A0A077Z9Y5_TRITR Loading...

EF-hand 4 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z9Y5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 329 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.5	Very low	32	Very low	238 Å²	238	160.9 Å²	160.9	100%	1.172	78%	0.775	S	S	*	*				0	134	0	-68.3	-164.3	-166.3	0	0	106.8	V3	M1-V3 PolarHBondContact O-N 2.88Å
2	D	29.7	Very low	32.6	Very low	168 Å²	168	152.6 Å²	152.6	90%	0.898	74%	0.744	S	S	*	*			trans	-45.4	117.3	-154.8	-68.8	-69.8	0	0	0	116.2
3	V	28.4	Very low	33.2	Very low	141 Å²	141	150.1 Å²	150.1	86%	0.855	74%	0.743	S	S	*	*			trans	-105.4	103	162.8	-174.4	0	0	0	0	106.1	M1	M1-V3 PolarHBondContact O-N 2.88Å
4	Q	32.5	Very low	33.2	Very low	164 Å²	164	149 Å²	149	77%	0.766	74%	0.742	S	S	*	*			trans	-55	140	175.7	-72.7	-146.5	-24.2	0	0	111.1	F6	Q4-F6 PolarHBondContact O-N 3.41Å
5	Q	27.5	Very low	33.7	Very low	180 Å²	180	148.8 Å²	148.8	84%	0.841	74%	0.74	S	S	*	*			trans	-56	88.6	177.9	-164	112.5	-0.1	0	0	111.4
6	F	30.5	Very low	33.6	Very low	165 Å²	165	150.9 Å²	150.9	72%	0.724	75%	0.747	S	S	*	*			trans	-94.8	98.8	164	-103	-87	0	0	0	108.6	Q4 Y8	Q4-F6 PolarHBondContact O-N 3.41Å; F6-Y8 VanDerWaalsContact C-N 3.29Å; F6-Y8 AromaticContact CD1-CD2 3.89Å; F6-Y8 HydrophobicContact CD1-CD2 3.89Å; F6-Y8 AromaticContact CD1-CE2 3.89Å; F6-Y8 HydrophobicContact CD1-CE2 3.89Å; F6-Y8 HydrophobicContact CE1-CE2 4.29Å; F6-Y8 PolarHBondContact O-N 3.36Å
7	D	32	Very low	33.3	Very low	139 Å²	139	150.8 Å²	150.8	74%	0.743	75%	0.749	S	S	*	*			trans	-78.1	76.6	176.6	-145.1	-8.6	0	0	0	108.8	R9	D7-R9 PolarHBondContact O-N 2.91Å
8	Y	35.1	Very low	33.2	Very low	184 Å²	184	150.8 Å²	150.8	72%	0.722	75%	0.752	S	S	*	*			trans	-86.7	85.8	175.8	-110.4	-87.5	0	0	0	109.8	F6 I10	F6-Y8 VanDerWaalsContact C-N 3.29Å; F6-Y8 AromaticContact CD1-CD2 3.89Å; F6-Y8 HydrophobicContact CD1-CD2 3.89Å; F6-Y8 AromaticContact CD1-CE2 3.89Å; F6-Y8 HydrophobicContact CD1-CE2 3.89Å; F6-Y8 HydrophobicContact CE1-CE2 4.29Å; F6-Y8 PolarHBondContact O-N 3.36Å; Y8-I10 VanDerWaalsContact C-N 3.32Å; Y8-I10 HydrophobicContact CD1-CD1 4.11Å; Y8-I10 HydrophobicContact CD1-CG1 3.8Å; Y8-I10 PolarHBondContact O-N 2.81Å
9	R	31.6	Very low	33.3	Very low	239 Å²	239	148.8 Å²	148.8	90%	0.902	76%	0.761	S	S	*	*			trans	-69.8	88	160.9	-86.1	-174.3	171.2	-166.9	-2.6	109	D7 S11	D7-R9 PolarHBondContact O-N 2.91Å; R9-S11 PolarHBondContact O-N 2.9Å
10	I	38.8	Very low	33.4	Very low	89 Å²	89	146 Å²	146	46%	0.456	76%	0.761	S	S	.	*			trans	-82.1	97.7	164.7	-58.9	-172	0	0	0	107.1	Y8	Y8-I10 VanDerWaalsContact C-N 3.32Å; Y8-I10 HydrophobicContact CD1-CD1 4.11Å; Y8-I10 HydrophobicContact CD1-CG1 3.8Å; Y8-I10 PolarHBondContact O-N 2.81Å
11	S	33.2	Very low	33.3	Very low	63 Å²	63	141.6 Å²	141.6	44%	0.441	75%	0.751	S	S	.	*			trans	-85.6	134.5	169.5	179.7	0	0	0	0	109.2	R9 V13 N14	R9-S11 PolarHBondContact O-N 2.9Å; S11-V13 PolarHBondContact O-N 3.48Å; S11-N14 PolarHBondContact O-N 3.33Å
12	C	39.6	Very low	33.2	Very low	61 Å²	61	139 Å²	139	41%	0.412	74%	0.736	S	S	.	*	G	3₁₀ helix	trans	-53.6	-15.6	176.7	-72	0	0	0	0	115.3	W38 G47	C12-W38 WeakPolarHBondContact SG-CZ2 3.31Å; C12-G47 PolarHBondContact N-O 3.23Å; C12-G47 WeakPolarHBondContact SG-CA 3.38Å; C12-G47 PolarHBondContact SG-O 3.37Å
13	V	39.9	Very low	33.6	Very low	120 Å²	120	138.2 Å²	138.2	73%	0.727	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-87.6	-10.2	-172.6	-165.8	0	0	0	0	112.8	S11	S11-V13 PolarHBondContact O-N 3.48Å
14	N	33.4	Very low	33.8	Very low	135 Å²	135	137.6 Å²	137.6	72%	0.722	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-106.1	16	-176	-90.4	-16.9	0	0	0	115.3	S11 E16	S11-N14 PolarHBondContact O-N 3.33Å; N14-E16 PolarHBondContact O-N 3.26Å
15	M	40.2	Very low	34	Very low	146 Å²	146	136.3 Å²	136.3	72%	0.719	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	3.1	177.7	-96.2	-73.3	-164.6	0	0	114.3	F34	M15-F34 HydrophobicContact CE-CZ 4.4Å
16	E	32.5	Very low	34.5	Very low	182 Å²	182	133.6 Å²	133.6	85%	0.85	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	0.8	178.2	-157.3	159.2	-171.9	0	0	113.9	N14	N14-E16 PolarHBondContact O-N 3.26Å
17	L	29.2	Very low	35.1	Very low	150 Å²	150	128 Å²	128	79%	0.785	68%	0.679	S	S	*	*	S	Bend	trans	-140.4	15.4	-164.4	-118	127.2	0	0	0	120.5
18	L	31	Very low	35.3	Very low	151 Å²	151	131.1 Å²	131.1	79%	0.791	68%	0.68	S	S	*	*			trans	-146.6	38.4	173.2	-95.9	168.5	0	0	0	114.7	A20	L18-A20 VanDerWaalsContact C-N 3.27Å
19	A	35.2	Very low	35.4	Very low	113 Å²	113	125.8 Å²	125.8	93%	0.934	68%	0.681	S	S	*	*	S	Bend	trans	-85	-3.1	161.4	0	0	0	0	0	112.7
20	A	34.4	Very low	36.2	Very low	91 Å²	91	120.8 Å²	120.8	75%	0.752	67%	0.666	S	S	*	*	S	Bend	trans	-103.3	91.9	176.5	0	0	0	0	0	109.8	L18	L18-A20 VanDerWaalsContact C-N 3.27Å
21	G	31.4	Very low	37	Very low	54 Å²	54	121 Å²	121	56%	0.557	68%	0.681	S	S	*	*	S	Bend	trans	127.5	96.8	174.9	0	0	0	0	0	111.8
22	E	32.1	Very low	38	Very low	184 Å²	184	125 Å²	125	86%	0.86	69%	0.691	S	S	*	*	S	Bend	trans	40.7	82.4	149.4	-63.7	174.4	155.1	0	0	116.5
23	D	36.6	Very low	39.2	Very low	152 Å²	152	123.3 Å²	123.3	81%	0.813	68%	0.679	S	S	*	*				-179.7	144.8	123.3	-95	-29.6	0	0	0	113.6
24	R	33.7	Very low	40.5	Very low	127 Å²	127	122.3 Å²	122.3	48%	0.479	67%	0.665	S	S	.	*			trans	-62.9	124.1	-168.2	-62.9	170.7	174.6	-142.4	-8.3	113.6	E99	R24-E99 IonicContact CZ-OE2 3.47Å; R24-E99 IonicContact NH1-OE2 3.23Å; R24-E99 PolarHBondContact NH1-OE2 3.32Å; R24-E99 IonicContact NH2-OE2 2.84Å; R24-E99 PolarHBondContact NH2-OE2 2.94Å
25	F	36	Very low	42.2	Very low	137 Å²	137	121.6 Å²	121.6	60%	0.601	66%	0.658	S	S	*	*			trans	-148.4	80.8	143.7	-97.9	-81.7	0	0	0	109.8	I27 I84	F25-I27 PolarHBondContact O-N 3.42Å; F25-I84 HydrophobicContact CE1-CG2 4.48Å; F25-I84 HydrophobicContact CE2-CG2 4.27Å; F25-I84 HydrophobicContact CZ-CB 4.49Å; F25-I84 HydrophobicContact CZ-CG1 4.37Å; F25-I84 HydrophobicContact CZ-CG2 3.65Å
