P85-R88 WeakPolarHBondContact O-CG 3.42Å; P85-R88 PolarHBondContact O-N 3.14Å; Y86-R88 VanDerWaalsContact C-N 3.33Å; Y86-R88 PolarHBondContact O-N 2.73Å
89	Y	86.5	Confident	91.6	Very high	192 Å²	192	67.9 Å²	67.9	75%	0.753	32%	0.319	S	S	*	.	S	Bend	trans	-79	-29.4	-171	-57.2	-73.9	0	0	0	114.7	Y87	Y87-Y89 VanDerWaalsContact C-N 3.32Å; Y87-Y89 PolarHBondContact O-N 2.79Å
90	S	85.1	Confident	91.6	Very high	59 Å²	59	71.1 Å²	71.1	41%	0.413	34%	0.335	S	S	.	.			trans	-125.2	59.3	-173.7	-169	0	0	0	0	113	V92 N93 W94	S90-V92 VanDerWaalsContact C-N 3.29Å; S90-V92 PolarHBondContact O-N 2.67Å; S90-V92 VanDerWaalsContact O-N 3.14Å; S90-N93 PolarHBondContact O-N 3.45Å; S90-W94 PolarHBondContact O-NE1 3.35Å
91	R	88.7	Confident	91.8	Very high	129 Å²	129	72.2 Å²	72.2	49%	0.487	34%	0.341	S	S	.	.	H	α-helix	trans	-51.5	-39.2	-172.9	-72.2	179.7	170	162.2	2.9	114.9	E81 R95	E81-R91 IonicContact OE1-NE 3.17Å; E81-R91 PolarHBondContact OE1-NE 2.83Å; E81-R91 IonicContact OE2-CZ 3.17Å; E81-R91 IonicContact OE2-NE 3.72Å; E81-R91 PolarHBondContact OE2-NE 2.69Å; E81-R91 IonicContact OE2-NH2 3.64Å; E81-R91 PolarHBondContact OE2-NH2 3.19Å; R91-R95 WeakPolarHBondContact O-CB 3.49Å; R91-R95 WeakPolarHBondContact O-CD 3.33Å; R91-R95 WeakPolarHBondContact O-CG 3.42Å; R91-R95 PolarHBondContact O-N 2.78Å
92	V	90.9	Very high	91.9	Very high	115 Å²	115	71.5 Å²	71.5	70%	0.697	34%	0.337	S	S	*	.	H	α-helix	trans	-67	-48.1	-171.3	-178.8	0	0	0	0	112.1	S90 N96	S90-V92 VanDerWaalsContact C-N 3.29Å; S90-V92 PolarHBondContact O-N 2.67Å; S90-V92 VanDerWaalsContact O-N 3.14Å; V92-N96 PolarHBondContact O-N 2.83Å; V92-N96 VanDerWaalsContact O-N 3.15Å
93	N	90.2	Very high	92	Very high	112 Å²	112	69.5 Å²	69.5	60%	0.599	34%	0.338	S	S	*	.	H	α-helix	trans	-69.1	-53.3	-168.4	-70.9	-16.1	0	0	0	112.4	S90 N96 S97	S90-N93 PolarHBondContact O-N 3.45Å; N93-N96 WeakPolarHBondContact O-CB 3.34Å; N93-N96 PolarHBondContact O-N 3.17Å; N93-S97 PolarHBondContact O-N 2.78Å; N93-S97 VanDerWaalsContact O-N 3.15Å; N93-S97 PolarHBondContact O-OG 2.79Å
94	W	93.8	Very high	92.2	Very high	7 Å²	7	70.4 Å²	70.4	3%	0.027	34%	0.341	C	S	.	.	H	α-helix	trans	-73.2	-32.5	-178.1	68.7	-101.1	0	0	0	112.1	Y55 Y77 I80 E81 Y87 S90 N96 S97 V98	Y55-W94 HydrophobicContact CE1-CB 4.02Å; Y77-W94 AromaticContact CD1-CH2 3.97Å; Y77-W94 HydrophobicContact CD1-CH2 3.97Å; Y77-W94 AromaticContact CD1-CZ3 3.69Å; Y77-W94 HydrophobicContact CD1-CZ3 3.69Å; Y77-W94 HydrophobicContact CE1-CZ3 4.42Å; Y77-W94 HydrophobicContact CG-CH2 4.21Å; Y77-W94 HydrophobicContact CG-CZ3 4.39Å; I80-W94 HydrophobicContact CB-CZ3 4.34Å; I80-W94 HydrophobicContact CD1-CZ3 4.26Å; I80-W94 HydrophobicContact CG2-CZ3 4.26Å; E81-W94 HydrophobicContact CG-CH2 4.03Å; E81-W94 HydrophobicContact CG-CZ2 3.7Å; E81-W94 VanDerWaalsContact OE1-CZ2 3.31Å; E81-W94 WeakPolarHBondContact OE1-CZ2 3.03Å; Y87-W94 HydrophobicContact CD1-CB 3.79Å; Y87-W94 AromaticContact CD1-CD1 3.7Å; Y87-W94 HydrophobicContact CD1-CD2 4.06Å; Y87-W94 AromaticContact CD1-CG 3.59Å; Y87-W94 HydrophobicContact CD1-CG 3.59Å; Y87-W94 HydrophobicContact CE1-CB 4.04Å; Y87-W94 HydrophobicContact CE1-CG 4.32Å; Y87-W94 HydrophobicContact CG-CD2 4.44Å; Y87-W94 HydrophobicContact CG-CG 4.37Å; Y87-W94 PolarHBondContact O-NE1 2.83Å; S90-W94 PolarHBondContact O-NE1 3.35Å; W94-N96 PolarHBondContact O-N 2.81Å; W94-S97 CarbonylContact O-C 3.53Å; W94-S97 WeakPolarHBondContact O-CB 3.44Å; W94-S97 PolarHBondContact O-N 3.24Å; W94-S97 VanDerWaalsContact O-N 3.13Å; W94-V98 HydrophobicContact CE3-CG2 3.85Å; W94-V98 HydrophobicContact CZ3-CG2 4.18Å; W94-V98 WeakPolarHBondContact O-CG2 3.25Å; W94-V98 PolarHBondContact O-N 2.99Å
95	R	96.6	Very high	92.2	Very high	58 Å²	58	70.5 Å²	70.5	22%	0.219	34%	0.342	C	S	.	.	H	α-helix	trans	-62.3	-37.4	175.1	-71.7	177.6	-176.4	-165.5	-4.4	110.3	Y77 E81 R91 V98 R99	Y77-R95 HydrophobicContact CD1-CB 4.33Å; Y77-R95 HydrophobicContact CD1-CG 3.76Å; Y77-R95 HydrophobicContact CD2-CG 4.31Å; Y77-R95 HydrophobicContact CE1-CB 3.8Å; Y77-R95 HydrophobicContact CE1-CG 3.75Å; Y77-R95 HydrophobicContact CE2-CG 4.32Å; Y77-R95 HydrophobicContact CG-CG 4.03Å; E81-R95 IonicContact OE1-CZ 3.41Å; E81-R95 IonicContact OE1-NE 3.51Å; E81-R95 IonicContact OE1-NH2 3.27Å; E81-R95 PolarHBondContact OE1-NH2 3.41Å; R91-R95 WeakPolarHBondContact O-CB 3.49Å; R91-R95 WeakPolarHBondContact O-CD 3.33Å; R91-R95 WeakPolarHBondContact O-CG 3.42Å; R91-R95 PolarHBondContact O-N 2.78Å; R95-V98 PolarHBondContact O-N 3.42Å; R95-R99 WeakPolarHBondContact O-CG 3.28Å; R95-R99 PolarHBondContact O-N 2.77Å
96	N	95.7	Very high	92.2	Very high	89 Å²	89	71.5 Å²	71.5	48%	0.476	35%	0.346	S	S	.	.	H	α-helix	trans	-63.2	-46	172.8	-167.1	39.3	0	0	0	111.9	V92 N93 W94 V98 R99 H100	V92-N96 PolarHBondContact O-N 2.83Å; V92-N96 VanDerWaalsContact O-N 3.15Å; N93-N96 WeakPolarHBondContact O-CB 3.34Å; N93-N96 PolarHBondContact O-N 3.17Å; W94-N96 PolarHBondContact O-N 2.81Å; N96-V98 VanDerWaalsContact C-N 3.27Å; N96-V98 PolarHBondContact O-N 3.27Å; N96-R99 PolarHBondContact O-N 2.68Å; N96-R99 PolarHBondContact OD1-NH2 2.69Å; N96-R99 VanDerWaalsContact OD1-NH2 3.13Å; N96-H100 WeakPolarHBondContact O-CB 3.4Å; N96-H100 PolarHBondContact O-N 3.45Å
97	S	95.8	Very high	92.3	Very high	35 Å²	35	67.3 Å²	67.3	25%	0.245	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-38	174.4	-55.1	0	0	0	0	112.5	N93 W94 H100 N101	N93-S97 PolarHBondContact O-N 2.78Å; N93-S97 VanDerWaalsContact O-N 3.15Å; N93-S97 PolarHBondContact O-OG 2.79Å; W94-S97 CarbonylContact O-C 3.53Å; W94-S97 WeakPolarHBondContact O-CB 3.44Å; W94-S97 PolarHBondContact O-N 3.24Å; W94-S97 VanDerWaalsContact O-N 3.13Å; S97-H100 PolarHBondContact O-N 2.88Å; S97-N101 WeakPolarHBondContact O-CB 3.22Å; S97-N101 PolarHBondContact O-N 3.17Å; S97-N101 PolarHBondContact O-ND2 2.89Å
98	V	95.8	Very high	92.4	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-48.3	174.8	168.3	0	0	0	0	111	Y55 I59 I76 Y77 I80 W94 R95 N96 H100 N101 L102	Y55-V98 HydrophobicContact CD1-CG2 4.18Å; I59-V98 HydrophobicContact CD1-CG1 4.11Å; I59-V98 HydrophobicContact CG1-CG1 4.16Å; I76-V98 HydrophobicContact CG2-CG1 4.09Å; Y77-V98 HydrophobicContact CD1-CG1 4.37Å; Y77-V98 HydrophobicContact CE1-CB 4.16Å; Y77-V98 HydrophobicContact CE1-CG1 3.89Å; I80-V98 HydrophobicContact CD1-CG2 4.06Å; W94-V98 HydrophobicContact CE3-CG2 3.85Å; W94-V98 HydrophobicContact CZ3-CG2 4.18Å; W94-V98 WeakPolarHBondContact O-CG2 3.25Å; W94-V98 PolarHBondContact O-N 2.99Å; R95-V98 PolarHBondContact O-N 3.42Å; N96-V98 VanDerWaalsContact C-N 3.27Å; N96-V98 PolarHBondContact O-N 3.27Å; V98-H100 VanDerWaalsContact C-N 3.3Å; V98-H100 PolarHBondContact O-N 3.24Å; V98-N101 PolarHBondContact O-N 2.72Å; V98-L102 HydrophobicContact CG1-CD1 4.13Å; V98-L102 WeakPolarHBondContact O-CG 3.48Å; V98-L102 PolarHBondContact O-N 2.78Å
99	R	97.2	Very high	92.5	Very high	105 Å²	105	64.1 Å²	64.1	40%	0.396	32%	0.324	S	S	.	.	H	α-helix	trans	-57.5	-45.4	176.4	-66.6	-164.2	-66	-84.8	-2.2	112	I73 Y77 R95 N96 L102 S103	I73-R99 HydrophobicContact CD1-CG 3.58Å; Y77-R99 WeakPolarHBondContact OH-CD 3.41Å; Y77-R99 WeakPolarHBondContact OH-CG 3.15Å; Y77-R99 PolarHBondContact OH-NH1 2.85Å; R95-R99 WeakPolarHBondContact O-CG 3.28Å; R95-R99 PolarHBondContact O-N 2.77Å; N96-R99 PolarHBondContact O-N 2.68Å; N96-R99 PolarHBondContact OD1-NH2 2.69Å; N96-R99 VanDerWaalsContact OD1-NH2 3.13Å; R99-L102 PolarHBondContact O-N 2.96Å; R99-S103 PolarHBondContact O-N 3.45Å
100	H	95.7	Very high	92.8	Very high	108 Å²	108	60.1 Å²	60.1	50%	0.5	31%	0.31	S	S	.	.	H	α-helix	trans	-60.5	-45.1	176.9	170	69.2	0	0	0	111.7	N96 S97 V98 L102 S103 L104	N96-H100 WeakPolarHBondContact O-CB 3.4Å; N96-H100 PolarHBondContact O-N 3.45Å; S97-H100 PolarHBondContact O-N 2.88Å; V98-H100 VanDerWaalsContact C-N 3.3Å; V98-H100 PolarHBondContact O-N 3.24Å; H100-L102 PolarHBondContact O-N 3.48Å; H100-S103 PolarHBondContact O-N 2.88Å; H100-L104 WeakPolarHBondContact CE1-CD1 3.3Å; H100-L104 VanDerWaalsContact NE2-CD1 3.35Å; H100-L104 WeakPolarHBondContact NE2-CD1 3.4Å; H100-L104 WeakPolarHBondContact O-CB 3.4Å; H100-L104 PolarHBondContact O-N 3.19Å
101	N	95.6	Very high	93.1	Very high	25 Å²	25	59.7 Å²	59.7	13%	0.134	31%	0.305	C	S	.	.	H	α-helix	trans	-66.9	-35.6	179.9	-85.8	-90.1	0	0	0	113.3	V56 I59 S97 V98 S103 L104 N105	V56-N101 WeakPolarHBondContact CG2-OD1 3.38Å; I59-N101 HydrophobicContact CD1-CB 3.88Å; S97-N101 WeakPolarHBondContact O-CB 3.22Å; S97-N101 PolarHBondContact O-N 3.17Å; S97-N101 PolarHBondContact O-ND2 2.89Å; V98-N101 PolarHBondContact O-N 2.72Å; N101-S103 VanDerWaalsContact C-N 3.31Å; N101-S103 PolarHBondContact O-N 2.7Å; N101-L104 PolarHBondContact O-N 2.91Å; N101-N105 PolarHBondContact O-N 3.23Å; N101-N105 PolarHBondContact O-ND2 3.33Å; N101-N105 PolarHBondContact OD1-ND2 2.86Å
102	L	94.7	Very high	92.9	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-61.1	-40.9	175.5	-74.4	169.8	0	0	0	111.6	I59 I73 I76 V98 R99 H100 F108 W125	I59-L102 HydrophobicContact CD1-CD2 4.18Å; I59-L102 HydrophobicContact CD1-CG 4.13Å; I59-L102 HydrophobicContact CG2-CD2 3.73Å; I73-L102 HydrophobicContact CD1-CD1 4.06Å; I73-L102 HydrophobicContact CG1-CD1 3.97Å; I76-L102 HydrophobicContact CD1-CD1 4.23Å; I76-L102 HydrophobicContact CD1-CD2 4.19Å; V98-L102 HydrophobicContact CG1-CD1 4.13Å; V98-L102 WeakPolarHBondContact O-CG 3.48Å; V98-L102 PolarHBondContact O-N 2.78Å; R99-L102 PolarHBondContact O-N 2.96Å; H100-L102 PolarHBondContact O-N 3.48Å; L102-F108 HydrophobicContact CD2-CB 4.08Å; L102-F108 HydrophobicContact CD2-CD1 4.45Å; L102-F108 HydrophobicContact CD2-CD2 4.24Å; L102-F108 HydrophobicContact CD2-CG 4Å; L102-W125 HydrophobicContact CB-CD2 4.14Å; L102-W125 HydrophobicContact CB-CE3 4.05Å; L102-W125 HydrophobicContact CB-CH2 3.84Å; L102-W125 HydrophobicContact CB-CZ2 3.95Å; L102-W125 HydrophobicContact CB-CZ3 3.9Å; L102-W125 HydrophobicContact CD1-CD2 4.18Å; L102-W125 HydrophobicContact CD1-CG 4.24Å; L102-W125 HydrophobicContact CD2-CB 4.16Å; L102-W125 HydrophobicContact CD2-CD2 3.86Å; L102-W125 HydrophobicContact CD2-CE3 3.95Å; L102-W125 HydrophobicContact CD2-CG 3.95Å; L102-W125 HydrophobicContact CG-CD2 4.28Å; L102-W125 HydrophobicContact CG-CE3 4.5Å; L102-W125 WeakPolarHBondContact O-CZ3 3.49Å
103	S	93.9	Very high	92.1	Very high	96 Å²	96	56.7 Å²	56.7	67%	0.671	30%	0.301	S	S	*	.	H	α-helix	trans	-84.9	-26.1	179.1	-57.2	0	0	0	0	114	R99 H100 N101	R99-S103 PolarHBondContact O-N 3.45Å; H100-S103 PolarHBondContact O-N 2.88Å; N101-S103 VanDerWaalsContact C-N 3.31Å; N101-S103 PolarHBondContact O-N 2.7Å
104	L	91.6	Very high	90.9	Very high	74 Å²	74	54.8 Å²	54.8	39%	0.387	31%	0.308	S	S	.	.	H	α-helix	trans	-80.2	-33.4	-175.9	179	144.7	0	0	0	113.2	H100 N101	H100-L104 WeakPolarHBondContact CE1-CD1 3.3Å; H100-L104 VanDerWaalsContact NE2-CD1 3.35Å; H100-L104 WeakPolarHBondContact NE2-CD1 3.4Å; H100-L104 WeakPolarHBondContact O-CB 3.4Å; H100-L104 PolarHBondContact O-N 3.19Å; N101-L104 PolarHBondContact O-N 2.91Å
105	N	91.1	Very high	89.2	Confident	22 Å²	22	58.7 Å²	58.7	12%	0.118	33%	0.333	C	S	.	.			trans	-102.7	121.7	-173.1	-60.8	-85.1	0	0	0	111	N101 C107 F108	N101-N105 PolarHBondContact O-N 3.23Å; N101-N105 PolarHBondContact O-ND2 3.33Å; N101-N105 PolarHBondContact OD1-ND2 2.86Å; N105-C107 VanDerWaalsContact CB-SG 3.6Å; N105-C107 PolarHBondContact O-N 3.37Å; N105-F108 HydrophobicContact CB-CD2 4.04Å; N105-F108 HydrophobicContact CB-CE2 4.28Å; N105-F108 PolarHBondContact O-N 3.08Å
106	D	87	Confident	87.4	Confident	56 Å²	56	63.8 Å²	63.8	30%	0.299	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-11.9	178.4	-64.2	-19.3	0	0	0	113.9	F108 F147 K149	D106-F108 PolarHBondContact O-N 3.4Å; D106-F147 HydrophobicContact CB-CD1 3.86Å; D106-F147 HydrophobicContact CB-CE1 4.15Å; D106-K149 HydrophobicContact CB-CB 4.24Å
107	C	90.5	Very high	85.6	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.02	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-19.1	175	62.1	0	0	0	0	112.6	N105 L127 H128 F147	N105-C107 VanDerWaalsContact CB-SG 3.6Å; N105-C107 PolarHBondContact O-N 3.37Å; C107-L127 CarbonylContact O-C 3.58Å; C107-L127 WeakPolarHBondContact O-CA 3.17Å; C107-H128 PolarHBondContact O-N 3.46Å; C107-F147 HydrophobicContact CB-CB 4.15Å; C107-F147 HydrophobicContact CB-CD1 3.89Å; C107-F147 HydrophobicContact CB-CG 4.16Å
108	F	93.3	Very high	83.9	Confident	10 Å²	10	70.2 Å²	70.2	4%	0.044	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	114.3	177.2	-57.3	-55.6	0	0	0	109.7	V56 I59 L63 L102 N105 D106 W125 T126 L127	V56-F108 HydrophobicContact CB-CE2 4.44Å; V56-F108 HydrophobicContact CB-CZ 4.43Å; V56-F108 HydrophobicContact CG1-CE2 4.04Å; V56-F108 HydrophobicContact CG1-CZ 3.83Å; V56-F108 HydrophobicContact CG2-CE2 4.42Å; I59-F108 HydrophobicContact CB-CE1 3.99Å; I59-F108 HydrophobicContact CB-CE2 4.32Å; I59-F108 HydrophobicContact CB-CZ 3.68Å; I59-F108 HydrophobicContact CD1-CE2 4.05Å; I59-F108 HydrophobicContact CD1-CZ 4.27Å; I59-F108 HydrophobicContact CG2-CD1 3.85Å; I59-F108 HydrophobicContact CG2-CE1 3.37Å; I59-F108 HydrophobicContact CG2-CE2 4.16Å; I59-F108 HydrophobicContact CG2-CG 4.44Å; I59-F108 HydrophobicContact CG2-CZ 3.54Å; L63-F108 HydrophobicContact CD1-CD1 3.78Å; L63-F108 HydrophobicContact CD1-CE1 3.9Å; L102-F108 HydrophobicContact CD2-CB 4.08Å; L102-F108 HydrophobicContact CD2-CD1 4.45Å; L102-F108 HydrophobicContact CD2-CD2 4.24Å; L102-F108 HydrophobicContact CD2-CG 4Å; N105-F108 HydrophobicContact CB-CD2 4.04Å; N105-F108 HydrophobicContact CB-CE2 4.28Å; N105-F108 PolarHBondContact O-N 3.08Å; D106-F108 PolarHBondContact O-N 3.4Å; F108-W125 HydrophobicContact CB-CE3 4.08Å; F108-W125 HydrophobicContact CB-CZ3 4.36Å; F108-T126 CarbonylContact C-O 3.58Å; F108-T126 WeakPolarHBondContact CA-O 3.14Å; F108-L127 HydrophobicContact CD1-CD1 4.14Å; F108-L127 HydrophobicContact CE1-CD1 3.78Å
109	V	92.5	Very high	82.2	Confident	51 Å²	51	78.1 Å²	78.1	31%	0.309	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.5	-177.1	-178.1	0	0	0	0	109.4	W125 T126 H128	V109-W125 WeakPolarHBondContact O-CA 3.43Å; V109-T126 HydrophobicContact CB-CG2 3.91Å; V109-T126 PolarHBondContact N-O 3.45Å; V109-T126 PolarHBondContact O-N 3.41Å; V109-H128 HydrophobicContact CG2-CB 3.92Å
110	K	94	Very high	80.4	Confident	108 Å²	108	85.1 Å²	85.1	47%	0.47	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115	175	-175.8	-174.9	-179.8	-175.9	0	109.5	H123 W125	K110-H123 HydrophobicContact CD-CB 4.36Å; K110-H123 WeakPolarHBondContact CE-CD2 3.5Å; K110-H123 WeakPolarHBondContact CE-ND1 3.31Å; K110-H123 WeakPolarHBondContact CE-NE2 3.18Å; K110-H123 HydrophobicContact CG-CB 3.78Å; K110-H123 PolarHBondContact NZ-CD2 3Å; K110-H123 VanDerWaalsContact NZ-CD2 3.26Å; K110-H123 PolarHBondContact NZ-NE2 3.38Å; K110-W125 HydrophobicContact CB-CE3 4.31Å; K110-W125 HydrophobicContact CB-CH2 4.21Å; K110-W125 HydrophobicContact CB-CZ3 4.03Å
111	V	90.8	Very high	79	Confident	49 Å²	49	89.3 Å²	89.3	30%	0.297	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	117.3	177	-176.8	0	0	0	0	109.2	Y124 T126	V111-Y124 PolarHBondContact N-O 3.17Å; V111-Y124 PolarHBondContact O-N 3.07Å; V111-T126 HydrophobicContact CG2-CG2 3.56Å
112	T	84.7	Confident	78.1	Confident	101 Å²	101	90.1 Å²	90.1	62%	0.62	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-81.1	121.3	170.1	45.2	0	0	0	0	108.7
113	V	73.2	Confident	77.9	Confident	80 Å²	80	93.9 Å²	93.9	49%	0.485	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-85.5	127.3	170.1	175.9	0	0	0	0	107.2	T115 Y124	V113-T115 PolarHBondContact O-N 3.26Å; V113-Y124 HydrophobicContact CB-CD2 4.5Å; V113-Y124 HydrophobicContact CB-CE2 4.48Å; V113-Y124 HydrophobicContact CG2-CD2 3.39Å; V113-Y124 HydrophobicContact CG2-CE2 3.57Å; V113-Y124 HydrophobicContact CG2-CG 4.47Å
114	G	65	Low	77.9	Confident	72 Å²	72	91.7 Å²	91.7	74%	0.742	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-48	124.9	174.7	0	0	0	0	0	109.8	E116	G114-E116 PolarHBondContact O-N 3.12Å; G114-E116 VanDerWaalsContact O-N 3.11Å
115	T	58.4	Low	78.1	Confident	90 Å²	90	89.6 Å²	89.6	55%	0.552	47%	0.47	S	S	*	.			trans	-81.3	95.1	-178.7	38.7	0	0	0	0	108.6	V113 K117 K119	V113-T115 PolarHBondContact O-N 3.26Å; T115-K117 PolarHBondContact O-N 3.18Å; T115-K117 VanDerWaalsContact O-N 3.16Å; T115-K119 WeakPolarHBondContact CG2-O 3.48Å
116	E	58.7	Low	78.2	Confident	164 Å²	164	89.7 Å²	89.7	77%	0.766	47%	0.472	S	S	*	.	S	Bend	trans	-68.8	108.6	159.3	-155.1	-169.1	158.8	0	0	106.9	G114	G114-E116 PolarHBondContact O-N 3.12Å; G114-E116 VanDerWaalsContact O-N 3.11Å
117	K	59.1	Low	78.4	Confident	176 Å²	176	87.1 Å²	87.1	77%	0.765	46%	0.458	S	S	*	.	S	Bend	trans	71.8	72.2	171.1	-57.1	171.9	-176	175.8	0	116.8	T115 K119	T115-K117 PolarHBondContact O-N 3.18Å; T115-K117 VanDerWaalsContact O-N 3.16Å; K117-K119 PolarHBondContact O-N 3.04Å
118	G	59.1	Low	78.4	Confident	84 Å²	84	88.1 Å²	88.1	87%	0.866	46%	0.462	S	S	*	.	S	Bend	trans	67	-9.1	146.4	0	0	0	0	0	119
119	K	59.4	Low	78	Confident	166 Å²	166	92 Å²	92	72%	0.722	49%	0.488	S	S	*	.			trans	-96.8	117.7	179.1	-158.5	165.9	-173.3	170.6	0	108.8	T115 K117 R121	T115-K119 WeakPolarHBondContact CG2-O 3.48Å; K117-K119 PolarHBondContact O-N 3.04Å; K119-R121 PolarHBondContact O-N 3.23Å
120	R	60.6	Low	77.4	Confident	252 Å²	252	93.4 Å²	93.4	95%	0.951	49%	0.494	S	S	*	.			trans	-63	73.7	171.4	-73	-176.3	170.8	147.8	-1.6	110.5	G122	R120-G122 PolarHBondContact O-N 3.06Å
121	R	66.2	Low	76.8	Confident	196 Å²	196	88.2 Å²	88.2	74%	0.74	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-71.1	116.1	171.6	-120.1	174.3	-179.2	155.9	-1.7	105.6	K119	K119-R121 PolarHBondContact O-N 3.23Å
122	G	77.2	Confident	76.2	Confident	42 Å²	42	89.1 Å²	89.1	43%	0.433	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-52.7	171.6	-173	0	0	0	0	0	114.7	R120	R120-G122 PolarHBondContact O-N 3.06Å
123	H	90.5	Very high	75.5	Confident	80 Å²	80	89 Å²	89	37%	0.37	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-82.6	151.6	-172.1	-44.4	-72.7	0	0	0	112.4	K110	K110-H123 HydrophobicContact CD-CB 4.36Å; K110-H123 WeakPolarHBondContact CE-CD2 3.5Å; K110-H123 WeakPolarHBondContact CE-ND1 3.31Å; K110-H123 WeakPolarHBondContact CE-NE2 3.18Å; K110-H123 HydrophobicContact CG-CB 3.78Å; K110-H123 PolarHBondContact NZ-CD2 3Å; K110-H123 VanDerWaalsContact NZ-CD2 3.26Å; K110-H123 PolarHBondContact NZ-NE2 3.38Å