26	V	38.9	Very low	43.5	Very low	123 Å²	123	119.1 Å²	119.1	75%	0.745	64%	0.644	S	S	*	*			trans	-95.5	90.2	171.4	-177.9	0	0	0	0	108.1	R28	V26-R28 HydrophobicContact CG1-CG 4.01Å; V26-R28 PolarHBondContact O-N 3.18Å
27	I	41.8	Very low	45.4	Very low	49 Å²	49	110.8 Å²	110.8	25%	0.251	61%	0.605	S	S	.	*			trans	-71	93	153.7	-59	-177.6	0	0	0	104.8	F25 G29 T33 I37 V61	F25-I27 PolarHBondContact O-N 3.42Å; I27-G29 PolarHBondContact O-N 3.47Å; I27-T33 HydrophobicContact CG2-CG2 3.97Å; I27-I37 HydrophobicContact CD1-CD1 3.98Å; I27-V61 HydrophobicContact CD1-CG2 4.31Å
28	R	37.7	Very low	47.5	Very low	203 Å²	203	105.7 Å²	105.7	77%	0.766	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.3	112.9	176.8	-91	-177.6	166.2	170.8	-4.7	109.6	V26	V26-R28 HydrophobicContact CG1-CG 4.01Å; V26-R28 PolarHBondContact O-N 3.18Å
29	G	36.3	Very low	49.5	Very low	72 Å²	72	103.3 Å²	103.3	74%	0.742	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	111.8	-7.9	149.2	0	0	0	0	0	118.5	I27	I27-G29 PolarHBondContact O-N 3.47Å
30	K	49.2	Very low	51.4	Low	135 Å²	135	100.9 Å²	100.9	59%	0.587	53%	0.533	S	S	*	.			trans	-156.3	104.5	179.2	-69	-172.2	-176.4	175	0	111.1	F32 T33 F34	K30-F32 HydrophobicContact CB-CB 4.09Å; K30-F32 PolarHBondContact O-N 3.05Å; K30-F32 VanDerWaalsContact O-N 3.1Å; K30-T33 VanDerWaalsContact CB-OG1 3.22Å; K30-T33 WeakPolarHBondContact CB-OG1 2.95Å; K30-T33 WeakPolarHBondContact O-CA 3.19Å; K30-T33 WeakPolarHBondContact O-CB 3.46Å; K30-T33 PolarHBondContact O-N 3.19Å; K30-F34 PolarHBondContact O-N 2.86Å
31	A	53.8	Low	53.2	Low	93 Å²	93	96.6 Å²	96.6	77%	0.769	50%	0.497	S	S	*	.	H	α-helix	trans	-50	-31.5	158.6	0	0	0	0	0	110.7	T33 F34 M35	A31-T33 VanDerWaalsContact C-N 3.31Å; A31-T33 PolarHBondContact O-N 3.27Å; A31-F34 PolarHBondContact O-N 2.82Å; A31-M35 PolarHBondContact O-N 2.78Å
32	F	55.6	Low	55.4	Low	146 Å²	146	94.4 Å²	94.4	64%	0.64	47%	0.472	S	S	*	.	H	α-helix	trans	-58.1	-33.9	170	-167	-94.5	0	0	0	114.3	K30 K36	K30-F32 HydrophobicContact CB-CB 4.09Å; K30-F32 PolarHBondContact O-N 3.05Å; K30-F32 VanDerWaalsContact O-N 3.1Å; F32-K36 HydrophobicContact CE1-CD 4.17Å; F32-K36 WeakPolarHBondContact O-CB 3.48Å; F32-K36 PolarHBondContact O-N 2.81Å
33	T	64.5	Low	57.1	Low	26 Å²	26	90.1 Å²	90.1	16%	0.16	46%	0.463	C	S	.	.	H	α-helix	trans	-72	-42.8	177.3	-67.4	0	0	0	0	110.8	I27 K30 A31 K36 I37 A64 L70	I27-T33 HydrophobicContact CG2-CG2 3.97Å; K30-T33 VanDerWaalsContact CB-OG1 3.22Å; K30-T33 WeakPolarHBondContact CB-OG1 2.95Å; K30-T33 WeakPolarHBondContact O-CA 3.19Å; K30-T33 WeakPolarHBondContact O-CB 3.46Å; K30-T33 PolarHBondContact O-N 3.19Å; A31-T33 VanDerWaalsContact C-N 3.31Å; A31-T33 PolarHBondContact O-N 3.27Å; T33-K36 PolarHBondContact O-N 3.05Å; T33-I37 HydrophobicContact CG2-CD1 3.7Å; T33-I37 HydrophobicContact CG2-CG1 4.23Å; T33-I37 WeakPolarHBondContact O-CB 3.41Å; T33-I37 WeakPolarHBondContact O-CG1 3.49Å; T33-I37 PolarHBondContact O-N 3.18Å; T33-A64 HydrophobicContact CG2-CB 4.18Å; T33-L70 HydrophobicContact CG2-CD1 4.3Å
34	F	66.6	Low	58.5	Low	99 Å²	99	87.9 Å²	87.9	43%	0.434	45%	0.451	S	S	.	.	H	α-helix	trans	-62.7	-48	176	-180	-94.7	0	0	0	111.2	M15 K30 A31 K36 I37 W38	M15-F34 HydrophobicContact CE-CZ 4.4Å; K30-F34 PolarHBondContact O-N 2.86Å; A31-F34 PolarHBondContact O-N 2.82Å; F34-K36 VanDerWaalsContact C-N 3.29Å; F34-K36 PolarHBondContact O-N 3.23Å; F34-I37 PolarHBondContact O-N 2.81Å; F34-W38 HydrophobicContact CE1-CE3 4.45Å; F34-W38 HydrophobicContact CZ-CE3 4.17Å; F34-W38 WeakPolarHBondContact O-CB 3.04Å; F34-W38 PolarHBondContact O-N 3.14Å
35	M	68.7	Low	59.9	Low	120 Å²	120	92.5 Å²	92.5	59%	0.591	47%	0.468	S	S	*	.	H	α-helix	trans	-62.5	-37.3	177.5	-172.6	177.4	-83.2	0	0	111.9	A31 W38 N39	A31-M35 PolarHBondContact O-N 2.78Å; M35-W38 PolarHBondContact O-N 3.26Å; M35-N39 VanDerWaalsContact O-CB 3.32Å; M35-N39 WeakPolarHBondContact O-CB 3.23Å; M35-N39 VanDerWaalsContact O-CG 3.25Å; M35-N39 PolarHBondContact O-N 3.25Å
36	K	69.1	Low	61.3	Low	95 Å²	95	90 Å²	90	41%	0.413	46%	0.464	S	S	.	.	H	α-helix	trans	-67.1	-41.6	174.3	-174.1	167.4	178.8	-179.7	0	112.5	F32 T33 F34 W38 E40 L70	F32-K36 HydrophobicContact CE1-CD 4.17Å; F32-K36 WeakPolarHBondContact O-CB 3.48Å; F32-K36 PolarHBondContact O-N 2.81Å; T33-K36 PolarHBondContact O-N 3.05Å; F34-K36 VanDerWaalsContact C-N 3.29Å; F34-K36 PolarHBondContact O-N 3.23Å; K36-W38 VanDerWaalsContact C-N 3.33Å; K36-E40 VanDerWaalsContact O-CB 3.29Å; K36-E40 WeakPolarHBondContact O-CB 3.5Å; K36-E40 PolarHBondContact O-N 3.03Å; K36-L70 HydrophobicContact CB-CD1 4.25Å; K36-L70 HydrophobicContact CD-CD1 3.9Å; K36-L70 HydrophobicContact CG-CD1 3.88Å
37	I	70.9	Confident	62.7	Low	6 Å²	6	85.2 Å²	85.2	3%	0.031	44%	0.44	C	S	.	.	H	α-helix	trans	-62	-44.5	173.9	-69.3	168.7	0	0	0	110	I27 T33 F34 E40 A41 A57 F60 V61 A64 L70	I27-I37 HydrophobicContact CD1-CD1 3.98Å; T33-I37 HydrophobicContact CG2-CD1 3.7Å; T33-I37 HydrophobicContact CG2-CG1 4.23Å; T33-I37 WeakPolarHBondContact O-CB 3.41Å; T33-I37 WeakPolarHBondContact O-CG1 3.49Å; T33-I37 PolarHBondContact O-N 3.18Å; F34-I37 PolarHBondContact O-N 2.81Å; I37-E40 PolarHBondContact O-N 3.48Å; I37-A41 WeakPolarHBondContact O-CB 3.32Å; I37-A41 PolarHBondContact O-N 3.24Å; I37-A57 HydrophobicContact CG2-CB 4.26Å; I37-F60 HydrophobicContact CB-CB 4.34Å; I37-F60 HydrophobicContact CG1-CB 4.04Å; I37-F60 HydrophobicContact CG2-CB 3.72Å; I37-V61 HydrophobicContact CD1-CG2 4.03Å; I37-V61 HydrophobicContact CG2-CG2 4.32Å; I37-A64 HydrophobicContact CD1-CB 4.12Å; I37-L70 HydrophobicContact CG1-CD1 4.01Å; I37-L70 HydrophobicContact CG1-CD2 4.17Å