124	Y	93.7	Very high	75.3	Confident	50 Å²	50	88.2 Å²	88.2	20%	0.196	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	149.8	168.3	-73.4	-97.4	0	0	0	109.6	M70 K72 V111 V113	M70-Y124 HydrophobicContact CB-CD1 4.44Å; M70-Y124 HydrophobicContact CG-CD1 4.08Å; M70-Y124 HydrophobicContact SD-CD1 4.35Å; K72-Y124 VanDerWaalsContact CE-CZ 3.44Å; K72-Y124 VanDerWaalsContact CE-OH 3.3Å; K72-Y124 WeakPolarHBondContact CE-OH 3.5Å; K72-Y124 HydrophobicContact CG-CD1 4.12Å; K72-Y124 HydrophobicContact CG-CE1 3.96Å; K72-Y124 HydrophobicContact CG-CE2 4.49Å; K72-Y124 HydrophobicContact CG-CG 4.46Å; K72-Y124 PolarHBondContact NZ-OH 3.36Å; V111-Y124 PolarHBondContact N-O 3.17Å; V111-Y124 PolarHBondContact O-N 3.07Å; V113-Y124 HydrophobicContact CB-CD2 4.5Å; V113-Y124 HydrophobicContact CB-CE2 4.48Å; V113-Y124 HydrophobicContact CG2-CD2 3.39Å; V113-Y124 HydrophobicContact CG2-CE2 3.57Å; V113-Y124 HydrophobicContact CG2-CG 4.47Å
125	W	95.5	Very high	75.4	Confident	30 Å²	30	85 Å²	85	11%	0.114	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.6	170.6	-68.4	94.5	0	0	0	108.3	L63 M70 L71 I76 L102 F108 V109 K110	L63-W125 WeakPolarHBondContact CD2-O 3.21Å; M70-W125 CarbonylContact C-O 3.49Å; M70-W125 WeakPolarHBondContact CA-O 3.34Å; L71-W125 PolarHBondContact N-O 2.95Å; L71-W125 PolarHBondContact O-N 3.17Å; I76-W125 HydrophobicContact CD1-CB 4.29Å; L102-W125 HydrophobicContact CB-CD2 4.14Å; L102-W125 HydrophobicContact CB-CE3 4.05Å; L102-W125 HydrophobicContact CB-CH2 3.84Å; L102-W125 HydrophobicContact CB-CZ2 3.95Å; L102-W125 HydrophobicContact CB-CZ3 3.9Å; L102-W125 HydrophobicContact CD1-CD2 4.18Å; L102-W125 HydrophobicContact CD1-CG 4.24Å; L102-W125 HydrophobicContact CD2-CB 4.16Å; L102-W125 HydrophobicContact CD2-CD2 3.86Å; L102-W125 HydrophobicContact CD2-CE3 3.95Å; L102-W125 HydrophobicContact CD2-CG 3.95Å; L102-W125 HydrophobicContact CG-CD2 4.28Å; L102-W125 HydrophobicContact CG-CE3 4.5Å; L102-W125 WeakPolarHBondContact O-CZ3 3.49Å; F108-W125 HydrophobicContact CB-CE3 4.08Å; F108-W125 HydrophobicContact CB-CZ3 4.36Å; V109-W125 WeakPolarHBondContact O-CA 3.43Å; K110-W125 HydrophobicContact CB-CE3 4.31Å; K110-W125 HydrophobicContact CB-CH2 4.21Å; K110-W125 HydrophobicContact CB-CZ3 4.03Å
126	T	93.8	Very high	75.6	Confident	23 Å²	23	85 Å²	85	14%	0.141	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	165.6	176.5	-172	0	0	0	0	109.8	K69 F108 V109 V111	K69-T126 PolarHBondContact O-OG1 3.11Å; F108-T126 CarbonylContact C-O 3.58Å; F108-T126 WeakPolarHBondContact CA-O 3.14Å; V109-T126 HydrophobicContact CB-CG2 3.91Å; V109-T126 PolarHBondContact N-O 3.45Å; V109-T126 PolarHBondContact O-N 3.41Å; V111-T126 HydrophobicContact CG2-CG2 3.56Å
127	L	91.3	Very high	75.3	Confident	3 Å²	3	85.9 Å²	85.9	2%	0.016	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	143.4	168.6	-136.1	92.5	0	0	0	110.2	T60 L63 C107 F108 S131 F132 F135	T60-L127 HydrophobicContact CG2-CD1 4Å; L63-L127 HydrophobicContact CD1-CD1 3.9Å; C107-L127 CarbonylContact O-C 3.58Å; C107-L127 WeakPolarHBondContact O-CA 3.17Å; F108-L127 HydrophobicContact CD1-CD1 4.14Å; F108-L127 HydrophobicContact CE1-CD1 3.78Å; L127-S131 WeakPolarHBondContact CD2-OG 3.21Å; L127-S131 VanDerWaalsContact CG-OG 3.29Å; L127-S131 WeakPolarHBondContact CG-OG 3.4Å; L127-F132 HydrophobicContact CB-CD1 4.35Å; L127-F132 HydrophobicContact CB-CD2 4.25Å; L127-F132 HydrophobicContact CB-CE1 3.87Å; L127-F132 HydrophobicContact CB-CE2 3.79Å; L127-F132 HydrophobicContact CB-CZ 3.58Å; L127-F132 HydrophobicContact CD2-CB 4.34Å; L127-F132 HydrophobicContact CD2-CD1 3.9Å; L127-F132 HydrophobicContact CD2-CD2 4.18Å; L127-F132 HydrophobicContact CD2-CE1 4.24Å; L127-F132 HydrophobicContact CD2-CG 3.87Å; L127-F132 WeakPolarHBondContact O-CE2 3.34Å; L127-F135 HydrophobicContact CD1-CE2 4.24Å; L127-F135 HydrophobicContact CD2-CD2 3.75Å; L127-F135 HydrophobicContact CD2-CE2 3.9Å; L127-F135 HydrophobicContact CG-CE2 4.48Å
128	H	89	Confident	75.1	Confident	23 Å²	23	78.7 Å²	78.7	11%	0.106	41%	0.405	C	S	.	.			trans	-64	138	171	-169.3	-79.9	0	0	0	109.9	C107 V109 D130 S131 F132 F147	C107-H128 PolarHBondContact O-N 3.46Å; V109-H128 HydrophobicContact CG2-CB 3.92Å; H128-D130 VanDerWaalsContact C-N 3.3Å; H128-D130 IonicContact CE1-OD2 2.69Å; H128-D130 PolarHBondContact CE1-OD2 2.8Å; H128-D130 PolarHBondContact ND1-N 2.94Å; H128-D130 VanDerWaalsContact ND1-N 3.19Å; H128-D130 IonicContact ND1-OD2 2.72Å; H128-D130 PolarHBondContact O-N 3.28Å; H128-S131 PolarHBondContact N-OG 3.12Å; H128-S131 WeakPolarHBondContact O-CA 3.36Å; H128-S131 WeakPolarHBondContact O-CB 3.32Å; H128-S131 PolarHBondContact O-N 2.97Å; H128-S131 PolarHBondContact O-OG 3.46Å; H128-F132 VanDerWaalsContact O-CD2 3.22Å; H128-F132 WeakPolarHBondContact O-CD2 3.43Å; H128-F132 PolarHBondContact O-N 3.3Å; H128-F147 HydrophobicContact CB-CE1 4.04Å; H128-F147 HydrophobicContact CB-CZ 4.17Å; H128-F147 AromaticContact CG-CE1 3.92Å; H128-F147 AromaticContact CG-CZ 3.81Å; H128-F147 AromaticContact ND1-CZ 3.58Å
129	P	85.4	Confident	75.2	Confident	91 Å²	91	77.1 Å²	77.1	59%	0.591	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-49.1	-47.5	-179.9	16.7	-30.9	0	0	0	113.2	S131 F132	P129-S131 PolarHBondContact O-N 3.13Å; P129-F132 WeakPolarHBondContact O-CD2 3.41Å; P129-F132 PolarHBondContact O-N 3.45Å
130	D	80.4	Confident	75.4	Confident	81 Å²	81	69.4 Å²	69.4	43%	0.433	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-69	-18.1	179.7	-53.8	-18	0	0	0	114.2	H128 T133 F147	H128-D130 VanDerWaalsContact C-N 3.3Å; H128-D130 IonicContact CE1-OD2 2.69Å; H128-D130 PolarHBondContact CE1-OD2 2.8Å; H128-D130 PolarHBondContact ND1-N 2.94Å; H128-D130 VanDerWaalsContact ND1-N 3.19Å; H128-D130 IonicContact ND1-OD2 2.72Å; H128-D130 PolarHBondContact O-N 3.28Å; D130-T133 PolarHBondContact O-OG1 2.95Å; D130-F147 HydrophobicContact CB-CE2 3.95Å; D130-F147 HydrophobicContact CB-CZ 4.08Å
131	S	81.5	Confident	75.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-88.9	-12.5	-178.3	74.1	0	0	0	0	113.2	L127 H128 P129 T133 M134 F135	L127-S131 WeakPolarHBondContact CD2-OG 3.21Å; L127-S131 VanDerWaalsContact CG-OG 3.29Å; L127-S131 WeakPolarHBondContact CG-OG 3.4Å; H128-S131 PolarHBondContact N-OG 3.12Å; H128-S131 WeakPolarHBondContact O-CA 3.36Å; H128-S131 WeakPolarHBondContact O-CB 3.32Å; H128-S131 PolarHBondContact O-N 2.97Å; H128-S131 PolarHBondContact O-OG 3.46Å; P129-S131 PolarHBondContact O-N 3.13Å; S131-T133 VanDerWaalsContact C-N 3.31Å; S131-T133 PolarHBondContact O-N 2.77Å; S131-M134 VanDerWaalsContact O-CB 3.28Å; S131-M134 WeakPolarHBondContact O-CB 3.3Å; S131-M134 PolarHBondContact O-N 2.92Å; S131-M134 VanDerWaalsContact O-N 3.13Å; S131-F135 VanDerWaalsContact O-CD2 3.23Å; S131-F135 WeakPolarHBondContact O-CD2 3.37Å
132	F	76.8	Confident	75.1	Confident	68 Å²	68	64.8 Å²	64.8	30%	0.298	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-40.5	179.6	-79.5	-87.3	0	0	0	111.9	L64 K69 L127 H128 P129 M134 F135 D136	L64-F132 HydrophobicContact CD2-CD1 3.89Å; L64-F132 HydrophobicContact CD2-CE1 3.92Å; K69-F132 HydrophobicContact CB-CE1 4.22Å; K69-F132 HydrophobicContact CB-CZ 4.19Å; K69-F132 HydrophobicContact CD-CE1 4.44Å; K69-F132 HydrophobicContact CG-CE1 4.26Å; L127-F132 HydrophobicContact CB-CD1 4.35Å; L127-F132 HydrophobicContact CB-CD2 4.25Å; L127-F132 HydrophobicContact CB-CE1 3.87Å; L127-F132 HydrophobicContact CB-CE2 3.79Å; L127-F132 HydrophobicContact CB-CZ 3.58Å; L127-F132 HydrophobicContact CD2-CB 4.34Å; L127-F132 HydrophobicContact CD2-CD1 3.9Å; L127-F132 HydrophobicContact CD2-CD2 4.18Å; L127-F132 HydrophobicContact CD2-CE1 4.24Å; L127-F132 HydrophobicContact CD2-CG 3.87Å; L127-F132 WeakPolarHBondContact O-CE2 3.34Å; H128-F132 VanDerWaalsContact O-CD2 3.22Å; H128-F132 WeakPolarHBondContact O-CD2 3.43Å; H128-F132 PolarHBondContact O-N 3.3Å; P129-F132 WeakPolarHBondContact O-CD2 3.41Å; P129-F132 PolarHBondContact O-N 3.45Å; F132-M134 PolarHBondContact O-N 3.27Å; F132-F135 PolarHBondContact O-N 3.22Å; F132-F135 VanDerWaalsContact O-N 3.12Å; F132-D136 PolarHBondContact O-N 3.44Å
133	T	71.5	Confident	74.5	Confident	97 Å²	97	66.8 Å²	66.8	60%	0.595	33%	0.332	S	S	*	.	H	α-helix	trans	-61.4	-26.1	178.8	58.3	0	0	0	0	112.5	D130 S131 F135 D136	D130-T133 PolarHBondContact O-OG1 2.95Å; S131-T133 VanDerWaalsContact C-N 3.31Å; S131-T133 PolarHBondContact O-N 2.77Å; T133-F135 PolarHBondContact O-N 3.16Å; T133-D136 PolarHBondContact O-N 2.92Å
134	M	68.7	Low	73.1	Confident	64 Å²	64	72.3 Å²	72.3	32%	0.315	36%	0.358	S	S	.	.	H	α-helix	trans	-69	-18.6	179.8	-56	-169.2	164.4	0	0	113.3	S131 F132 R143 F147	S131-M134 VanDerWaalsContact O-CB 3.28Å; S131-M134 WeakPolarHBondContact O-CB 3.3Å; S131-M134 PolarHBondContact O-N 2.92Å; S131-M134 VanDerWaalsContact O-N 3.13Å; F132-M134 PolarHBondContact O-N 3.27Å; M134-R143 PolarHBondContact SD-NH1 3.1Å; M134-R143 PolarHBondContact SD-NH2 2.92Å; M134-F147 HydrophobicContact CE-CD2 3.43Å; M134-F147 VanDerWaalsContact CE-CD2 3.43Å; M134-F147 HydrophobicContact CE-CE2 4.09Å; M134-F147 HydrophobicContact CE-CG 4.46Å; M134-F147 HydrophobicContact SD-CB 4.01Å; M134-F147 HydrophobicContact SD-CD2 3.63Å; M134-F147 HydrophobicContact SD-CG 4.23Å
135	F	67.4	Low	71.8	Confident	6 Å²	6	80 Å²	80	3%	0.026	39%	0.386	C	S	.	.	H	α-helix	trans	-115.6	-10.9	-178.6	-55.7	-79	0	0	0	112.9	V56 T60 L64 L127 S131 F132 T133 Q137 G138 L140	V56-F135 HydrophobicContact CG1-CE1 4.46Å; V56-F135 HydrophobicContact CG1-CZ 4.12Å; T60-F135 HydrophobicContact CG2-CB 3.81Å; T60-F135 HydrophobicContact CG2-CD1 3.58Å; T60-F135 HydrophobicContact CG2-CD2 3.56Å; T60-F135 HydrophobicContact CG2-CE1 3.91Å; T60-F135 HydrophobicContact CG2-CE2 3.9Å; T60-F135 HydrophobicContact CG2-CG 3.37Å; T60-F135 HydrophobicContact CG2-CZ 4.06Å; T60-F135 WeakPolarHBondContact OG1-CE1 3.34Å; T60-F135 WeakPolarHBondContact OG1-CZ 3.5Å; L64-F135 HydrophobicContact CD1-CB 4.29Å; L127-F135 HydrophobicContact CD1-CE2 4.24Å; L127-F135 HydrophobicContact CD2-CD2 3.75Å; L127-F135 HydrophobicContact CD2-CE2 3.9Å; L127-F135 HydrophobicContact CG-CE2 4.48Å; S131-F135 VanDerWaalsContact O-CD2 3.23Å; S131-F135 WeakPolarHBondContact O-CD2 3.37Å; F132-F135 PolarHBondContact O-N 3.22Å; F132-F135 VanDerWaalsContact O-N 3.12Å; T133-F135 PolarHBondContact O-N 3.16Å; F135-Q137 VanDerWaalsContact C-N 3.3Å; F135-Q137 PolarHBondContact O-N 3.09Å; F135-G138 PolarHBondContact O-N 3.38Å; F135-L140 HydrophobicContact CD1-CD2 4.47Å
136	D	61.5	Low	70.6	Confident	90 Å²	90	87.6 Å²	87.6	48%	0.481	42%	0.415	S	S	.	.	H	α-helix	trans	-70.3	-25	-177	-160	30.8	0	0	0	113.1	C32 F132 T133 G138	C32-D136 PolarHBondContact SG-OD1 3.02Å; F132-D136 PolarHBondContact O-N 3.44Å; T133-D136 PolarHBondContact O-N 2.92Å; D136-G138 PolarHBondContact O-N 3.29Å
137	Q	52.1	Low	69.4	Low	181 Å²	181	87.4 Å²	87.4	85%	0.846	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	9	175.7	-63	-173.6	-3	0	0	114	F135 S139	F135-Q137 VanDerWaalsContact C-N 3.3Å; F135-Q137 PolarHBondContact O-N 3.09Å; Q137-S139 PolarHBondContact O-N 3.44Å
138	G	55.2	Low	68.4	Low	25 Å²	25	92.1 Å²	92.1	26%	0.258	44%	0.441	S	S	.	.	S	Bend	trans	75.6	0.6	174.8	0	0	0	0	0	115.4	S39 F135 D136 L140	S39-G138 PolarHBondContact OG-O 2.94Å; F135-G138 PolarHBondContact O-N 3.38Å; D136-G138 PolarHBondContact O-N 3.29Å; G138-L140 VanDerWaalsContact C-N 3.3Å; G138-L140 PolarHBondContact O-N 2.95Å
139	S	62.1	Low	67.5	Low	52 Å²	52	94.3 Å²	94.3	36%	0.364	45%	0.45	S	S	.	.			trans	-76.2	83.7	170.9	-170.3	0	0	0	0	110.1	Q137 M141	Q137-S139 PolarHBondContact O-N 3.44Å; S139-M141 PolarHBondContact O-N 3.01Å
140	L	63.9	Low	66.5	Low	3 Å²	3	93.7 Å²	93.7	2%	0.016	45%	0.446	C	S	.	.			trans	-78.7	2.4	165.8	-63.4	175	0	0	0	111.8	L36 L53 S57 V61 F135 G138	L36-L140 HydrophobicContact CD2-CD1 4.04Å; L36-L140 HydrophobicContact CD2-CD2 4.31Å; L53-L140 HydrophobicContact CD2-CB 3.76Å; L53-L140 HydrophobicContact CD2-CD1 4.44Å; S57-L140 WeakPolarHBondContact CB-O 3.37Å; S57-L140 PolarHBondContact OG-O 3.44Å; V61-L140 HydrophobicContact CG2-CD1 3.78Å; V61-L140 HydrophobicContact CG2-CD2 3.9Å; F135-L140 HydrophobicContact CD1-CD2 4.47Å; G138-L140 VanDerWaalsContact C-N 3.3Å; G138-L140 PolarHBondContact O-N 2.95Å
141	M	60	Low	65.3	Low	144 Å²	144	92.9 Å²	92.9	71%	0.709	45%	0.447	S	S	*	.	S	Bend	trans	-68.6	150.6	177.1	-66.4	-154.3	-68.6	0	0	111.1	S139 R143	S139-M141 PolarHBondContact O-N 3.01Å; M141-R143 PolarHBondContact O-N 3.1Å; M141-R143 VanDerWaalsContact O-N 3.1Å
142	R	59.6	Low	63.8	Low	208 Å²	208	98.5 Å²	98.5	79%	0.785	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-58	117.9	178	-174.7	-172.7	-90.7	107.8	-9.4	108.8
143	R	65.6	Low	62.5	Low	84 Å²	84	100.8 Å²	100.8	32%	0.317	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-77.2	145.8	177.5	-70.5	-172.9	-77.6	128.1	-16.1	111.2	M134 M141 R145	M134-R143 PolarHBondContact SD-NH1 3.1Å; M134-R143 PolarHBondContact SD-NH2 2.92Å; M141-R143 PolarHBondContact O-N 3.1Å; M141-R143 VanDerWaalsContact O-N 3.1Å; R143-R145 VanDerWaalsContact C-N 3.34Å; R143-R145 PolarHBondContact NH1-O 3.21Å
144	H	60	Low	61.4	Low	196 Å²	196	104.9 Å²	104.9	91%	0.907	49%	0.493	S	S	*	.	S	Bend	trans	-73.7	-24.5	176.5	-163.1	-73.4	0	0	0	112.7
145	R	66.5	Low	60.2	Low	210 Å²	210	107.3 Å²	107.3	79%	0.792	50%	0.503	S	S	*	.	S	Bend	trans	-117.3	132.7	176.2	-66.3	-171	-176.2	-166.7	1.7	111.3	R143	R143-R145 VanDerWaalsContact C-N 3.34Å; R143-R145 PolarHBondContact NH1-O 3.21Å
146	R	69.6	Low	59.1	Low	191 Å²	191	110.5 Å²	110.5	72%	0.721	52%	0.521	S	S	*	.			trans	-68.4	147.2	173.1	-72.8	-177.2	-79.9	174.1	-3.9	109.9	V148	R146-V148 PolarHBondContact O-N 3.11Å
147	F	68.5	Low	58.5	Low	19 Å²	19	110 Å²	110	8%	0.083	52%	0.521	C	S	.	.			trans	-65.4	125.5	164.6	176.5	-102.8	0	0	0	107.5	D106 C107 H128 D130 M134 K149	D106-F147 HydrophobicContact CB-CD1 3.86Å; D106-F147 HydrophobicContact CB-CE1 4.15Å; C107-F147 HydrophobicContact CB-CB 4.15Å; C107-F147 HydrophobicContact CB-CD1 3.89Å; C107-F147 HydrophobicContact CB-CG 4.16Å; H128-F147 HydrophobicContact CB-CE1 4.04Å; H128-F147 HydrophobicContact CB-CZ 4.17Å; H128-F147 AromaticContact CG-CE1 3.92Å; H128-F147 AromaticContact CG-CZ 3.81Å; H128-F147 AromaticContact ND1-CZ 3.58Å; D130-F147 HydrophobicContact CB-CE2 3.95Å; D130-F147 HydrophobicContact CB-CZ 4.08Å; M134-F147 HydrophobicContact CE-CD2 3.43Å; M134-F147 VanDerWaalsContact CE-CD2 3.43Å; M134-F147 HydrophobicContact CE-CE2 4.09Å; M134-F147 HydrophobicContact CE-CG 4.46Å; M134-F147 HydrophobicContact SD-CB 4.01Å; M134-F147 HydrophobicContact SD-CD2 3.63Å; M134-F147 HydrophobicContact SD-CG 4.23Å; F147-K149 HydrophobicContact CE1-CB 4.42Å
148	V	71	Confident	58.4	Low	101 Å²	101	104.5 Å²	104.5	61%	0.612	50%	0.503	S	S	*	.			trans	-115.2	120.9	173.1	-179	0	0	0	0	104.6	R146	R146-V148 PolarHBondContact O-N 3.11Å
149	K	70	Confident	58.3	Low	70 Å²	70	109.3 Å²	109.3	30%	0.304	52%	0.516	S	S	.	.			trans	-56.3	134.3	173.5	-175.3	-177.4	174.8	-172	0	107.7	D106 F147 S151 E153	D106-K149 HydrophobicContact CB-CB 4.24Å; F147-K149 HydrophobicContact CE1-CB 4.42Å; K149-S151 PolarHBondContact O-N 2.99Å; K149-S151 VanDerWaalsContact O-N 3.11Å; K149-E153 IonicContact NZ-OE1 2.73Å; K149-E153 PolarHBondContact NZ-OE1 2.83Å; K149-E153 IonicContact NZ-OE2 3.54Å; K149-E153 PolarHBondContact NZ-OE2 3.34Å
150	P	64.2	Low	57.7	Low	77 Å²	77	108.3 Å²	108.3	50%	0.5	51%	0.511	S	S	.	.			trans	-51.5	123.8	174.1	18	-28.8	0	0	0	109.2	N152	P150-N152 PolarHBondContact O-N 3.46Å
151	S	55.5	Low	57.3	Low	64 Å²	64	113.2 Å²	113.2	45%	0.448	54%	0.538	S	S	.	.	S	Bend	trans	-77.8	22	-162.1	47.9	0	0	0	0	115.5	K149 E153 R154 E155	K149-S151 PolarHBondContact O-N 2.99Å; K149-S151 VanDerWaalsContact O-N 3.11Å; S151-E153 PolarHBondContact O-N 3.34Å; S151-R154 PolarHBondContact O-N 2.9Å; S151-R154 VanDerWaalsContact O-N 3.1Å; S151-E155 PolarHBondContact O-N 3.5Å
152	N	51.2	Low	57.4	Low	119 Å²	119	109 Å²	109	64%	0.636	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	33.4	175.3	-68.8	11.7	0	0	0	113	P150 D156	P150-N152 PolarHBondContact O-N 3.46Å; N152-D156 VanDerWaalsContact CA-OD2 3.28Å; N152-D156 WeakPolarHBondContact CA-OD2 3.41Å
153	E	48.6	Very low	57.3	Low	115 Å²	115	103 Å²	103	54%	0.537	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	-23.1	169.5	-73	178	-169.5	0	0	111	K149 S151 T157	K149-E153 IonicContact NZ-OE1 2.73Å; K149-E153 PolarHBondContact NZ-OE1 2.83Å; K149-E153 IonicContact NZ-OE2 3.54Å; K149-E153 PolarHBondContact NZ-OE2 3.34Å; S151-E153 PolarHBondContact O-N 3.34Å; E153-T157 WeakPolarHBondContact O-CB 3.23Å; E153-T157 VanDerWaalsContact O-CG2 3.24Å; E153-T157 WeakPolarHBondContact O-CG2 3.22Å; E153-T157 PolarHBondContact O-N 3.23Å; E153-T157 PolarHBondContact O-OG1 3.15Å
154	R	49.2	Very low	57.1	Low	184 Å²	184	101.4 Å²	101.4	69%	0.694	50%	0.504	S	S	*	.	H	α-helix	trans	-91.1	-31.6	178.5	-68.6	-173.5	-173.1	164.3	7.4	113	S151 T157 S158	S151-R154 PolarHBondContact O-N 2.9Å; S151-R154 VanDerWaalsContact O-N 3.1Å; R154-T157 PolarHBondContact O-OG1 3.48Å; R154-S158 PolarHBondContact O-OG 3.38Å
155	E	43.4	Very low	57.3	Low	114 Å²	114	95.2 Å²	95.2	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-80.3	-31.8	168.4	-78.9	-174.4	174	0	0	111.9	S151 S158 K159	S151-E155 PolarHBondContact O-N 3.5Å; E155-S158 WeakPolarHBondContact CA-OG 3.21Å; E155-S158 PolarHBondContact O-N 3.25Å; E155-S158 PolarHBondContact O-OG 3.4Å; E155-S158 VanDerWaalsContact O-OG 3.13Å; E155-K159 WeakPolarHBondContact O-CB 3.29Å; E155-K159 WeakPolarHBondContact O-CG 3.49Å; E155-K159 PolarHBondContact O-N 3.12Å
156	D	44.3	Very low	57.5	Low	73 Å²	73	91.3 Å²	91.3	39%	0.39	48%	0.481	S	S	.	.	H	α-helix	trans	-75.5	-31.2	178.7	-64.9	-40	0	0	0	112.6	N152 A160	N152-D156 VanDerWaalsContact CA-OD2 3.28Å; N152-D156 WeakPolarHBondContact CA-OD2 3.41Å; D156-A160 WeakPolarHBondContact O-CA 3.38Å; D156-A160 WeakPolarHBondContact O-CB 3.28Å; D156-A160 PolarHBondContact O-N 3.25Å
157	T	47.8	Very low	57.1	Low	79 Å²	79	84.5 Å²	84.5	49%	0.485	46%	0.461	S	S	.	.	H	α-helix	trans	-69.9	-35.8	170.7	41.2	0	0	0	0	112.7	E153 R154 N161	E153-T157 WeakPolarHBondContact O-CB 3.23Å; E153-T157 VanDerWaalsContact O-CG2 3.24Å; E153-T157 WeakPolarHBondContact O-CG2 3.22Å; E153-T157 PolarHBondContact O-N 3.23Å; E153-T157 PolarHBondContact O-OG1 3.15Å; R154-T157 PolarHBondContact O-OG1 3.48Å; T157-N161 WeakPolarHBondContact O-CB 3.18Å; T157-N161 PolarHBondContact O-N 3.18Å; T157-N161 PolarHBondContact O-ND2 3.24Å; T157-N161 VanDerWaalsContact O-ND2 3.17Å; T157-N161 PolarHBondContact O-OD1 3.39Å
158	S	51.4	Low	57	Low	67 Å²	67	88.8 Å²	88.8	47%	0.469	48%	0.482	S	S	.	.	H	α-helix	trans	-74.6	-38.4	177.8	37.5	0	0	0	0	112	R154 E155 A162	R154-S158 PolarHBondContact O-OG 3.38Å; E155-S158 WeakPolarHBondContact CA-OG 3.21Å; E155-S158 PolarHBondContact O-N 3.25Å; E155-S158 PolarHBondContact O-OG 3.4Å; E155-S158 VanDerWaalsContact O-OG 3.13Å; S158-A162 WeakPolarHBondContact O-CB 3.42Å; S158-A162 PolarHBondContact O-N 3.22Å