38	W	74	Confident	63.9	Low	44 Å²	44	85.4 Å²	85.4	17%	0.167	45%	0.446	C	S	.	.	H	α-helix	trans	-61.9	-51.1	177.4	-175.4	-81.6	0	0	0	111.4	C12 F34 M35 K36 E40 A41 D42 L49	C12-W38 WeakPolarHBondContact SG-CZ2 3.31Å; F34-W38 HydrophobicContact CE1-CE3 4.45Å; F34-W38 HydrophobicContact CZ-CE3 4.17Å; F34-W38 WeakPolarHBondContact O-CB 3.04Å; F34-W38 PolarHBondContact O-N 3.14Å; M35-W38 PolarHBondContact O-N 3.26Å; K36-W38 VanDerWaalsContact C-N 3.33Å; W38-E40 VanDerWaalsContact C-N 3.27Å; W38-E40 PolarHBondContact O-N 3.45Å; W38-A41 PolarHBondContact O-N 3.27Å; W38-A41 VanDerWaalsContact O-N 3.16Å; W38-D42 WeakPolarHBondContact O-CB 3.3Å; W38-D42 PolarHBondContact O-N 3.02Å; W38-L49 HydrophobicContact CD2-CD1 4.46Å; W38-L49 HydrophobicContact CE3-CD1 3.73Å; W38-L49 HydrophobicContact CE3-CG 4.2Å; W38-L49 HydrophobicContact CH2-CD1 3.87Å; W38-L49 HydrophobicContact CH2-CG 3.71Å; W38-L49 HydrophobicContact CZ2-CG 4.04Å; W38-L49 HydrophobicContact CZ3-CD1 3.4Å; W38-L49 VanDerWaalsContact CZ3-CD1 3.4Å; W38-L49 HydrophobicContact CZ3-CG 3.79Å
39	N	73.4	Confident	65.4	Low	101 Å²	101	77.8 Å²	77.8	54%	0.54	42%	0.42	S	S	.	.	H	α-helix	trans	-62.8	-33.3	-179.4	-75.7	-12.5	0	0	0	112.9	M35	M35-N39 VanDerWaalsContact O-CB 3.32Å; M35-N39 WeakPolarHBondContact O-CB 3.23Å; M35-N39 VanDerWaalsContact O-CG 3.25Å; M35-N39 PolarHBondContact O-N 3.25Å
40	E	74.6	Confident	67.1	Low	62 Å²	62	77.7 Å²	77.7	29%	0.29	40%	0.402	S	S	.	.	H	α-helix	trans	-77.8	-34.4	176.3	-168	71.5	-167.9	0	0	111.6	K36 I37 W38 F60 S72	K36-E40 VanDerWaalsContact O-CB 3.29Å; K36-E40 WeakPolarHBondContact O-CB 3.5Å; K36-E40 PolarHBondContact O-N 3.03Å; I37-E40 PolarHBondContact O-N 3.48Å; W38-E40 VanDerWaalsContact C-N 3.27Å; W38-E40 PolarHBondContact O-N 3.45Å; E40-F60 HydrophobicContact CB-CD2 4.43Å; E40-F60 HydrophobicContact CB-CE2 4.01Å; E40-F60 HydrophobicContact CB-CZ 4.11Å; E40-F60 HydrophobicContact CG-CD1 4.45Å; E40-F60 HydrophobicContact CG-CD2 4.26Å; E40-F60 HydrophobicContact CG-CE1 3.68Å; E40-F60 HydrophobicContact CG-CE2 3.45Å; E40-F60 VanDerWaalsContact CG-CE2 3.45Å; E40-F60 HydrophobicContact CG-CZ 3.12Å; E40-S72 PolarHBondContact OE1-N 3.05Å; E40-S72 PolarHBondContact OE1-OG 3.49Å
41	A	73.1	Confident	68.3	Low	0 Å²	0	81.1 Å²	81.1	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-77.4	-35.9	178.1	0	0	0	0	0	113.5	I37 W38 S43 L49 S53 A57 F60	I37-A41 WeakPolarHBondContact O-CB 3.32Å; I37-A41 PolarHBondContact O-N 3.24Å; W38-A41 PolarHBondContact O-N 3.27Å; W38-A41 VanDerWaalsContact O-N 3.16Å; A41-S43 VanDerWaalsContact C-N 3.26Å; A41-S43 PolarHBondContact O-N 3.31Å; A41-S43 VanDerWaalsContact O-N 3.12Å; A41-L49 HydrophobicContact CB-CD2 3.85Å; A41-S53 WeakPolarHBondContact O-CB 3.09Å; A41-S53 PolarHBondContact O-OG 2.58Å; A41-A57 HydrophobicContact CB-CB 3.63Å; A41-F60 HydrophobicContact CB-CD2 4.47Å
42	D	76.8	Confident	69.2	Low	8 Å²	8	81.8 Å²	81.8	4%	0.043	41%	0.406	C	S	.	.			trans	-85.9	63.8	174.8	-171	11.8	0	0	0	110.2	W38 N44 R45 T46 G47 L49	W38-D42 WeakPolarHBondContact O-CB 3.3Å; W38-D42 PolarHBondContact O-N 3.02Å; D42-N44 PolarHBondContact O-N 2.89Å; D42-R45 PolarHBondContact O-N 2.79Å; D42-R45 WeakPolarHBondContact OD1-CA 3.33Å; D42-R45 PolarHBondContact OD1-N 2.87Å; D42-R45 WeakPolarHBondContact OD2-CA 3.29Å; D42-T46 PolarHBondContact OD1-N 3.19Å; D42-T46 PolarHBondContact OD1-OG1 3.39Å; D42-T46 PolarHBondContact OD2-N 2.99Å; D42-T46 VanDerWaalsContact OD2-N 3.07Å; D42-G47 PolarHBondContact OD2-N 3.49Å; D42-L49 HydrophobicContact CB-CD2 3.93Å
43	S	68	Low	70	Confident	94 Å²	94	75.2 Å²	75.2	66%	0.657	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-21.1	177.1	-43.2	0	0	0	0	112.8	A41	A41-S43 VanDerWaalsContact C-N 3.26Å; A41-S43 PolarHBondContact O-N 3.31Å; A41-S43 VanDerWaalsContact O-N 3.12Å
44	N	64.9	Low	70.5	Confident	105 Å²	105	78.8 Å²	78.8	56%	0.561	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-2	-179.4	-62.2	-23	0	0	0	113.2	D42 T46	D42-N44 PolarHBondContact O-N 2.89Å; N44-T46 HydrophobicContact CB-CG2 3.59Å; N44-T46 PolarHBondContact O-N 3.36Å
45	R	64.8	Low	70.8	Confident	225 Å²	225	80 Å²	80	85%	0.849	40%	0.397	S	S	*	.			trans	45.5	36	-175.3	-63.1	-177	178	-112.2	0.7	112.8	D42 G47	D42-R45 PolarHBondContact O-N 2.79Å; D42-R45 WeakPolarHBondContact OD1-CA 3.33Å; D42-R45 PolarHBondContact OD1-N 2.87Å; D42-R45 WeakPolarHBondContact OD2-CA 3.29Å; R45-G47 PolarHBondContact O-N 2.77Å
46	T	65.5	Low	71	Confident	83 Å²	83	75.2 Å²	75.2	51%	0.509	38%	0.377	S	S	.	.			trans	-80.5	-9.1	-174.7	56.7	0	0	0	0	112.2	D42 N44 S48	D42-T46 PolarHBondContact OD1-N 3.19Å; D42-T46 PolarHBondContact OD1-OG1 3.39Å; D42-T46 PolarHBondContact OD2-N 2.99Å; D42-T46 VanDerWaalsContact OD2-N 3.07Å; N44-T46 HydrophobicContact CB-CG2 3.59Å; N44-T46 PolarHBondContact O-N 3.36Å; T46-S48 PolarHBondContact O-N 3.27Å; T46-S48 PolarHBondContact OG1-N 2.88Å; T46-S48 PolarHBondContact OG1-O 3.01Å; T46-S48 PolarHBondContact OG1-OG 3.41Å
47	G	67.2	Low	71.3	Confident	23 Å²	23	71.3 Å²	71.3	24%	0.237	36%	0.363	C	S	.	.	S	Bend	trans	66.3	21.2	-170	0	0	0	0	0	111.7	C12 D42 R45	C12-G47 PolarHBondContact N-O 3.23Å; C12-G47 WeakPolarHBondContact SG-CA 3.38Å; C12-G47 PolarHBondContact SG-O 3.37Å; D42-G47 PolarHBondContact OD2-N 3.49Å; R45-G47 PolarHBondContact O-N 2.77Å
48	S	67.2	Low	71.5	Confident	54 Å²	54	72.9 Å²	72.9	38%	0.378	37%	0.371	S	S	.	.	S	Bend	trans	-150.4	139.7	176.9	61.1	0	0	0	0	108.5	T46	T46-S48 PolarHBondContact O-N 3.27Å; T46-S48 PolarHBondContact OG1-N 2.88Å; T46-S48 PolarHBondContact OG1-O 3.01Å; T46-S48 PolarHBondContact OG1-OG 3.41Å