159	K	51.6	Low	57	Low	125 Å²	125	87.7 Å²	87.7	54%	0.543	48%	0.478	S	S	.	.	H	α-helix	trans	-66.7	-44.1	169	-74.1	174.3	-177.1	165.8	0	112.4	E155 N161 A162 E163	E155-K159 WeakPolarHBondContact O-CB 3.29Å; E155-K159 WeakPolarHBondContact O-CG 3.49Å; E155-K159 PolarHBondContact O-N 3.12Å; K159-N161 VanDerWaalsContact C-N 3.33Å; K159-N161 PolarHBondContact O-N 3.13Å; K159-A162 PolarHBondContact O-N 3.35Å; K159-E163 WeakPolarHBondContact O-CB 3.43Å; K159-E163 WeakPolarHBondContact O-CG 3.31Å; K159-E163 PolarHBondContact O-N 3.3Å
160	A	49.7	Very low	56.9	Low	31 Å²	31	88.2 Å²	88.2	26%	0.256	48%	0.483	S	S	.	.	H	α-helix	trans	-65.2	-35.5	176.3	0	0	0	0	0	112	D156 N164	D156-A160 WeakPolarHBondContact O-CA 3.38Å; D156-A160 WeakPolarHBondContact O-CB 3.28Å; D156-A160 PolarHBondContact O-N 3.25Å; A160-N164 WeakPolarHBondContact O-CB 2.97Å; A160-N164 PolarHBondContact O-N 3.31Å; A160-N164 PolarHBondContact O-ND2 3.17Å; A160-N164 VanDerWaalsContact O-ND2 3.11Å; A160-N164 PolarHBondContact O-OD1 3.41Å
161	N	56.2	Low	56.7	Low	106 Å²	106	87.5 Å²	87.5	57%	0.567	48%	0.475	S	S	*	.	H	α-helix	trans	-68.8	-38.5	173.8	-73.1	-15.7	0	0	0	111.8	T157 K159 A165	T157-N161 WeakPolarHBondContact O-CB 3.18Å; T157-N161 PolarHBondContact O-N 3.18Å; T157-N161 PolarHBondContact O-ND2 3.24Å; T157-N161 VanDerWaalsContact O-ND2 3.17Å; T157-N161 PolarHBondContact O-OD1 3.39Å; K159-N161 VanDerWaalsContact C-N 3.33Å; K159-N161 PolarHBondContact O-N 3.13Å; N161-A165 VanDerWaalsContact O-CB 3.3Å; N161-A165 WeakPolarHBondContact O-CB 3.1Å; N161-A165 PolarHBondContact O-N 2.68Å
162	A	62.2	Low	57.2	Low	55 Å²	55	90 Å²	90	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-68.1	-42.5	173.8	0	0	0	0	0	112.2	S158 K159 A165 L166	S158-A162 WeakPolarHBondContact O-CB 3.42Å; S158-A162 PolarHBondContact O-N 3.22Å; K159-A162 PolarHBondContact O-N 3.35Å; A162-A165 PolarHBondContact O-N 3.28Å; A162-L166 WeakPolarHBondContact O-CG 3.42Å; A162-L166 PolarHBondContact O-N 2.99Å; A162-L166 VanDerWaalsContact O-N 3.09Å
163	E	57.6	Low	58	Low	82 Å²	82	89.8 Å²	89.8	38%	0.383	47%	0.473	S	S	.	.	H	α-helix	trans	-64.3	-42.1	173.5	-74.6	-170.1	154.6	0	0	111.2	K159 A165 L166 V167 K251	K159-E163 WeakPolarHBondContact O-CB 3.43Å; K159-E163 WeakPolarHBondContact O-CG 3.31Å; K159-E163 PolarHBondContact O-N 3.3Å; E163-A165 VanDerWaalsContact C-N 3.34Å; E163-A165 PolarHBondContact O-N 3.13Å; E163-L166 PolarHBondContact O-N 3.2Å; E163-V167 WeakPolarHBondContact O-CB 3.1Å; E163-V167 VanDerWaalsContact O-CG2 3.25Å; E163-V167 WeakPolarHBondContact O-CG2 3.44Å; E163-V167 PolarHBondContact O-N 3.33Å; E163-K251 IonicContact OE1-NZ 3.89Å; E163-K251 PolarHBondContact OE1-NZ 3.28Å; E163-K251 IonicContact OE2-NZ 3.98Å
164	N	60.3	Low	58.7	Low	51 Å²	51	87 Å²	87	27%	0.273	46%	0.461	S	S	.	.	H	α-helix	trans	-63.6	-39.7	173.9	-70.7	-22.3	0	0	0	111	A160 L166 V167 M168 R271	A160-N164 WeakPolarHBondContact O-CB 2.97Å; A160-N164 PolarHBondContact O-N 3.31Å; A160-N164 PolarHBondContact O-ND2 3.17Å; A160-N164 VanDerWaalsContact O-ND2 3.11Å; A160-N164 PolarHBondContact O-OD1 3.41Å; N164-L166 PolarHBondContact O-N 3.23Å; N164-V167 PolarHBondContact O-N 2.91Å; N164-M168 WeakPolarHBondContact O-CB 3.39Å; N164-M168 WeakPolarHBondContact O-CG 3.22Å; N164-M168 PolarHBondContact O-N 3.48Å; N164-R271 PolarHBondContact OD1-NH1 3.21Å; N164-R271 PolarHBondContact OD1-NH2 3.27Å
165	A	65.8	Low	59.4	Low	67 Å²	67	81.4 Å²	81.4	55%	0.554	45%	0.45	S	S	*	.	H	α-helix	trans	-63.1	-30.4	176.1	0	0	0	0	0	112.9	N161 A162 E163 P169	N161-A165 VanDerWaalsContact O-CB 3.3Å; N161-A165 WeakPolarHBondContact O-CB 3.1Å; N161-A165 PolarHBondContact O-N 2.68Å; A162-A165 PolarHBondContact O-N 3.28Å; E163-A165 VanDerWaalsContact C-N 3.34Å; E163-A165 PolarHBondContact O-N 3.13Å; A165-P169 WeakPolarHBondContact O-CD 3.46Å; A165-P169 WeakPolarHBondContact O-CG 3.16Å
166	L	69.7	Low	60.6	Low	127 Å²	127	81.2 Å²	81.2	67%	0.665	45%	0.449	S	S	*	.	H	α-helix	trans	-78.5	-36.3	173.6	-70.5	167.5	0	0	0	112.8	A162 E163 N164	A162-L166 WeakPolarHBondContact O-CG 3.42Å; A162-L166 PolarHBondContact O-N 2.99Å; A162-L166 VanDerWaalsContact O-N 3.09Å; E163-L166 PolarHBondContact O-N 3.2Å; N164-L166 PolarHBondContact O-N 3.23Å
167	V	61.8	Low	61.7	Low	48 Å²	48	81.7 Å²	81.7	29%	0.291	45%	0.449	S	S	.	.	H	α-helix	trans	-83.3	-34.3	-174.9	173.4	0	0	0	0	112.6	E163 N164 I170 L171	E163-V167 WeakPolarHBondContact O-CB 3.1Å; E163-V167 VanDerWaalsContact O-CG2 3.25Å; E163-V167 WeakPolarHBondContact O-CG2 3.44Å; E163-V167 PolarHBondContact O-N 3.33Å; N164-V167 PolarHBondContact O-N 2.91Å; V167-I170 WeakPolarHBondContact O-CB 3.35Å; V167-I170 PolarHBondContact O-N 3.38Å; V167-I170 VanDerWaalsContact O-N 3.09Å; V167-L171 HydrophobicContact CG1-CD1 3.77Å; V167-L171 HydrophobicContact CG1-CG 3.86Å; V167-L171 PolarHBondContact O-N 2.81Å
168	M	66.3	Low	62.5	Low	109 Å²	109	80 Å²	80	54%	0.537	44%	0.437	S	S	.	.	H	α-helix	trans	-60	-43.4	-176.3	-74.4	-59.4	-66.3	0	0	113.9	N164 I170 L171 Q172	N164-M168 WeakPolarHBondContact O-CB 3.39Å; N164-M168 WeakPolarHBondContact O-CG 3.22Å; N164-M168 PolarHBondContact O-N 3.48Å; M168-I170 VanDerWaalsContact C-N 3.27Å; M168-I170 PolarHBondContact O-N 3.3Å; M168-L171 PolarHBondContact O-N 3.44Å; M168-L171 HydrophobicContact SD-CD1 4.38Å; M168-Q172 VanDerWaalsContact O-CB 3.32Å; M168-Q172 WeakPolarHBondContact O-CB 3.19Å; M168-Q172 PolarHBondContact O-N 3Å
169	P	70.4	Confident	63.2	Low	79 Å²	79	80.3 Å²	80.3	51%	0.513	44%	0.436	S	S	.	.	H	α-helix	trans	-61.1	-34.7	173.9	-23.9	34.4	0	0	0	113.2	A165 K173	A165-P169 WeakPolarHBondContact O-CD 3.46Å; A165-P169 WeakPolarHBondContact O-CG 3.16Å; P169-K173 WeakPolarHBondContact O-CB 3.38Å; P169-K173 PolarHBondContact O-N 3.17Å
170	I	67.8	Low	64.2	Low	80 Å²	80	81.5 Å²	81.5	41%	0.41	44%	0.437	S	S	.	.	H	α-helix	trans	-69.1	-47.9	177.6	-59.4	172.8	0	0	0	110.1	V167 M168 Q172 K173 I174	V167-I170 WeakPolarHBondContact O-CB 3.35Å; V167-I170 PolarHBondContact O-N 3.38Å; V167-I170 VanDerWaalsContact O-N 3.09Å; M168-I170 VanDerWaalsContact C-N 3.27Å; M168-I170 PolarHBondContact O-N 3.3Å; I170-Q172 VanDerWaalsContact C-N 3.26Å; I170-Q172 PolarHBondContact O-N 3.42Å; I170-K173 PolarHBondContact O-N 3.1Å; I170-I174 HydrophobicContact CG2-CD1 4.01Å; I170-I174 WeakPolarHBondContact O-CG1 3.39Å; I170-I174 PolarHBondContact O-N 3.49Å
171	L	61	Low	65	Low	63 Å²	63	86.9 Å²	86.9	33%	0.33	45%	0.451	S	S	.	.	H	α-helix	trans	-61.3	-37.5	176.6	-70.3	179.1	0	0	0	111.8	V167 M168 I174 S175	V167-L171 HydrophobicContact CG1-CD1 3.77Å; V167-L171 HydrophobicContact CG1-CG 3.86Å; V167-L171 PolarHBondContact O-N 2.81Å; M168-L171 PolarHBondContact O-N 3.44Å; M168-L171 HydrophobicContact SD-CD1 4.38Å; L171-I174 PolarHBondContact O-N 3.44Å; L171-S175 WeakPolarHBondContact O-CB 3.49Å; L171-S175 PolarHBondContact O-N 3.32Å
172	Q	64.4	Low	65.2	Low	116 Å²	116	87 Å²	87	54%	0.542	44%	0.443	S	S	.	.	H	α-helix	trans	-64	-45.5	175.6	-176.4	159.9	-11.8	0	0	111.5	M168 I170 I174 S175 E176	M168-Q172 VanDerWaalsContact O-CB 3.32Å; M168-Q172 WeakPolarHBondContact O-CB 3.19Å; M168-Q172 PolarHBondContact O-N 3Å; I170-Q172 VanDerWaalsContact C-N 3.26Å; I170-Q172 PolarHBondContact O-N 3.42Å; Q172-I174 PolarHBondContact O-N 2.86Å; Q172-S175 WeakPolarHBondContact O-CB 3.36Å; Q172-S175 PolarHBondContact O-N 3.44Å; Q172-E176 WeakPolarHBondContact CG-OE1 3.24Å; Q172-E176 PolarHBondContact NE2-OE1 2.98Å; Q172-E176 WeakPolarHBondContact O-CG 3.45Å; Q172-E176 PolarHBondContact O-N 3.48Å
173	K	68.8	Low	65.5	Low	115 Å²	115	90.8 Å²	90.8	50%	0.5	45%	0.452	S	S	.	.	H	α-helix	trans	-61.5	-41.8	175.6	-167.2	176.5	-177	-176.2	0	112.5	P169 I170 E176 E177	P169-K173 WeakPolarHBondContact O-CB 3.38Å; P169-K173 PolarHBondContact O-N 3.17Å; I170-K173 PolarHBondContact O-N 3.1Å; K173-E176 PolarHBondContact O-N 2.9Å; K173-E177 WeakPolarHBondContact O-CG 3.46Å; K173-E177 PolarHBondContact O-N 3.48Å
174	I	62.8	Low	66	Low	55 Å²	55	91.5 Å²	91.5	28%	0.282	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-43.7	174.9	-67.2	168.1	0	0	0	110.5	I170 L171 Q172 E176 E177 L178 F254	I170-I174 HydrophobicContact CG2-CD1 4.01Å; I170-I174 WeakPolarHBondContact O-CG1 3.39Å; I170-I174 PolarHBondContact O-N 3.49Å; L171-I174 PolarHBondContact O-N 3.44Å; Q172-I174 PolarHBondContact O-N 2.86Å; I174-E176 VanDerWaalsContact C-N 3.31Å; I174-E176 PolarHBondContact O-N 3.21Å; I174-E177 PolarHBondContact O-N 2.92Å; I174-L178 HydrophobicContact CG2-CD1 4.02Å; I174-L178 HydrophobicContact CG2-CG 4.37Å; I174-L178 WeakPolarHBondContact O-CG 3.4Å; I174-L178 PolarHBondContact O-N 3.47Å; I174-F254 HydrophobicContact CD1-CZ 4.24Å
175	S	63.4	Low	66	Low	68 Å²	68	92.8 Å²	92.8	48%	0.476	46%	0.461	S	S	.	.	H	α-helix	trans	-61.3	-38.8	176.7	-177.4	0	0	0	0	112.4	L171 Q172 T179	L171-S175 WeakPolarHBondContact O-CB 3.49Å; L171-S175 PolarHBondContact O-N 3.32Å; Q172-S175 WeakPolarHBondContact O-CB 3.36Å; Q172-S175 PolarHBondContact O-N 3.44Å; S175-T179 WeakPolarHBondContact O-CB 3.41Å; S175-T179 PolarHBondContact O-N 3.35Å; S175-T179 PolarHBondContact O-OG1 2.95Å
176	E	70.4	Confident	65.7	Low	110 Å²	110	92.5 Å²	92.5	51%	0.514	45%	0.45	S	S	.	.	H	α-helix	trans	-66	-45.2	176.6	-73.2	166.8	-172.9	0	0	111.3	Q172 K173 I174 T179 R180	Q172-E176 WeakPolarHBondContact CG-OE1 3.24Å; Q172-E176 PolarHBondContact NE2-OE1 2.98Å; Q172-E176 WeakPolarHBondContact O-CG 3.45Å; Q172-E176 PolarHBondContact O-N 3.48Å; K173-E176 PolarHBondContact O-N 2.9Å; I174-E176 VanDerWaalsContact C-N 3.31Å; I174-E176 PolarHBondContact O-N 3.21Å; E176-T179 WeakPolarHBondContact O-CB 3.45Å; E176-T179 PolarHBondContact O-N 3Å; E176-R180 PolarHBondContact O-N 3.46Å