49	L	69.3	Low	71.3	Confident	42 Å²	42	73.9 Å²	73.9	22%	0.22	38%	0.376	C	S	.	.			trans	-91.4	118	174.3	-63.2	171.4	0	0	0	108.1	W38 A41 D42 F54 A57	W38-L49 HydrophobicContact CD2-CD1 4.46Å; W38-L49 HydrophobicContact CE3-CD1 3.73Å; W38-L49 HydrophobicContact CE3-CG 4.2Å; W38-L49 HydrophobicContact CH2-CD1 3.87Å; W38-L49 HydrophobicContact CH2-CG 3.71Å; W38-L49 HydrophobicContact CZ2-CG 4.04Å; W38-L49 HydrophobicContact CZ3-CD1 3.4Å; W38-L49 VanDerWaalsContact CZ3-CD1 3.4Å; W38-L49 HydrophobicContact CZ3-CG 3.79Å; A41-L49 HydrophobicContact CB-CD2 3.85Å; D42-L49 HydrophobicContact CB-CD2 3.93Å; L49-F54 HydrophobicContact CB-CB 4.37Å; L49-A57 HydrophobicContact CD1-CB 4.15Å
50	D	73	Confident	71.2	Confident	70 Å²	70	69.1 Å²	69.1	37%	0.374	35%	0.351	S	S	.	.			trans	-66.5	171.2	165.9	75.7	30	0	0	0	110.5	T52 S53 F54	D50-T52 PolarHBondContact O-N 3Å; D50-T52 VanDerWaalsContact O-N 3.14Å; D50-T52 VanDerWaalsContact OD1-CA 3.3Å; D50-T52 WeakPolarHBondContact OD1-CA 3.24Å; D50-T52 VanDerWaalsContact OD1-CB 3.24Å; D50-T52 WeakPolarHBondContact OD1-CB 3.3Å; D50-T52 PolarHBondContact OD1-N 3.3Å; D50-S53 PolarHBondContact O-N 2.72Å; D50-S53 PolarHBondContact OD1-N 2.71Å; D50-S53 PolarHBondContact OD1-OG 2.78Å; D50-F54 WeakPolarHBondContact O-CB 3.43Å; D50-F54 PolarHBondContact O-N 3Å
51	R	72.7	Confident	71	Confident	208 Å²	208	67 Å²	67	79%	0.785	34%	0.342	S	S	*	.	H	α-helix	trans	-52.4	-40.1	-179.8	174.7	-179.8	-89.7	166.9	-5.2	111.9	F55	R51-F55 HydrophobicContact CG-CD2 3.93Å; R51-F55 HydrophobicContact CG-CE2 3.5Å; R51-F55 WeakPolarHBondContact O-CD2 2.97Å; R51-F55 PolarHBondContact O-N 2.84Å
52	T	73.5	Confident	70.8	Confident	106 Å²	106	67.1 Å²	67.1	65%	0.65	34%	0.343	S	S	*	.	H	α-helix	trans	-71.7	-46.1	-178	-46.7	0	0	0	0	110.7	D50 F54 F55 A56	D50-T52 PolarHBondContact O-N 3Å; D50-T52 VanDerWaalsContact O-N 3.14Å; D50-T52 VanDerWaalsContact OD1-CA 3.3Å; D50-T52 WeakPolarHBondContact OD1-CA 3.24Å; D50-T52 VanDerWaalsContact OD1-CB 3.24Å; D50-T52 WeakPolarHBondContact OD1-CB 3.3Å; D50-T52 PolarHBondContact OD1-N 3.3Å; T52-F54 VanDerWaalsContact C-N 3.32Å; T52-F54 PolarHBondContact O-N 3.41Å; T52-F55 PolarHBondContact O-N 3.19Å; T52-A56 PolarHBondContact O-N 3.44Å
53	S	71.8	Confident	70.4	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.063	34%	0.341	C	S	.	.	H	α-helix	trans	-61.4	-37.1	175.4	-71.5	0	0	0	0	112.3	A41 D50 A56 A57	A41-S53 WeakPolarHBondContact O-CB 3.09Å; A41-S53 PolarHBondContact O-OG 2.58Å; D50-S53 PolarHBondContact O-N 2.72Å; D50-S53 PolarHBondContact OD1-N 2.71Å; D50-S53 PolarHBondContact OD1-OG 2.78Å; S53-A56 WeakPolarHBondContact O-CB 3.34Å; S53-A56 PolarHBondContact O-N 3.46Å; S53-A57 WeakPolarHBondContact O-CB 3.5Å; S53-A57 PolarHBondContact O-N 3.27Å
54	F	74.6	Confident	70.4	Confident	101 Å²	101	63.5 Å²	63.5	44%	0.443	32%	0.32	S	S	.	.	H	α-helix	trans	-64.7	-45.1	174.1	179.9	-99.9	0	0	0	111.8	L49 D50 T52 A56 A57 L58	L49-F54 HydrophobicContact CB-CB 4.37Å; D50-F54 WeakPolarHBondContact O-CB 3.43Å; D50-F54 PolarHBondContact O-N 3Å; T52-F54 VanDerWaalsContact C-N 3.32Å; T52-F54 PolarHBondContact O-N 3.41Å; F54-A56 VanDerWaalsContact C-N 3.31Å; F54-A56 PolarHBondContact O-N 3.34Å; F54-A57 WeakPolarHBondContact O-CB 3.43Å; F54-A57 PolarHBondContact O-N 2.76Å; F54-L58 HydrophobicContact CD1-CD1 4.1Å; F54-L58 HydrophobicContact CD1-CG 4.44Å; F54-L58 HydrophobicContact CE1-CD1 3.48Å; F54-L58 VanDerWaalsContact CE1-CD1 3.48Å; F54-L58 HydrophobicContact CE1-CG 4Å; F54-L58 HydrophobicContact CZ-CD1 3.94Å; F54-L58 HydrophobicContact CZ-CD2 4.36Å; F54-L58 HydrophobicContact CZ-CG 4.12Å; F54-L58 PolarHBondContact O-N 2.8Å
55	F	72.9	Confident	70.4	Confident	123 Å²	123	62.4 Å²	62.4	54%	0.539	31%	0.312	S	S	.	.	H	α-helix	trans	-63.9	-37.8	174.3	-73.2	-59.6	0	0	0	112.2	R51 T52 L58 K59	R51-F55 HydrophobicContact CG-CD2 3.93Å; R51-F55 HydrophobicContact CG-CE2 3.5Å; R51-F55 WeakPolarHBondContact O-CD2 2.97Å; R51-F55 PolarHBondContact O-N 2.84Å; T52-F55 PolarHBondContact O-N 3.19Å; F55-L58 PolarHBondContact O-N 3.14Å; F55-K59 WeakPolarHBondContact O-CB 3.48Å; F55-K59 PolarHBondContact O-N 2.82Å
56	A	72.9	Confident	70.4	Confident	21 Å²	21	56 Å²	56	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-45.8	172.5	0	0	0	0	0	111	T52 S53 F54 L58 K59 F60 L75	T52-A56 PolarHBondContact O-N 3.44Å; S53-A56 WeakPolarHBondContact O-CB 3.34Å; S53-A56 PolarHBondContact O-N 3.46Å; F54-A56 VanDerWaalsContact C-N 3.31Å; F54-A56 PolarHBondContact O-N 3.34Å; A56-L58 PolarHBondContact O-N 3.22Å; A56-K59 CarbonylContact O-C 3.46Å; A56-K59 PolarHBondContact O-N 3.4Å; A56-K59 VanDerWaalsContact O-N 3.12Å; A56-F60 HydrophobicContact CB-CD2 4.49Å; A56-F60 HydrophobicContact CB-CE2 4.35Å; A56-F60 WeakPolarHBondContact O-CD2 3.15Å; A56-F60 PolarHBondContact O-N 3.28Å; A56-L75 HydrophobicContact CB-CD2 4.31Å
57	A	76	Confident	70.3	Confident	13 Å²	13	57.8 Å²	57.8	11%	0.107	31%	0.307	C	S	.	.	H	α-helix	trans	-57.9	-46.3	175.9	0	0	0	0	0	111.7	I37 A41 L49 S53 F54 K59 F60 V61	I37-A57 HydrophobicContact CG2-CB 4.26Å; A41-A57 HydrophobicContact CB-CB 3.63Å; L49-A57 HydrophobicContact CD1-CB 4.15Å; S53-A57 WeakPolarHBondContact O-CB 3.5Å; S53-A57 PolarHBondContact O-N 3.27Å; F54-A57 WeakPolarHBondContact O-CB 3.43Å; F54-A57 PolarHBondContact O-N 2.76Å; A57-K59 VanDerWaalsContact C-N 3.3Å; A57-K59 PolarHBondContact O-N 2.89Å; A57-F60 CarbonylContact O-C 3.58Å; A57-F60 WeakPolarHBondContact O-CB 3.35Å; A57-F60 PolarHBondContact O-N 3.23Å; A57-F60 VanDerWaalsContact O-N 3.16Å; A57-V61 WeakPolarHBondContact O-CG2 3.49Å; A57-V61 PolarHBondContact O-N 2.93Å
58	L	74.4	Confident	70.1	Confident	38 Å²	38	60.8 Å²	60.8	20%	0.199	31%	0.313	C	S	.	.	H	α-helix	trans	-60.6	-39.6	175.4	-75.3	-175.8	0	0	0	112.4	F54 F55 A56 V61 A62 P82 I84	F54-L58 HydrophobicContact CD1-CD1 4.1Å; F54-L58 HydrophobicContact CD1-CG 4.44Å; F54-L58 HydrophobicContact CE1-CD1 3.48Å; F54-L58 VanDerWaalsContact CE1-CD1 3.48Å; F54-L58 HydrophobicContact CE1-CG 4Å; F54-L58 HydrophobicContact CZ-CD1 3.94Å; F54-L58 HydrophobicContact CZ-CD2 4.36Å; F54-L58 HydrophobicContact CZ-CG 4.12Å; F54-L58 PolarHBondContact O-N 2.8Å; F55-L58 PolarHBondContact O-N 3.14Å; A56-L58 PolarHBondContact O-N 3.22Å; L58-V61 PolarHBondContact O-N 2.81Å; L58-A62 PolarHBondContact O-N 2.97Å; L58-P82 HydrophobicContact CB-CG 4.39Å; L58-P82 HydrophobicContact CD2-CG 4.5Å; L58-I84 HydrophobicContact CD2-CD1 3.63Å