177	E	67.1	Low	65.4	Low	82 Å²	82	90.3 Å²	90.3	38%	0.383	45%	0.45	S	S	.	.	H	α-helix	trans	-63.3	-44.1	176.2	-73.6	-61.5	146.3	0	0	112.3	K173 I174 T179 R180 W181	K173-E177 WeakPolarHBondContact O-CG 3.46Å; K173-E177 PolarHBondContact O-N 3.48Å; I174-E177 PolarHBondContact O-N 2.92Å; E177-T179 VanDerWaalsContact C-N 3.27Å; E177-T179 PolarHBondContact O-N 3.4Å; E177-R180 WeakPolarHBondContact O-CB 3.41Å; E177-R180 PolarHBondContact O-N 3.32Å; E177-R180 VanDerWaalsContact O-N 3.15Å; E177-R180 IonicContact OE1-NH1 2.68Å; E177-W181 PolarHBondContact O-N 2.86Å
178	L	64.1	Low	65.5	Low	45 Å²	45	94.8 Å²	94.8	24%	0.236	47%	0.472	C	S	.	.	H	α-helix	trans	-60.9	-37.7	174.8	-72.1	173.8	0	0	0	111.8	I174 R182 M265 W267	I174-L178 HydrophobicContact CG2-CD1 4.02Å; I174-L178 HydrophobicContact CG2-CG 4.37Å; I174-L178 WeakPolarHBondContact O-CG 3.4Å; I174-L178 PolarHBondContact O-N 3.47Å; L178-R182 WeakPolarHBondContact O-CB 3.34Å; L178-R182 PolarHBondContact O-N 3.47Å; L178-M265 HydrophobicContact CD2-CE 4.38Å; L178-W267 HydrophobicContact CD1-CD2 4.23Å; L178-W267 HydrophobicContact CD1-CE3 4.43Å; L178-W267 HydrophobicContact CD1-CH2 4.46Å; L178-W267 HydrophobicContact CD1-CZ2 4.26Å
179	T	66	Low	64.9	Low	73 Å²	73	94.1 Å²	94.1	45%	0.448	47%	0.467	S	S	.	.	H	α-helix	trans	-66.6	-38.9	176.2	-56.5	0	0	0	0	111.3	S175 E176 E177 R182 Q183	S175-T179 WeakPolarHBondContact O-CB 3.41Å; S175-T179 PolarHBondContact O-N 3.35Å; S175-T179 PolarHBondContact O-OG1 2.95Å; E176-T179 WeakPolarHBondContact O-CB 3.45Å; E176-T179 PolarHBondContact O-N 3Å; E177-T179 VanDerWaalsContact C-N 3.27Å; E177-T179 PolarHBondContact O-N 3.4Å; T179-R182 WeakPolarHBondContact O-CB 3.45Å; T179-R182 PolarHBondContact O-N 3.1Å; T179-Q183 PolarHBondContact O-N 3.49Å
180	R	73.2	Confident	64.1	Low	149 Å²	149	94.8 Å²	94.8	56%	0.562	47%	0.472	S	S	*	.	H	α-helix	trans	-63.7	-48.2	176.5	-168	-176.8	-157.9	171.1	5.1	112	E176 E177 R182 Q183 Q184	E176-R180 PolarHBondContact O-N 3.46Å; E177-R180 WeakPolarHBondContact O-CB 3.41Å; E177-R180 PolarHBondContact O-N 3.32Å; E177-R180 VanDerWaalsContact O-N 3.15Å; E177-R180 IonicContact OE1-NH1 2.68Å; R180-R182 VanDerWaalsContact C-N 3.3Å; R180-R182 PolarHBondContact O-N 3.02Å; R180-Q183 PolarHBondContact O-N 3.29Å; R180-Q183 VanDerWaalsContact O-N 3.16Å; R180-Q184 PolarHBondContact O-N 3.36Å
181	W	66.4	Low	63.3	Low	145 Å²	145	99.1 Å²	99.1	55%	0.549	49%	0.49	S	S	.	.	H	α-helix	trans	-58.6	-43.2	174.9	-89.8	90.5	0	0	0	111.7	E177 Q183 Q184 I185	E177-W181 PolarHBondContact O-N 2.86Å; W181-Q183 VanDerWaalsContact C-N 3.34Å; W181-Q183 PolarHBondContact O-N 3.3Å; W181-Q184 PolarHBondContact O-N 2.92Å; W181-I185 WeakPolarHBondContact O-CG1 3.35Å; W181-I185 PolarHBondContact O-N 3.38Å
182	R	60.5	Low	62.8	Low	109 Å²	109	99.8 Å²	99.8	41%	0.411	50%	0.497	S	S	.	.	H	α-helix	trans	-57.3	-45.2	174.5	-178	-178.1	177.4	179.8	3.3	112	L178 T179 R180 I185 L186	L178-R182 WeakPolarHBondContact O-CB 3.34Å; L178-R182 PolarHBondContact O-N 3.47Å; T179-R182 WeakPolarHBondContact O-CB 3.45Å; T179-R182 PolarHBondContact O-N 3.1Å; R180-R182 VanDerWaalsContact C-N 3.3Å; R180-R182 PolarHBondContact O-N 3.02Å; R182-I185 PolarHBondContact O-N 2.98Å; R182-L186 HydrophobicContact CG-CD1 4.23Å; R182-L186 VanDerWaalsContact O-CG 3.32Å; R182-L186 WeakPolarHBondContact O-CG 3.5Å; R182-L186 PolarHBondContact O-N 2.82Å
183	Q	67.5	Low	61.5	Low	134 Å²	134	95.6 Å²	95.6	63%	0.626	48%	0.479	S	S	*	.	H	α-helix	trans	-65.2	-37.7	178.5	-73.8	-165.6	-17	0	0	112.8	T179 R180 W181 L186 A187	T179-Q183 PolarHBondContact O-N 3.49Å; R180-Q183 PolarHBondContact O-N 3.29Å; R180-Q183 VanDerWaalsContact O-N 3.16Å; W181-Q183 VanDerWaalsContact C-N 3.34Å; W181-Q183 PolarHBondContact O-N 3.3Å; Q183-L186 PolarHBondContact O-N 3.23Å; Q183-A187 WeakPolarHBondContact O-CB 3.36Å; Q183-A187 PolarHBondContact O-N 3.05Å
184	Q	69.3	Low	60.4	Low	97 Å²	97	97 Å²	97	45%	0.453	49%	0.485	S	S	.	.	H	α-helix	trans	-63.9	-43	175.3	-73.6	178.2	-20.4	0	0	112.2	R180 W181 A187 L188	R180-Q184 PolarHBondContact O-N 3.36Å; W181-Q184 PolarHBondContact O-N 2.92Å; Q184-A187 PolarHBondContact O-N 3.41Å; Q184-L188 WeakPolarHBondContact O-CG 3.38Å; Q184-L188 PolarHBondContact O-N 3.5Å
185	I	58.7	Low	59.4	Low	78 Å²	78	98.2 Å²	98.2	40%	0.4	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-45.8	176.5	-66.1	168	0	0	0	110.6	W181 R182 A187 L188 Q189	W181-I185 WeakPolarHBondContact O-CG1 3.35Å; W181-I185 PolarHBondContact O-N 3.38Å; R182-I185 PolarHBondContact O-N 2.98Å; I185-A187 VanDerWaalsContact C-N 3.26Å; I185-A187 PolarHBondContact O-N 3.43Å; I185-L188 PolarHBondContact O-N 2.96Å; I185-Q189 PolarHBondContact O-N 3.44Å
186	L	59.4	Low	58.3	Low	60 Å²	60	98.6 Å²	98.6	31%	0.314	50%	0.5	S	S	.	.	H	α-helix	trans	-60.4	-35	176.2	-71.1	174.1	0	0	0	112.5	R182 Q183 Q189 C193	R182-L186 HydrophobicContact CG-CD1 4.23Å; R182-L186 VanDerWaalsContact O-CG 3.32Å; R182-L186 WeakPolarHBondContact O-CG 3.5Å; R182-L186 PolarHBondContact O-N 2.82Å; Q183-L186 PolarHBondContact O-N 3.23Å; L186-Q189 CarbonylContact O-C 3.55Å; L186-C193 HydrophobicContact CD2-CB 3.33Å
187	A	65.1	Low	56.7	Low	81 Å²	81	99.7 Å²	99.7	67%	0.669	51%	0.508	S	S	*	.	H	α-helix	trans	-72.6	-33.4	176.9	0	0	0	0	0	113	Q183 Q184 I185	Q183-A187 WeakPolarHBondContact O-CB 3.36Å; Q183-A187 PolarHBondContact O-N 3.05Å; Q184-A187 PolarHBondContact O-N 3.41Å; I185-A187 VanDerWaalsContact C-N 3.26Å; I185-A187 PolarHBondContact O-N 3.43Å
188	L	63.2	Low	55.2	Low	143 Å²	143	100.1 Å²	100.1	75%	0.749	52%	0.516	S	S	*	.	H	α-helix	trans	-75.7	-31.2	177.6	-71.1	170.3	0	0	0	112.6	Q184 I185	Q184-L188 WeakPolarHBondContact O-CG 3.38Å; Q184-L188 PolarHBondContact O-N 3.5Å; I185-L188 PolarHBondContact O-N 2.96Å
189	Q	53.7	Low	53.7	Low	95 Å²	95	104.1 Å²	104.1	44%	0.444	54%	0.538	S	S	.	.			trans	-140.2	76.2	-178.4	-64.4	-154.1	-29.7	0	0	112.9	I185 L186 E191 V192	I185-Q189 PolarHBondContact O-N 3.44Å; L186-Q189 CarbonylContact O-C 3.55Å; Q189-E191 PolarHBondContact O-N 3.2Å; Q189-V192 HydrophobicContact CB-CB 4.17Å; Q189-V192 HydrophobicContact CB-CG2 4.19Å; Q189-V192 PolarHBondContact O-N 3.2Å
190	P	54	Low	52.1	Low	93 Å²	93	108.5 Å²	108.5	60%	0.604	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-26.9	-179.8	22.9	-31.6	0	0	0	113.3
191	E	50.9	Low	50.1	Low	171 Å²	171	111.9 Å²	111.9	80%	0.799	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-19.6	-174.9	-61.5	-59.8	150.8	0	0	114.3	Q189	Q189-E191 PolarHBondContact O-N 3.2Å
192	V	49.5	Very low	48.5	Very low	77 Å²	77	113.6 Å²	113.6	47%	0.467	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.7	-24.8	-174.4	-176.5	0	0	0	0	111.7	Q189	Q189-V192 HydrophobicContact CB-CB 4.17Å; Q189-V192 HydrophobicContact CB-CG2 4.19Å; Q189-V192 PolarHBondContact O-N 3.2Å
193	C	38.6	Very low	47	Very low	27 Å²	27	113.8 Å²	113.8	18%	0.182	58%	0.583	C	S	.	*			trans	-109.3	90.2	-172.1	-66.4	0	0	0	0	111.8	L186	L186-C193 HydrophobicContact CD2-CB 3.33Å
194	K	44.3	Very low	45.4	Very low	144 Å²	144	112.5 Å²	112.5	63%	0.626	58%	0.58	S	S	*	*			trans	-78.7	127.5	166.2	-72.6	-174.1	179.8	-179.1	0	110.1	S196	K194-S196 PolarHBondContact O-N 3.14Å
195	P	43.4	Very low	43.8	Very low	81 Å²	81	117.2 Å²	117.2	53%	0.526	60%	0.599	S	S	.	*			trans	-71.3	101.5	176.4	27.6	-31.3	0	0	0	109.7	I197	P195-I197 VanDerWaalsContact C-N 3.31Å; P195-I197 HydrophobicContact CB-CG1 4.31Å; P195-I197 PolarHBondContact O-N 3.15Å; P195-I197 VanDerWaalsContact O-N 3.08Å
196	S	39	Very low	42.5	Very low	76 Å²	76	119.7 Å²	119.7	53%	0.531	61%	0.613	S	S	.	*			trans	-73	90.9	158.3	171.7	0	0	0	0	107.8	K194 V198	K194-S196 PolarHBondContact O-N 3.14Å; S196-V198 PolarHBondContact O-N 3.47Å; S196-V198 VanDerWaalsContact O-N 3.16Å
197	I	36.9	Very low	41.4	Very low	134 Å²	134	122.3 Å²	122.3	69%	0.687	64%	0.637	S	S	*	*			trans	-74.4	99.4	172.8	-69.6	170.3	0	0	0	107.3	P195 D199	P195-I197 VanDerWaalsContact C-N 3.31Å; P195-I197 HydrophobicContact CB-CG1 4.31Å; P195-I197 PolarHBondContact O-N 3.15Å; P195-I197 VanDerWaalsContact O-N 3.08Å; I197-D199 HydrophobicContact CG2-CB 4.4Å
198	V	35.1	Very low	40	Very low	90 Å²	90	122.9 Å²	122.9	55%	0.545	63%	0.628	S	S	.	*			trans	-106	109.6	149.7	-168.8	0	0	0	0	106.6	S196 Y200	S196-V198 PolarHBondContact O-N 3.47Å; S196-V198 VanDerWaalsContact O-N 3.16Å; V198-Y200 HydrophobicContact CB-CD2 3.86Å; V198-Y200 HydrophobicContact CB-CE2 3.73Å; V198-Y200 HydrophobicContact CG1-CD2 3.52Å; V198-Y200 HydrophobicContact CG1-CE2 3.18Å; V198-Y200 PolarHBondContact O-N 3.38Å
199	D	33.3	Very low	38.9	Very low	130 Å²	130	122.5 Å²	122.5	70%	0.695	63%	0.626	S	S	*	*			trans	-74.9	85.6	-174.7	-152	-4.1	0	0	0	109.5	I197 R201	I197-D199 HydrophobicContact CG2-CB 4.4Å; D199-R201 VanDerWaalsContact C-N 3.27Å; D199-R201 PolarHBondContact O-N 3.4Å
200	Y	32.8	Very low	38.2	Very low	165 Å²	165	121.9 Å²	121.9	65%	0.647	62%	0.623	S	S	*	*			trans	-88.4	22.7	-176.9	-90.1	-77.3	0	0	0	114	V198 Q202	V198-Y200 HydrophobicContact CB-CD2 3.86Å; V198-Y200 HydrophobicContact CB-CE2 3.73Å; V198-Y200 HydrophobicContact CG1-CD2 3.52Å; V198-Y200 HydrophobicContact CG1-CE2 3.18Å; V198-Y200 PolarHBondContact O-N 3.38Å; Y200-Q202 PolarHBondContact O-N 2.99Å; Y200-Q202 VanDerWaalsContact O-N 3.15Å