59	K	69.8	Low	70	Confident	66 Å²	66	64.9 Å²	64.9	29%	0.287	33%	0.326	S	S	.	.	H	α-helix	trans	-68.8	-36.3	176	-168.8	160.5	-170.4	162.5	0	111.9	F55 A56 A57 A62 L63 L75 L77	F55-K59 WeakPolarHBondContact O-CB 3.48Å; F55-K59 PolarHBondContact O-N 2.82Å; A56-K59 CarbonylContact O-C 3.46Å; A56-K59 PolarHBondContact O-N 3.4Å; A56-K59 VanDerWaalsContact O-N 3.12Å; A57-K59 VanDerWaalsContact C-N 3.3Å; A57-K59 PolarHBondContact O-N 2.89Å; K59-A62 WeakPolarHBondContact O-CB 3.45Å; K59-A62 PolarHBondContact O-N 2.63Å; K59-L63 WeakPolarHBondContact O-CG 3.34Å; K59-L63 PolarHBondContact O-N 2.89Å; K59-L75 HydrophobicContact CB-CD2 3.82Å; K59-L75 HydrophobicContact CD-CB 4.4Å; K59-L75 HydrophobicContact CD-CD2 3.89Å; K59-L75 WeakPolarHBondContact CD-O 3.47Å; K59-L75 VanDerWaalsContact CE-C 3.47Å; K59-L75 WeakPolarHBondContact CE-O 2.8Å; K59-L75 HydrophobicContact CG-CD2 3.88Å; K59-L75 PolarHBondContact NZ-O 2.67Å; K59-L77 WeakPolarHBondContact CE-O 3.08Å; K59-L77 PolarHBondContact NZ-O 3.07Å
60	F	72	Confident	69.8	Low	1 Å²	1	63.7 Å²	63.7	0%	0.004	32%	0.32	C	S	.	.	H	α-helix	trans	-67.1	-36.6	171.9	-78.4	-59.5	0	0	0	112.7	I37 E40 A41 A56 A57 A62 L63 A64 L70 L75	I37-F60 HydrophobicContact CB-CB 4.34Å; I37-F60 HydrophobicContact CG1-CB 4.04Å; I37-F60 HydrophobicContact CG2-CB 3.72Å; E40-F60 HydrophobicContact CB-CD2 4.43Å; E40-F60 HydrophobicContact CB-CE2 4.01Å; E40-F60 HydrophobicContact CB-CZ 4.11Å; E40-F60 HydrophobicContact CG-CD1 4.45Å; E40-F60 HydrophobicContact CG-CD2 4.26Å; E40-F60 HydrophobicContact CG-CE1 3.68Å; E40-F60 HydrophobicContact CG-CE2 3.45Å; E40-F60 VanDerWaalsContact CG-CE2 3.45Å; E40-F60 HydrophobicContact CG-CZ 3.12Å; A41-F60 HydrophobicContact CB-CD2 4.47Å; A56-F60 HydrophobicContact CB-CD2 4.49Å; A56-F60 HydrophobicContact CB-CE2 4.35Å; A56-F60 WeakPolarHBondContact O-CD2 3.15Å; A56-F60 PolarHBondContact O-N 3.28Å; A57-F60 CarbonylContact O-C 3.58Å; A57-F60 WeakPolarHBondContact O-CB 3.35Å; A57-F60 PolarHBondContact O-N 3.23Å; A57-F60 VanDerWaalsContact O-N 3.16Å; F60-A62 VanDerWaalsContact C-N 3.35Å; F60-L63 HydrophobicContact CD1-CD1 4.04Å; F60-L63 HydrophobicContact CE1-CD1 4.38Å; F60-L63 PolarHBondContact O-N 2.82Å; F60-A64 VanDerWaalsContact O-CB 3.32Å; F60-A64 WeakPolarHBondContact O-CB 3.2Å; F60-A64 PolarHBondContact O-N 3.34Å; F60-L70 HydrophobicContact CB-CD2 4.31Å; F60-L70 HydrophobicContact CD1-CB 4.37Å; F60-L70 HydrophobicContact CD1-CD2 3.99Å; F60-L75 HydrophobicContact CD2-CD2 4.29Å; F60-L75 HydrophobicContact CE1-CD2 4.42Å; F60-L75 HydrophobicContact CE1-CG 4.25Å; F60-L75 HydrophobicContact CE2-CD1 3.98Å; F60-L75 HydrophobicContact CE2-CD2 3.93Å; F60-L75 HydrophobicContact CE2-CG 4.2Å; F60-L75 HydrophobicContact CZ-CD1 3.67Å; F60-L75 HydrophobicContact CZ-CD2 3.98Å; F60-L75 HydrophobicContact CZ-CG 3.79Å
61	V	70.1	Confident	69.3	Low	16 Å²	16	64.2 Å²	64.2	10%	0.097	32%	0.323	C	S	.	.	H	α-helix	trans	-61.7	-45	170	173.2	0	0	0	0	110	I27 I37 A57 L58 L63 A64 Q65 P82	I27-V61 HydrophobicContact CD1-CG2 4.31Å; I37-V61 HydrophobicContact CD1-CG2 4.03Å; I37-V61 HydrophobicContact CG2-CG2 4.32Å; A57-V61 WeakPolarHBondContact O-CG2 3.49Å; A57-V61 PolarHBondContact O-N 2.93Å; L58-V61 PolarHBondContact O-N 2.81Å; V61-L63 PolarHBondContact O-N 2.84Å; V61-A64 PolarHBondContact O-N 2.94Å; V61-Q65 HydrophobicContact CG1-CG 4.43Å; V61-Q65 WeakPolarHBondContact O-CB 3.27Å; V61-Q65 VanDerWaalsContact O-CG 3.27Å; V61-Q65 WeakPolarHBondContact O-CG 3.44Å; V61-Q65 PolarHBondContact O-N 3.43Å; V61-P82 HydrophobicContact CG1-CB 4.29Å
62	A	68.7	Low	68.8	Low	3 Å²	3	57.6 Å²	57.6	3%	0.025	31%	0.309	C	S	.	.	H	α-helix	trans	-60.4	-44.4	174.9	0	0	0	0	0	111.5	L58 K59 F60 A64 Q65 H66 V79 P82	L58-A62 PolarHBondContact O-N 2.97Å; K59-A62 WeakPolarHBondContact O-CB 3.45Å; K59-A62 PolarHBondContact O-N 2.63Å; F60-A62 VanDerWaalsContact C-N 3.35Å; A62-A64 PolarHBondContact O-N 2.82Å; A62-Q65 PolarHBondContact O-N 3.16Å; A62-H66 PolarHBondContact O-N 3.39Å; A62-H66 PolarHBondContact O-ND1 3.47Å; A62-V79 HydrophobicContact CB-CG1 4.08Å; A62-P82 HydrophobicContact CB-CB 3.99Å; A62-P82 HydrophobicContact CB-CG 4.46Å
63	L	69.1	Low	68.3	Low	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.8	-43.1	175.9	-74.7	167.2	0	0	0	112.5	K59 F60 V61 Q65 H66 S67 K68 L70 N74 V79	K59-L63 WeakPolarHBondContact O-CG 3.34Å; K59-L63 PolarHBondContact O-N 2.89Å; F60-L63 HydrophobicContact CD1-CD1 4.04Å; F60-L63 HydrophobicContact CE1-CD1 4.38Å; F60-L63 PolarHBondContact O-N 2.82Å; V61-L63 PolarHBondContact O-N 2.84Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 3.28Å; L63-H66 CarbonylContact O-C 3.51Å; L63-H66 PolarHBondContact O-N 3.12Å; L63-S67 PolarHBondContact O-N 2.91Å; L63-K68 HydrophobicContact CB-CB 4.42Å; L63-K68 HydrophobicContact CD2-CB 3.77Å; L63-K68 HydrophobicContact CD2-CD 3.84Å; L63-K68 HydrophobicContact CD2-CG 4.4Å; L63-K68 PolarHBondContact O-N 3.32Å; L63-L70 HydrophobicContact CB-CD2 4.49Å; L63-N74 HydrophobicContact CD1-CB 3.65Å; L63-N74 HydrophobicContact CD2-CB 3.76Å; L63-N74 HydrophobicContact CG-CB 4.38Å; L63-V79 HydrophobicContact CD2-CG2 3.68Å; L63-V79 HydrophobicContact CG-CG2 4.39Å
64	A	68.3	Low	67.8	Low	27 Å²	27	58.3 Å²	58.3	22%	0.223	31%	0.311	C	S	.	.	H	α-helix	trans	-61.6	-42.1	176.1	0	0	0	0	0	111.5	T33 I37 F60 V61 A62 H66 S67 L70	T33-A64 HydrophobicContact CG2-CB 4.18Å; I37-A64 HydrophobicContact CD1-CB 4.12Å; F60-A64 VanDerWaalsContact O-CB 3.32Å; F60-A64 WeakPolarHBondContact O-CB 3.2Å; F60-A64 PolarHBondContact O-N 3.34Å; V61-A64 PolarHBondContact O-N 2.94Å; A62-A64 PolarHBondContact O-N 2.82Å; A64-H66 VanDerWaalsContact C-N 3.26Å; A64-H66 PolarHBondContact O-N 3.34Å; A64-S67 PolarHBondContact O-N 3.26Å; A64-L70 HydrophobicContact CB-CD2 4.14Å
65	Q	65.2	Low	67.1	Low	81 Å²	81	55.9 Å²	55.9	38%	0.379	30%	0.303	S	S	.	.	H	α-helix	trans	-64.3	-31.2	176.3	-75	177.2	-17.8	0	0	112.4	V61 A62 L63 S67 V83	V61-Q65 HydrophobicContact CG1-CG 4.43Å; V61-Q65 WeakPolarHBondContact O-CB 3.27Å; V61-Q65 VanDerWaalsContact O-CG 3.27Å; V61-Q65 WeakPolarHBondContact O-CG 3.44Å; V61-Q65 PolarHBondContact O-N 3.43Å; A62-Q65 PolarHBondContact O-N 3.16Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 3.28Å; Q65-S67 VanDerWaalsContact C-N 3.33Å; Q65-V83 PolarHBondContact NE2-O 2.94Å
66	H	63.3	Low	66.6	Low	92 Å²	92	55.9 Å²	55.9	43%	0.426	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	16.1	178.3	-64.9	77.2	0	0	0	113	A62 L63 A64 K68 V79	A62-H66 PolarHBondContact O-N 3.39Å; A62-H66 PolarHBondContact O-ND1 3.47Å; L63-H66 CarbonylContact O-C 3.51Å; L63-H66 PolarHBondContact O-N 3.12Å; A64-H66 VanDerWaalsContact C-N 3.26Å; A64-H66 PolarHBondContact O-N 3.34Å; H66-K68 PolarHBondContact O-N 3.29Å; H66-V79 HydrophobicContact CB-CG1 4.03Å; H66-V79 VanDerWaalsContact CG-CG1 3.48Å; H66-V79 WeakPolarHBondContact ND1-CG1 3.28Å
67	S	64.1	Low	66	Low	119 Å²	119	57.9 Å²	57.9	83%	0.832	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	31.2	178.6	-58.7	0	0	0	0	114.5	L63 A64 Q65	L63-S67 PolarHBondContact O-N 2.91Å; A64-S67 PolarHBondContact O-N 3.26Å; Q65-S67 VanDerWaalsContact C-N 3.33Å
68	K	63.6	Low	65.2	Low	86 Å²	86	65 Å²	65	37%	0.374	36%	0.357	S	S	.	.			trans	-96.5	150.8	176.3	-67.6	-173.7	179.4	177.7	0	111	L63 H66 L70 L77	L63-K68 HydrophobicContact CB-CB 4.42Å; L63-K68 HydrophobicContact CD2-CB 3.77Å; L63-K68 HydrophobicContact CD2-CD 3.84Å; L63-K68 HydrophobicContact CD2-CG 4.4Å; L63-K68 PolarHBondContact O-N 3.32Å; H66-K68 PolarHBondContact O-N 3.29Å; K68-L70 PolarHBondContact O-N 2.89Å; K68-L77 HydrophobicContact CD-CD1 3.96Å
69	E	64.7	Low	64.4	Low	140 Å²	140	64.2 Å²	64.2	65%	0.654	35%	0.353	S	S	*	.			trans	-62.7	135.8	-179.8	-67.2	-170.2	152.6	0	0	111.8	L71 N74	E69-L71 HydrophobicContact CB-CD1 4.16Å; E69-L71 HydrophobicContact CB-CG 4.1Å; E69-L71 PolarHBondContact O-N 2.72Å; E69-L71 WeakPolarHBondContact OE2-CD1 2.96Å; E69-N74 PolarHBondContact O-ND2 3.24Å
70	L	64.8	Low	63.8	Low	18 Å²	18	63.1 Å²	63.1	9%	0.094	36%	0.361	C	S	.	.			trans	-75.9	72.1	177.2	-58.5	176	0	0	0	109.7	T33 K36 I37 F60 L63 A64 K68	T33-L70 HydrophobicContact CG2-CD1 4.3Å; K36-L70 HydrophobicContact CB-CD1 4.25Å; K36-L70 HydrophobicContact CD-CD1 3.9Å; K36-L70 HydrophobicContact CG-CD1 3.88Å; I37-L70 HydrophobicContact CG1-CD1 4.01Å; I37-L70 HydrophobicContact CG1-CD2 4.17Å; F60-L70 HydrophobicContact CB-CD2 4.31Å; F60-L70 HydrophobicContact CD1-CB 4.37Å; F60-L70 HydrophobicContact CD1-CD2 3.99Å; L63-L70 HydrophobicContact CB-CD2 4.49Å; A64-L70 HydrophobicContact CB-CD2 4.14Å; K68-L70 PolarHBondContact O-N 2.89Å
71	L	61.9	Low	63.2	Low	80 Å²	80	67.3 Å²	67.3	42%	0.419	40%	0.395	S	S	.	.			trans	-119.9	139.8	177	-64.1	175.7	0	0	0	108.8	E69 T73 N74	E69-L71 HydrophobicContact CB-CD1 4.16Å; E69-L71 HydrophobicContact CB-CG 4.1Å; E69-L71 PolarHBondContact O-N 2.72Å; E69-L71 WeakPolarHBondContact OE2-CD1 2.96Å; L71-T73 PolarHBondContact O-N 3.29Å; L71-N74 WeakPolarHBondContact O-CB 3.46Å; L71-N74 PolarHBondContact O-N 3.41Å
72	S	62.1	Low	62.5	Low	70 Å²	70	68 Å²	68	49%	0.49	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-49.4	-28.2	173	-75.1	0	0	0	0	113.8	E40 N74 L75	E40-S72 PolarHBondContact OE1-N 3.05Å; E40-S72 PolarHBondContact OE1-OG 3.49Å; S72-N74 VanDerWaalsContact C-N 3.3Å; S72-N74 PolarHBondContact O-N 3.03Å; S72-L75 WeakPolarHBondContact O-CB 3.36Å; S72-L75 PolarHBondContact O-N 3.2Å
73	T	64.8	Low	61.9	Low	98 Å²	98	72.7 Å²	72.7	60%	0.601	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-67	-27.2	176	52.1	0	0	0	0	113.7	L71 L75 T76	L71-T73 PolarHBondContact O-N 3.29Å; T73-L75 VanDerWaalsContact C-N 3.29Å; T73-L75 PolarHBondContact O-N 3.31Å; T73-T76 PolarHBondContact O-OG1 3.49Å; T73-T76 VanDerWaalsContact O-OG1 3.07Å
74	N	61	Low	61.1	Low	31 Å²	31	75.5 Å²	75.5	17%	0.166	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-82.3	-8.1	-179.9	-69.7	-43.6	0	0	0	112.7	L63 E69 L71 S72 T76 L77	L63-N74 HydrophobicContact CD1-CB 3.65Å; L63-N74 HydrophobicContact CD2-CB 3.76Å; L63-N74 HydrophobicContact CG-CB 4.38Å; E69-N74 PolarHBondContact O-ND2 3.24Å; L71-N74 WeakPolarHBondContact O-CB 3.46Å; L71-N74 PolarHBondContact O-N 3.41Å; S72-N74 VanDerWaalsContact C-N 3.3Å; S72-N74 PolarHBondContact O-N 3.03Å; N74-T76 PolarHBondContact O-N 3.3Å; N74-T76 VanDerWaalsContact O-N 3.17Å; N74-L77 HydrophobicContact CB-CD1 4.04Å; N74-L77 WeakPolarHBondContact O-CB 3.21Å; N74-L77 PolarHBondContact O-N 3.02Å; N74-L77 WeakPolarHBondContact OD1-CD1 3.5Å
75	L	59.9	Low	59.7	Low	51 Å²	51	77.6 Å²	77.6	27%	0.267	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-64.9	-9.9	171.1	-72	163	0	0	0	113.1	A56 K59 F60 S72 T73	A56-L75 HydrophobicContact CB-CD2 4.31Å; K59-L75 HydrophobicContact CB-CD2 3.82Å; K59-L75 HydrophobicContact CD-CB 4.4Å; K59-L75 HydrophobicContact CD-CD2 3.89Å; K59-L75 WeakPolarHBondContact CD-O 3.47Å; K59-L75 VanDerWaalsContact CE-C 3.47Å; K59-L75 WeakPolarHBondContact CE-O 2.8Å; K59-L75 HydrophobicContact CG-CD2 3.88Å; K59-L75 PolarHBondContact NZ-O 2.67Å; F60-L75 HydrophobicContact CD2-CD2 4.29Å; F60-L75 HydrophobicContact CE1-CD2 4.42Å; F60-L75 HydrophobicContact CE1-CG 4.25Å; F60-L75 HydrophobicContact CE2-CD1 3.98Å; F60-L75 HydrophobicContact CE2-CD2 3.93Å; F60-L75 HydrophobicContact CE2-CG 4.2Å; F60-L75 HydrophobicContact CZ-CD1 3.67Å; F60-L75 HydrophobicContact CZ-CD2 3.98Å; F60-L75 HydrophobicContact CZ-CG 3.79Å; S72-L75 WeakPolarHBondContact O-CB 3.36Å; S72-L75 PolarHBondContact O-N 3.2Å; T73-L75 VanDerWaalsContact C-N 3.29Å; T73-L75 PolarHBondContact O-N 3.31Å