201	R	31.5	Very low	37.4	Very low	219 Å²	219	120.7 Å²	120.7	83%	0.826	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-1	-177.9	-95.8	-176.5	166.1	169.5	-2.8	115.4	D199	D199-R201 VanDerWaalsContact C-N 3.27Å; D199-R201 PolarHBondContact O-N 3.4Å
202	Q	31.6	Very low	36.8	Very low	182 Å²	182	114.4 Å²	114.4	85%	0.85	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-2.2	-174.6	-99.6	158.4	-10.3	0	0	117	Y200	Y200-Q202 PolarHBondContact O-N 2.99Å; Y200-Q202 VanDerWaalsContact O-N 3.15Å
203	N	29.4	Very low	36.1	Very low	112 Å²	112	119 Å²	119	60%	0.599	61%	0.605	S	S	*	*			trans	-115.9	21.5	-178	-68.9	-22.2	0	0	0	114.6	F205	N203-F205 PolarHBondContact O-N 3.27Å
204	L	34.7	Very low	35.9	Very low	107 Å²	107	121.2 Å²	121.2	56%	0.56	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-4.2	-177.1	-109.6	136.6	0	0	0	115.2	Q210	L204-Q210 VanDerWaalsContact CD2-NE2 3.26Å
205	F	35.3	Very low	35.6	Very low	197 Å²	197	122.1 Å²	122.1	86%	0.864	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-10.3	-174.7	-71.5	-77.5	0	0	0	114.6	N203	N203-F205 PolarHBondContact O-N 3.27Å
206	D	31.5	Very low	35.1	Very low	129 Å²	129	120.7 Å²	120.7	69%	0.69	62%	0.618	S	S	*	*	S	Bend	trans	-126.1	118	-178.6	-72.8	-39.6	0	0	0	109.1
207	S	36.6	Very low	34.8	Very low	115 Å²	115	122.7 Å²	122.7	80%	0.804	62%	0.623	S	S	*	*	S	Bend	trans	71.3	98.6	173.5	46.5	0	0	0	0	119	I209	S207-I209 VanDerWaalsContact C-N 3.28Å; S207-I209 PolarHBondContact O-N 2.73Å
208	N	35.5	Very low	34.8	Very low	93 Å²	93	125.5 Å²	125.5	50%	0.497	63%	0.633	S	S	.	*	S	Bend	trans	-19.1	25	162	-79.7	-17.6	0	0	0	123.5
209	I	39.9	Very low	34.4	Very low	135 Å²	135	126.1 Å²	126.1	69%	0.692	65%	0.648	S	S	*	*			trans	-142	122.2	174.1	-57.4	179.4	0	0	0	110.3	S207 V211	S207-I209 VanDerWaalsContact C-N 3.28Å; S207-I209 PolarHBondContact O-N 2.73Å; I209-V211 HydrophobicContact CG2-CG2 3.9Å
210	Q	38.4	Very low	34.2	Very low	82 Å²	82	124.7 Å²	124.7	38%	0.383	65%	0.654	S	S	.	*			trans	-111	129.4	169.2	-68.5	-177.2	-16.4	0	0	109.2	L204	L204-Q210 VanDerWaalsContact CD2-NE2 3.26Å
211	V	37.6	Very low	33.9	Very low	68 Å²	68	125 Å²	125	41%	0.412	66%	0.662	S	S	.	*			trans	-133.4	132.9	172.8	-170.2	0	0	0	0	108	I209 Y213	I209-V211 HydrophobicContact CG2-CG2 3.9Å; V211-Y213 HydrophobicContact CB-CE2 4.37Å; V211-Y213 HydrophobicContact CG1-CD2 4.19Å; V211-Y213 HydrophobicContact CG1-CE1 4.44Å; V211-Y213 HydrophobicContact CG1-CE2 3.44Å; V211-Y213 VanDerWaalsContact CG1-CE2 3.44Å
212	G	37.1	Very low	33.8	Very low	40 Å²	40	123.5 Å²	123.5	41%	0.412	66%	0.664	S	S	.	*			trans	-125	144.1	173	0	0	0	0	0	110.8
213	Y	35.4	Very low	33.6	Very low	174 Å²	174	119.8 Å²	119.8	68%	0.682	66%	0.664	S	S	*	*			trans	-126	145.8	177.8	-62.8	-87.6	0	0	0	110.5	V211	V211-Y213 HydrophobicContact CB-CE2 4.37Å; V211-Y213 HydrophobicContact CG1-CD2 4.19Å; V211-Y213 HydrophobicContact CG1-CE1 4.44Å; V211-Y213 HydrophobicContact CG1-CE2 3.44Å; V211-Y213 VanDerWaalsContact CG1-CE2 3.44Å
214	F	34.3	Very low	33.4	Very low	73 Å²	73	119.2 Å²	119.2	32%	0.32	67%	0.669	S	S	.	*			trans	-112.7	128.2	162.8	-92.7	-91.1	0	0	0	108.2
215	Q	38.8	Very low	32.9	Very low	162 Å²	162	124.5 Å²	124.5	76%	0.757	69%	0.688	S	S	*	*			trans	-105.9	112.4	174	-170	173.7	2.7	0	0	108.8
216	G	33.2	Very low	32.5	Very low	51 Å²	51	119.9 Å²	119.9	53%	0.526	68%	0.676	S	S	.	*			trans	-76.2	133.3	164.1	0	0	0	0	0	109.6	Q218	G216-Q218 PolarHBondContact O-N 3.33Å; G216-Q218 VanDerWaalsContact O-N 3.1Å
217	N	32.2	Very low	32.1	Very low	119 Å²	119	121.7 Å²	121.7	64%	0.636	68%	0.68	S	S	*	*	S	Bend	trans	-71.5	101.2	177.9	-79.3	-9.6	0	0	0	110.4
218	Q	35.8	Very low	31.6	Very low	192 Å²	192	126.4 Å²	126.4	90%	0.897	68%	0.682	S	S	*	*	S	Bend	trans	-165.9	143.7	144.6	-104.1	168	37.4	0	0	109.1	G216 A220	G216-Q218 PolarHBondContact O-N 3.33Å; G216-Q218 VanDerWaalsContact O-N 3.1Å; Q218-A220 PolarHBondContact O-N 3.37Å
219	A	27.5	Very low	31.1	Very low	103 Å²	103	130.5 Å²	130.5	85%	0.851	70%	0.698	S	S	*	*			trans	-52.9	124.7	-163.2	0	0	0	0	0	114.9
220	A	29.6	Very low	30.5	Very low	100 Å²	100	128.6 Å²	128.6	83%	0.826	70%	0.695	S	S	*	*			trans	-126.4	74.2	161.2	0	0	0	0	0	108.2	Q218	Q218-A220 PolarHBondContact O-N 3.37Å
221	E	26.9	Very low	29.8	Very low	173 Å²	173	128.2 Å²	128.2	81%	0.808	71%	0.713	S	S	*	*			trans	-60	138.5	154.1	-85.1	-179.2	142.9	0	0	108.4
222	Q	27.5	Very low	29.4	Very low	187 Å²	187	130.8 Å²	130.8	87%	0.874	72%	0.724	S	S	*	*			trans	68.9	81.4	165.2	-55.9	174	8.1	0	0	117
223	A	28.4	Very low	28.9	Very low	104 Å²	104	136.2 Å²	136.2	86%	0.86	74%	0.738	S	S	*	*			trans	-145.2	113	148.4	0	0	0	0	0	110.6
224	S	25	Very low	28.8	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	74%	0.743	S	S	*	*			trans	-60.5	145.1	179	48.1	0	0	0	0	113	T226	S224-T226 PolarHBondContact O-N 3.34Å
225	F	24.2	Very low	28.9	Very low	218 Å²	218	133.6 Å²	133.6	96%	0.956	76%	0.755	S	S	*	*			trans	-59.6	89.9	172.5	-140.4	-96	0	0	0	110.8
226	T	26.4	Very low	28.6	Very low	99 Å²	99	133.3 Å²	133.3	61%	0.607	75%	0.753	S	S	*	*			trans	-122.5	116.3	171	46	0	0	0	0	110.5	S224 Y228	S224-T226 PolarHBondContact O-N 3.34Å; T226-Y228 PolarHBondContact O-N 2.83Å
227	H	24.8	Very low	28.7	Very low	167 Å²	167	137.2 Å²	137.2	77%	0.773	76%	0.761	S	S	*	*			trans	-24.5	112.6	164.8	-96.3	51	0	0	0	113.5
228	Y	25.7	Very low	28.7	Very low	215 Å²	215	140 Å²	140	84%	0.843	77%	0.77	S	S	*	*			trans	-106.8	88.8	154	-95.4	-86.5	0	0	0	108.8	T226 C230	T226-Y228 PolarHBondContact O-N 2.83Å; Y228-C230 PolarHBondContact O-N 3.3Å; Y228-C230 VanDerWaalsContact O-N 3.08Å
229	Q	24.4	Very low	28.7	Very low	179 Å²	179	138.2 Å²	138.2	84%	0.836	76%	0.762	S	S	*	*			trans	-75.8	76	163.3	-165.3	175.5	1	0	0	107	G231	Q229-G231 PolarHBondContact O-N 3.13Å
230	C	26.6	Very low	29	Very low	95 Å²	95	142.3 Å²	142.3	64%	0.642	76%	0.761	S	S	*	*			trans	-85.4	93.8	173.4	-162.8	0	0	0	0	108.6	Y228 L232	Y228-C230 PolarHBondContact O-N 3.3Å; Y228-C230 VanDerWaalsContact O-N 3.08Å; C230-L232 PolarHBondContact O-N 3.15Å
231	G	24.5	Very low	29.3	Very low	73 Å²	73	142.2 Å²	142.2	75%	0.753	75%	0.746	S	S	*	*			trans	-65.6	97.7	165.9	0	0	0	0	0	109.5	Q229	Q229-G231 PolarHBondContact O-N 3.13Å
232	L	29.7	Very low	29.7	Very low	123 Å²	123	137 Å²	137	64%	0.644	73%	0.728	S	S	*	*			trans	-84.6	115.5	166.8	-82.2	160	0	0	0	108.6	C230	C230-L232 PolarHBondContact O-N 3.15Å
233	Q	26	Very low	29.9	Very low	153 Å²	153	134.5 Å²	134.5	72%	0.715	73%	0.727	S	S	*	*			trans	-55.8	137	174.7	-74.5	-170.9	-19.7	0	0	109.9	S235	Q233-S235 PolarHBondContact O-N 3.34Å
234	S	34.1	Very low	30.2	Very low	110 Å²	110	132.9 Å²	132.9	77%	0.769	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	7.2	-174.5	-160.4	0	0	0	0	115.2
235	S	35	Very low	30.6	Very low	83 Å²	83	129.6 Å²	129.6	58%	0.58	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	0.8	-175.1	49.4	0	0	0	0	114.6	Q233	Q233-S235 PolarHBondContact O-N 3.34Å
236	Q	33	Very low	30.9	Very low	155 Å²	155	126.4 Å²	126.4	72%	0.724	70%	0.695	S	S	*	*	S	Bend	trans	-115.8	6	179.8	-66.4	-167.6	-42.1	0	0	114.8	E238	Q236-E238 VanDerWaalsContact C-N 3.32Å; Q236-E238 PolarHBondContact O-N 3.03Å
237	I	34.5	Very low	31.3	Very low	133 Å²	133	125.3 Å²	125.3	68%	0.682	69%	0.685	S	S	*	*			trans	-94.8	67	173.5	-50.4	176.8	0	0	0	108
238	E	34	Very low	31.7	Very low	179 Å²	179	124.3 Å²	124.3	84%	0.836	68%	0.684	S	S	*	*			trans	-87	111.9	169.1	-79.7	-173	163.8	0	0	109.8	Q236	Q236-E238 VanDerWaalsContact C-N 3.32Å; Q236-E238 PolarHBondContact O-N 3.03Å
239	E	34.2	Very low	32.2	Very low	153 Å²	153	123.1 Å²	123.1	72%	0.715	68%	0.684	S	S	*	*			trans	48.5	81.1	148.5	-83.5	176.2	170.1	0	0	119.2
240	F	34.1	Very low	32.9	Very low	189 Å²	189	118.8 Å²	118.8	83%	0.829	67%	0.673	S	S	*	*			trans	-96.5	90.8	144.8	-147.8	-92.7	0	0	0	108.8	P242	F240-P242 WeakPolarHBondContact O-CD 3.48Å
241	N	36.6	Very low	33.7	Very low	98 Å²	98	119.5 Å²	119.5	52%	0.524	67%	0.665	S	S	.	*			trans	-107.5	99.8	177	-162.3	8.5	0	0	0	109.4	T245	N241-T245 PolarHBondContact OD1-O 2.77Å; N241-T245 PolarHBondContact OD1-OG1 3.35Å
242	P	35.5	Very low	34.6	Very low	64 Å²	64	119.3 Å²	119.3	42%	0.416	65%	0.647	S	S	.	*			trans	-61.7	144.8	173.9	14.8	-16.5	0	0	0	109.9	F240 G244 T245	F240-P242 WeakPolarHBondContact O-CD 3.48Å; P242-G244 PolarHBondContact O-N 3.09Å; P242-G244 VanDerWaalsContact O-N 3.1Å; P242-T245 WeakPolarHBondContact CD-OG1 2.76Å; P242-T245 VanDerWaalsContact CG-OG1 3.32Å; P242-T245 WeakPolarHBondContact CG-OG1 3.49Å; P242-T245 PolarHBondContact O-N 3.01Å; P242-T245 PolarHBondContact O-OG1 2.95Å
243	P	31.1	Very low	35.4	Very low	134 Å²	134	119.2 Å²	119.2	87%	0.87	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	119.4	-178.9	21.6	-30	0	0	0	110.1
244	G	34.4	Very low	36.1	Very low	70 Å²	70	115.4 Å²	115.4	72%	0.722	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	107.2	8.7	178.6	0	0	0	0	0	116.5	P242	P242-G244 PolarHBondContact O-N 3.09Å; P242-G244 VanDerWaalsContact O-N 3.1Å
245	T	33.2	Very low	36.5	Very low	31 Å²	31	113.7 Å²	113.7	19%	0.19	61%	0.607	C	S	.	*			trans	-109.8	94.7	177.6	13.4	0	0	0	0	112.6	N241 P242 I247	N241-T245 PolarHBondContact OD1-O 2.77Å; N241-T245 PolarHBondContact OD1-OG1 3.35Å; P242-T245 WeakPolarHBondContact CD-OG1 2.76Å; P242-T245 VanDerWaalsContact CG-OG1 3.32Å; P242-T245 WeakPolarHBondContact CG-OG1 3.49Å; P242-T245 PolarHBondContact O-N 3.01Å; P242-T245 PolarHBondContact O-OG1 2.95Å; T245-I247 VanDerWaalsContact C-N 3.34Å; T245-I247 HydrophobicContact CG2-CD1 4.12Å; T245-I247 HydrophobicContact CG2-CG1 4.01Å; T245-I247 PolarHBondContact O-N 3.2Å; T245-I247 VanDerWaalsContact O-N 3.16Å