76	T	61.7	Low	58.2	Low	123 Å²	123	78 Å²	78	76%	0.755	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-93.9	-13	172.3	58.8	0	0	0	0	113	T73 N74	T73-T76 PolarHBondContact O-OG1 3.49Å; T73-T76 VanDerWaalsContact O-OG1 3.07Å; N74-T76 PolarHBondContact O-N 3.3Å; N74-T76 VanDerWaalsContact O-N 3.17Å
77	L	60.8	Low	56.7	Low	63 Å²	63	83.6 Å²	83.6	33%	0.33	48%	0.482	S	S	.	.	S	Bend	trans	-69.4	137.6	179.4	-65.2	177	0	0	0	110.2	K59 K68 N74 V79	K59-L77 WeakPolarHBondContact CE-O 3.08Å; K59-L77 PolarHBondContact NZ-O 3.07Å; K68-L77 HydrophobicContact CD-CD1 3.96Å; N74-L77 HydrophobicContact CB-CD1 4.04Å; N74-L77 WeakPolarHBondContact O-CB 3.21Å; N74-L77 PolarHBondContact O-N 3.02Å; N74-L77 WeakPolarHBondContact OD1-CD1 3.5Å; L77-V79 HydrophobicContact CB-CG2 3.98Å; L77-V79 PolarHBondContact O-N 3.19Å
78	D	59	Low	55.4	Low	162 Å²	162	83.1 Å²	83.1	87%	0.866	48%	0.478	S	S	*	.			trans	-73.2	109.6	167.7	-168.1	24.7	0	0	0	107.4
79	V	57.1	Low	54.2	Low	21 Å²	21	85.8 Å²	85.8	13%	0.127	50%	0.497	C	S	.	.			trans	-126.7	131	179.9	-170.9	0	0	0	0	104.6	A62 L63 H66 L77	A62-V79 HydrophobicContact CB-CG1 4.08Å; L63-V79 HydrophobicContact CD2-CG2 3.68Å; L63-V79 HydrophobicContact CG-CG2 4.39Å; H66-V79 HydrophobicContact CB-CG1 4.03Å; H66-V79 VanDerWaalsContact CG-CG1 3.48Å; H66-V79 WeakPolarHBondContact ND1-CG1 3.28Å; L77-V79 HydrophobicContact CB-CG2 3.98Å; L77-V79 PolarHBondContact O-N 3.19Å
80	G	58.3	Low	53.3	Low	44 Å²	44	85.6 Å²	85.6	45%	0.454	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-51.5	152.2	-179.6	0	0	0	0	0	111.4
81	A	58.6	Low	52	Low	88 Å²	88	90.1 Å²	90.1	73%	0.727	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-48.3	135.6	-178.8	0	0	0	0	0	110.6	V83	A81-V83 PolarHBondContact O-N 2.72Å
82	P	56.4	Low	50.7	Low	32 Å²	32	94.3 Å²	94.3	21%	0.208	55%	0.553	C	S	.	*	P	Polyproline II helix	trans	-56.9	134	178.9	22.8	-31.3	0	0	0	109	L58 V61 A62 I84	L58-P82 HydrophobicContact CB-CG 4.39Å; L58-P82 HydrophobicContact CD2-CG 4.5Å; V61-P82 HydrophobicContact CG1-CB 4.29Å; A62-P82 HydrophobicContact CB-CB 3.99Å; A62-P82 HydrophobicContact CB-CG 4.46Å; P82-I84 VanDerWaalsContact C-N 3.27Å; P82-I84 HydrophobicContact CB-CG1 4.21Å; P82-I84 HydrophobicContact CG-CD1 4.09Å; P82-I84 HydrophobicContact CG-CG1 4.26Å; P82-I84 PolarHBondContact O-N 3.35Å
83	V	54.2	Low	49.6	Very low	100 Å²	100	100 Å²	100	61%	0.606	57%	0.574	S	S	*	*			trans	-71.8	93.3	173.6	-177.6	0	0	0	0	106.7	Q65 A81	Q65-V83 PolarHBondContact NE2-O 2.94Å; A81-V83 PolarHBondContact O-N 2.72Å
84	I	53	Low	48	Very low	59 Å²	59	100.6 Å²	100.6	30%	0.303	58%	0.579	S	S	.	*			trans	-99.5	95.3	169.9	-57.1	169.3	0	0	0	104.8	F25 L58 P82 T86	F25-I84 HydrophobicContact CE1-CG2 4.48Å; F25-I84 HydrophobicContact CE2-CG2 4.27Å; F25-I84 HydrophobicContact CZ-CB 4.49Å; F25-I84 HydrophobicContact CZ-CG1 4.37Å; F25-I84 HydrophobicContact CZ-CG2 3.65Å; L58-I84 HydrophobicContact CD2-CD1 3.63Å; P82-I84 VanDerWaalsContact C-N 3.27Å; P82-I84 HydrophobicContact CB-CG1 4.21Å; P82-I84 HydrophobicContact CG-CD1 4.09Å; P82-I84 HydrophobicContact CG-CG1 4.26Å; P82-I84 PolarHBondContact O-N 3.35Å; I84-T86 HydrophobicContact CG2-CG2 3.52Å; I84-T86 PolarHBondContact O-N 3.25Å
85	S	38.3	Very low	46.4	Very low	72 Å²	72	107.3 Å²	107.3	50%	0.503	61%	0.614	S	S	.	*			trans	-71.8	75.4	172.8	-62.8	0	0	0	0	109.3
86	T	34	Very low	44.9	Very low	90 Å²	90	109.5 Å²	109.5	55%	0.552	64%	0.639	S	S	*	*			trans	-115.1	114.9	168.9	52.7	0	0	0	0	108.4	I84	I84-T86 HydrophobicContact CG2-CG2 3.52Å; I84-T86 PolarHBondContact O-N 3.25Å
87	R	31.3	Very low	43.6	Very low	208 Å²	208	108.4 Å²	108.4	79%	0.785	64%	0.637	S	S	*	*			trans	58.8	124.6	164.3	-72.7	-176.7	149.9	169	-3.6	117.8
88	S	37.2	Very low	42.3	Very low	109 Å²	109	113.9 Å²	113.9	76%	0.762	66%	0.661	S	S	*	*			trans	-143.2	81.4	142.4	-52.3	0	0	0	0	107.6	D90	S88-D90 PolarHBondContact O-N 3.42Å
89	D	39.1	Very low	41.2	Very low	142 Å²	142	111.6 Å²	111.6	76%	0.759	65%	0.645	S	S	*	*			trans	-63.1	74.8	146.7	-73.8	-58.3	0	0	0	106.6
90	D	45	Very low	40.2	Very low	137 Å²	137	117.4 Å²	117.4	73%	0.733	68%	0.675	S	S	*	*			trans	-140.7	106.4	166.6	-95.4	-41.1	0	0	0	106.4	S88	S88-D90 PolarHBondContact O-N 3.42Å
91	P	37.3	Very low	39.3	Very low	113 Å²	113	121.2 Å²	121.2	73%	0.734	68%	0.68	S	S	*	*			trans	-70.3	150	177.7	30.6	-30.5	0	0	0	108.3
92	L	34.6	Very low	38.2	Very low	168 Å²	168	120.4 Å²	120.4	88%	0.88	67%	0.669	S	S	*	*			trans	100.7	73	176	-49.6	173.9	0	0	0	115.2
93	M	39.1	Very low	37.7	Very low	189 Å²	189	122.5 Å²	122.5	93%	0.931	67%	0.673	S	S	*	*				-166.1	148.5	120.6	-110.8	169.3	61.3	0	0	113.3
94	P	31.9	Very low	37.2	Very low	111 Å²	111	123.7 Å²	123.7	72%	0.721	68%	0.684	S	S	*	*			trans	-97.1	151.5	-162	37.1	-30.5	0	0	0	113.6
95	L	26.7	Very low	37.1	Very low	172 Å²	172	121.6 Å²	121.6	90%	0.901	67%	0.673	S	S	*	*			trans	57.4	91.7	144.1	-163.6	71.8	0	0	0	117.2
96	A	28.9	Very low	37.9	Very low	96 Å²	96	124 Å²	124	79%	0.793	68%	0.676	S	S	*	*			trans	151.6	81.8	136.4	0	0	0	0	0	112.3
97	S	34.1	Very low	39	Very low	100 Å²	100	124.3 Å²	124.3	70%	0.699	68%	0.682	S	S	*	*			trans	-168.1	90.1	148.5	44.3	0	0	0	0	108.5	E99	S97-E99 PolarHBondContact O-N 3.01Å
98	E	33.6	Very low	40.3	Very low	179 Å²	179	120.9 Å²	120.9	84%	0.836	68%	0.675	S	S	*	*			trans	-53.3	92	156.7	-67.7	-90.5	151.7	0	0	106.9	N100	E98-N100 PolarHBondContact O-N 3.1Å