246	T	30.6	Very low	37	Very low	152 Å²	152	115.2 Å²	115.2	93%	0.933	61%	0.608	S	S	*	*			trans	-83.5	80.6	165.4	-41.5	0	0	0	0	108.3
247	I	35.5	Very low	37.2	Very low	75 Å²	75	111 Å²	111	39%	0.385	60%	0.595	S	S	.	*			trans	-78.3	125	-176.5	-64.5	168.7	0	0	0	109.9	T245 K249	T245-I247 VanDerWaalsContact C-N 3.34Å; T245-I247 HydrophobicContact CG2-CD1 4.12Å; T245-I247 HydrophobicContact CG2-CG1 4.01Å; T245-I247 PolarHBondContact O-N 3.2Å; T245-I247 VanDerWaalsContact O-N 3.16Å; I247-K249 VanDerWaalsContact C-N 3.33Å; I247-K249 PolarHBondContact O-N 2.65Å
248	L	32.8	Very low	37.5	Very low	146 Å²	146	110.9 Å²	110.9	76%	0.764	59%	0.589	S	S	*	*			trans	-54.2	93.4	163.3	-77.8	154.3	0	0	0	109.1	S250	L248-S250 PolarHBondContact O-N 2.78Å
249	K	36.1	Very low	37.7	Very low	190 Å²	190	107.8 Å²	107.8	83%	0.826	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	2.9	-172.3	-75.4	-174.9	173.5	-176.2	0	116.1	I247	I247-K249 VanDerWaalsContact C-N 3.33Å; I247-K249 PolarHBondContact O-N 2.65Å
250	S	39.4	Very low	37.9	Very low	88 Å²	88	105.4 Å²	105.4	62%	0.615	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-8.7	-164.6	58	0	0	0	0	117.1	L248	L248-S250 PolarHBondContact O-N 2.78Å
251	K	44.1	Very low	38.1	Very low	111 Å²	111	100.6 Å²	100.6	48%	0.483	57%	0.568	S	S	.	*	S	Bend	trans	-137	-0.9	-168.9	-63.4	-171	-178.4	-173.3	0	117.7	E163	E163-K251 IonicContact OE1-NZ 3.89Å; E163-K251 PolarHBondContact OE1-NZ 3.28Å; E163-K251 IonicContact OE2-NZ 3.98Å
252	L	43.6	Very low	38.2	Very low	69 Å²	69	99.4 Å²	99.4	36%	0.361	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.2	122.5	-177.7	-82.9	153	0	0	0	110.6	F254	L252-F254 HydrophobicContact CB-CD2 4.37Å; L252-F254 HydrophobicContact CB-CE2 3.73Å; L252-F254 HydrophobicContact CB-CZ 4.34Å; L252-F254 HydrophobicContact CD1-CE2 4.44Å; L252-F254 HydrophobicContact CD1-CZ 4.48Å; L252-F254 HydrophobicContact CD2-CE2 4.29Å; L252-F254 HydrophobicContact CD2-CZ 4.06Å; L252-F254 HydrophobicContact CG-CE2 4.38Å
253	K	45.1	Very low	38.5	Very low	120 Å²	120	100.7 Å²	100.7	52%	0.522	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.3	124.8	166.1	-73	-172.6	178.1	-173.5	0	108.7
254	F	42	Very low	38.9	Very low	74 Å²	74	96.6 Å²	96.6	33%	0.325	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.9	170.4	-64	-88.7	0	0	0	108.2	I174 L252 T269	I174-F254 HydrophobicContact CD1-CZ 4.24Å; L252-F254 HydrophobicContact CB-CD2 4.37Å; L252-F254 HydrophobicContact CB-CE2 3.73Å; L252-F254 HydrophobicContact CB-CZ 4.34Å; L252-F254 HydrophobicContact CD1-CE2 4.44Å; L252-F254 HydrophobicContact CD1-CZ 4.48Å; L252-F254 HydrophobicContact CD2-CE2 4.29Å; L252-F254 HydrophobicContact CD2-CZ 4.06Å; L252-F254 HydrophobicContact CG-CE2 4.38Å; F254-T269 HydrophobicContact CD1-CG2 3.83Å; F254-T269 HydrophobicContact CE1-CG2 3.56Å
255	V	42.9	Very low	39.2	Very low	73 Å²	73	96.2 Å²	96.2	44%	0.442	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.7	168.6	-179.3	0	0	0	0	106.2	W267 T268	V255-W267 WeakPolarHBondContact O-CA 3.17Å; V255-T268 PolarHBondContact O-N 3.1Å
256	I	44.3	Very low	39.6	Very low	116 Å²	116	96.6 Å²	96.6	60%	0.595	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	116	172.6	-57.5	174.3	0	0	0	105.8	M265	I256-M265 HydrophobicContact CG2-CG 4.42Å
257	C	38.3	Very low	40.3	Very low	67 Å²	67	93.9 Å²	93.9	45%	0.453	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	128	173.5	-67.1	0	0	0	0	108.7	V266	C257-V266 PolarHBondContact N-O 3.34Å; C257-V266 PolarHBondContact O-N 3.04Å; C257-V266 VanDerWaalsContact O-N 3.14Å
258	F	39.3	Very low	40.6	Very low	130 Å²	130	92.8 Å²	92.8	57%	0.57	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	117	171	-170.6	-95.5	0	0	0	108.1	P260	F258-P260 HydrophobicContact CD1-CB 4.36Å; F258-P260 HydrophobicContact CE1-CB 4.12Å; F258-P260 VanDerWaalsContact O-CD 3.28Å; F258-P260 WeakPolarHBondContact O-CD 3.37Å
259	E	38.9	Very low	41.2	Very low	114 Å²	114	87.9 Å²	87.9	53%	0.533	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	102.6	173.6	-166.7	83.7	-131.4	0	0	108.5	A261 C262 N263 I264	E259-A261 PolarHBondContact O-N 3.37Å; E259-A261 VanDerWaalsContact O-N 3.14Å; E259-C262 HydrophobicContact CB-CB 4.32Å; E259-C262 HydrophobicContact CG-CB 4.11Å; E259-C262 PolarHBondContact O-N 3.24Å; E259-C262 VanDerWaalsContact O-N 3.11Å; E259-N263 PolarHBondContact O-N 3.19Å; E259-I264 PolarHBondContact N-O 2.98Å
260	P	38.9	Very low	41.5	Very low	102 Å²	102	84.7 Å²	84.7	66%	0.662	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.4	-176.2	23.7	-31.7	0	0	0	113.4	F258	F258-P260 HydrophobicContact CD1-CB 4.36Å; F258-P260 HydrophobicContact CE1-CB 4.12Å; F258-P260 VanDerWaalsContact O-CD 3.28Å; F258-P260 WeakPolarHBondContact O-CD 3.37Å
261	A	37.1	Very low	41.7	Very low	89 Å²	89	86.3 Å²	86.3	74%	0.736	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-20.9	177.1	0	0	0	0	0	113.8	E259	E259-A261 PolarHBondContact O-N 3.37Å; E259-A261 VanDerWaalsContact O-N 3.14Å
262	C	39.6	Very low	41.6	Very low	72 Å²	72	86 Å²	86	49%	0.486	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	-4.7	-169.6	-61.5	0	0	0	0	114.3	E259 I264	E259-C262 HydrophobicContact CB-CB 4.32Å; E259-C262 HydrophobicContact CG-CB 4.11Å; E259-C262 PolarHBondContact O-N 3.24Å; E259-C262 VanDerWaalsContact O-N 3.11Å; C262-I264 HydrophobicContact CB-CB 4.38Å; C262-I264 HydrophobicContact CB-CD1 3.6Å; C262-I264 HydrophobicContact CB-CG1 3.65Å; C262-I264 WeakPolarHBondContact O-CG1 3.33Å; C262-I264 PolarHBondContact O-N 2.92Å
263	N	41.9	Very low	41.2	Very low	92 Å²	92	88.5 Å²	88.5	49%	0.492	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	33.9	-171	-84.3	-21.8	0	0	0	112.8	E259	E259-N263 PolarHBondContact O-N 3.19Å
264	I	40	Very low	40.7	Very low	47 Å²	47	89.9 Å²	89.9	24%	0.241	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.4	179.5	-57.3	174.7	0	0	0	108.4	E259 C262 V266	E259-I264 PolarHBondContact N-O 2.98Å; C262-I264 HydrophobicContact CB-CB 4.38Å; C262-I264 HydrophobicContact CB-CD1 3.6Å; C262-I264 HydrophobicContact CB-CG1 3.65Å; C262-I264 WeakPolarHBondContact O-CG1 3.33Å; C262-I264 PolarHBondContact O-N 2.92Å; I264-V266 HydrophobicContact CG2-CG2 3.63Å
265	M	39.6	Very low	40.3	Very low	62 Å²	62	99.8 Å²	99.8	31%	0.305	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.5	165.4	-176.4	172.5	57.8	0	0	108.4	L178 I256 W267	L178-M265 HydrophobicContact CD2-CE 4.38Å; I256-M265 HydrophobicContact CG2-CG 4.42Å; M265-W267 HydrophobicContact CE-CE3 4.16Å; M265-W267 HydrophobicContact CE-CZ3 3.85Å; M265-W267 HydrophobicContact CG-CE3 4.43Å
266	V	42.7	Very low	40.1	Very low	39 Å²	39	101.2 Å²	101.2	24%	0.236	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.6	173	-172.8	0	0	0	0	108.4	C257 I264	C257-V266 PolarHBondContact N-O 3.34Å; C257-V266 PolarHBondContact O-N 3.04Å; C257-V266 VanDerWaalsContact O-N 3.14Å; I264-V266 HydrophobicContact CG2-CG2 3.63Å
267	W	44.8	Very low	39.9	Very low	95 Å²	95	100.4 Å²	100.4	36%	0.36	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	144	167.7	70.1	80.1	0	0	0	110.7	L178 V255 M265	L178-W267 HydrophobicContact CD1-CD2 4.23Å; L178-W267 HydrophobicContact CD1-CE3 4.43Å; L178-W267 HydrophobicContact CD1-CH2 4.46Å; L178-W267 HydrophobicContact CD1-CZ2 4.26Å; V255-W267 WeakPolarHBondContact O-CA 3.17Å; M265-W267 HydrophobicContact CE-CE3 4.16Å; M265-W267 HydrophobicContact CE-CZ3 3.85Å; M265-W267 HydrophobicContact CG-CE3 4.43Å
268	T	41.8	Very low	40	Very low	52 Å²	52	102.2 Å²	102.2	32%	0.319	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	137.9	171.1	69	0	0	0	0	109.7	V255	V255-T268 PolarHBondContact O-N 3.1Å
269	T	44.9	Very low	40.1	Very low	43 Å²	43	100.6 Å²	100.6	26%	0.264	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.5	170.1	54.3	0	0	0	0	108.8	F254	F254-T269 HydrophobicContact CD1-CG2 3.83Å; F254-T269 HydrophobicContact CE1-CG2 3.56Å
270	Q	43	Very low	40.1	Very low	123 Å²	123	99.8 Å²	99.8	58%	0.575	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	111.9	174.5	-165.4	178.4	12.8	0	0	109.4	Q272	Q270-Q272 PolarHBondContact O-N 3.47Å
271	R	43.2	Very low	40.2	Very low	122 Å²	122	99.6 Å²	99.6	46%	0.46	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	113.9	167.9	-159	179.1	-172.5	161	7.8	107.6	N164 N273	N164-R271 PolarHBondContact OD1-NH1 3.21Å; N164-R271 PolarHBondContact OD1-NH2 3.27Å; R271-N273 PolarHBondContact O-N 3.05Å
272	Q	41.7	Very low	40.4	Very low	104 Å²	104	100.4 Å²	100.4	49%	0.486	49%	0.493	S	S	.	.			trans	-72	110.4	170	-74.6	-170.5	-28.3	0	0	108.5	Q270 L274	Q270-Q272 PolarHBondContact O-N 3.47Å; Q272-L274 PolarHBondContact O-N 2.89Å
273	N	36.3	Very low	40.5	Very low	122 Å²	122	102.5 Å²	102.5	65%	0.652	49%	0.493	S	S	*	.			trans	-71.7	108.3	163.3	-74.4	-22	0	0	0	107.3	R271	R271-N273 PolarHBondContact O-N 3.05Å
274	L	33.6	Very low	40.4	Very low	149 Å²	149	103.4 Å²	103.4	78%	0.78	49%	0.493	S	S	*	.			trans	-78.9	129.4	160.2	-72.9	163.7	0	0	0	106.8	Q272	Q272-L274 PolarHBondContact O-N 2.89Å
275	F	33.1	Very low	40.4	Very low	283 Å²	283	108.5 Å²	108.5	100%	1.241	52%	0.516	S	S	*	.			trans	-54.8	0	174.1	-75.9	-88.9	0	0	0	112.6

Retrieved 275 of 275 residues in 122.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).