99	E	37.4	Very low	41.2	Very low	113 Å²	113	117.6 Å²	117.6	53%	0.528	65%	0.648	S	S	.	*			trans	-65.8	88.9	170.1	-73.4	-131.8	129.9	0	0	107	R24 S97 F101	R24-E99 IonicContact CZ-OE2 3.47Å; R24-E99 IonicContact NH1-OE2 3.23Å; R24-E99 PolarHBondContact NH1-OE2 3.32Å; R24-E99 IonicContact NH2-OE2 2.84Å; R24-E99 PolarHBondContact NH2-OE2 2.94Å; S97-E99 PolarHBondContact O-N 3.01Å; E99-F101 VanDerWaalsContact C-N 3.28Å; E99-F101 WeakPolarHBondContact O-CD2 3.37Å; E99-F101 PolarHBondContact O-N 3.1Å
100	N	34.8	Very low	42.3	Very low	143 Å²	143	113.6 Å²	113.6	77%	0.765	63%	0.626	S	S	*	*			trans	-48.9	92.2	164.8	-82.3	-54	0	0	0	108.7	E98 S102	E98-N100 PolarHBondContact O-N 3.1Å; N100-S102 PolarHBondContact O-N 3.28Å
101	F	38.7	Very low	43.4	Very low	124 Å²	124	113.5 Å²	113.5	54%	0.544	62%	0.619	S	S	.	*			trans	-62.8	89	167.5	-80.9	-93.4	0	0	0	107.9	E99 W103	E99-F101 VanDerWaalsContact C-N 3.28Å; E99-F101 WeakPolarHBondContact O-CD2 3.37Å; E99-F101 PolarHBondContact O-N 3.1Å; F101-W103 VanDerWaalsContact C-N 3.33Å; F101-W103 PolarHBondContact O-N 2.79Å
102	S	35.6	Very low	44.9	Very low	71 Å²	71	114 Å²	114	50%	0.497	61%	0.609	S	S	.	*			trans	-63.6	91.9	178.8	-175	0	0	0	0	109.6	N100 C104	N100-S102 PolarHBondContact O-N 3.28Å; S102-C104 PolarHBondContact O-N 3.29Å; S102-C104 PolarHBondContact O-SG 3Å
103	W	46.8	Very low	46.3	Very low	77 Å²	77	107.7 Å²	107.7	29%	0.292	58%	0.575	S	S	.	*			trans	-11.4	115.3	143.2	-173.3	-78.1	0	0	0	112.7	F101 I105 L110 C167 P202	F101-W103 VanDerWaalsContact C-N 3.33Å; F101-W103 PolarHBondContact O-N 2.79Å; W103-I105 HydrophobicContact CZ2-CD1 3.88Å; W103-I105 VanDerWaalsContact NE1-CB 3.31Å; W103-L110 HydrophobicContact CZ2-CD1 4.34Å; W103-C167 HydrophobicContact CH2-CB 3.3Å; W103-C167 HydrophobicContact CZ2-CB 2.96Å; W103-P202 HydrophobicContact CE3-CB 4.48Å; W103-P202 HydrophobicContact CH2-CG 4.4Å; W103-P202 HydrophobicContact CZ3-CB 3.66Å; W103-P202 HydrophobicContact CZ3-CG 3.77Å
104	C	44.2	Very low	47.8	Very low	125 Å²	125	104.3 Å²	104.3	85%	0.845	56%	0.556	S	S	*	*			trans	-102.1	32.7	-175.6	-69.1	0	0	0	0	112.4	S102 E106	S102-C104 PolarHBondContact O-N 3.29Å; S102-C104 PolarHBondContact O-SG 3Å; C104-E106 PolarHBondContact O-N 2.83Å
105	I	50.9	Low	50	Low	15 Å²	15	103.7 Å²	103.7	8%	0.077	55%	0.547	C	S	.	.			trans	-73	119.8	160.7	-56.3	-175.3	0	0	0	106	W103 S107 E109 L110 C167	W103-I105 HydrophobicContact CZ2-CD1 3.88Å; W103-I105 VanDerWaalsContact NE1-CB 3.31Å; I105-S107 PolarHBondContact O-N 2.92Å; I105-E109 HydrophobicContact CG2-CB 3.65Å; I105-L110 HydrophobicContact CG2-CB 3.96Å; I105-C167 HydrophobicContact CD1-CB 3.9Å; I105-C167 VanDerWaalsContact CD1-O 3.29Å; I105-C167 WeakPolarHBondContact CD1-O 3.21Å
106	E	54.7	Low	52.2	Low	122 Å²	122	98 Å²	98	57%	0.57	52%	0.517	S	S	*	.			trans	-56.1	136.4	177.6	-165.2	161.8	-146.4	0	0	108.1	C104 E108 E109 L110	C104-E106 PolarHBondContact O-N 2.83Å; E106-E108 PolarHBondContact O-N 2.75Å; E106-E109 HydrophobicContact CB-CG 4.25Å; E106-E109 WeakPolarHBondContact O-CA 3.24Å; E106-E109 WeakPolarHBondContact O-CB 3.35Å; E106-E109 PolarHBondContact O-N 3.46Å; E106-L110 PolarHBondContact O-N 3.46Å
107	S	56.1	Low	54.4	Low	97 Å²	97	93.9 Å²	93.9	68%	0.678	48%	0.481	S	S	*	.	H	α-helix	trans	-55.3	-23.9	-173.3	-174.5	0	0	0	0	112.8	I105 K111	I105-S107 PolarHBondContact O-N 2.92Å; S107-K111 WeakPolarHBondContact O-CB 3.22Å; S107-K111 PolarHBondContact O-N 3.4Å
108	E	58.8	Low	56.4	Low	135 Å²	135	91.1 Å²	91.1	63%	0.631	47%	0.469	S	S	*	.	H	α-helix	trans	-72.1	-39.4	174.9	-61	-168.9	176.7	0	0	112.9	E106 K111 K112	E106-E108 PolarHBondContact O-N 2.75Å; E108-K111 PolarHBondContact O-N 3.37Å; E108-K112 WeakPolarHBondContact O-CG 3.49Å; E108-K112 PolarHBondContact O-N 2.96Å
109	E	56.5	Low	58.6	Low	41 Å²	41	86.6 Å²	86.6	19%	0.192	46%	0.457	C	S	.	.	H	α-helix	trans	-70.8	-45.7	176.9	-66.2	-179.3	148.9	0	0	110.4	I105 E106 K111 K112 Y113	I105-E109 HydrophobicContact CG2-CB 3.65Å; E106-E109 HydrophobicContact CB-CG 4.25Å; E106-E109 WeakPolarHBondContact O-CA 3.24Å; E106-E109 WeakPolarHBondContact O-CB 3.35Å; E106-E109 PolarHBondContact O-N 3.46Å; E109-K111 PolarHBondContact O-N 2.82Å; E109-K112 WeakPolarHBondContact O-CB 3.48Å; E109-K112 PolarHBondContact O-N 2.81Å; E109-Y113 HydrophobicContact CB-CD2 4.28Å; E109-Y113 HydrophobicContact CB-CE2 3.98Å; E109-Y113 WeakPolarHBondContact O-CD2 3.46Å; E109-Y113 PolarHBondContact O-N 3.42Å
110	L	63	Low	60.3	Low	58 Å²	58	82.3 Å²	82.3	30%	0.304	44%	0.437	S	S	.	.	H	α-helix	trans	-53.8	-41.5	175.6	-171.8	72.4	0	0	0	110.9	W103 I105 E106 Y113 E114 C167	W103-L110 HydrophobicContact CZ2-CD1 4.34Å; I105-L110 HydrophobicContact CG2-CB 3.96Å; E106-L110 PolarHBondContact O-N 3.46Å; L110-Y113 PolarHBondContact O-N 3.35Å; L110-E114 WeakPolarHBondContact O-CB 3.43Å; L110-E114 PolarHBondContact O-N 3.47Å; L110-C167 VanDerWaalsContact CD1-SG 3.54Å
111	K	67.9	Low	62.1	Low	134 Å²	134	81.2 Å²	81.2	58%	0.583	43%	0.431	S	S	*	.	H	α-helix	trans	-64.6	-44	177.1	-171.5	177.5	-179.9	-178.7	0	112.5	S107 E108 E109 Y113 E114 D115	S107-K111 WeakPolarHBondContact O-CB 3.22Å; S107-K111 PolarHBondContact O-N 3.4Å; E108-K111 PolarHBondContact O-N 3.37Å; E109-K111 PolarHBondContact O-N 2.82Å; K111-Y113 VanDerWaalsContact C-N 3.27Å; K111-Y113 PolarHBondContact O-N 2.8Å; K111-E114 PolarHBondContact O-N 2.94Å; K111-D115 WeakPolarHBondContact O-CB 3.44Å; K111-D115 PolarHBondContact O-N 3.49Å
112	K	67.5	Low	63.9	Low	123 Å²	123	77.4 Å²	77.4	54%	0.535	42%	0.419	S	S	.	.	H	α-helix	trans	-58.4	-43	174.3	-67.9	170	-171.8	168.6	0	110.9	E108 E109 D115 I116	E108-K112 WeakPolarHBondContact O-CG 3.49Å; E108-K112 PolarHBondContact O-N 2.96Å; E109-K112 WeakPolarHBondContact O-CB 3.48Å; E109-K112 PolarHBondContact O-N 2.81Å; K112-D115 PolarHBondContact O-N 3.5Å; K112-I116 WeakPolarHBondContact O-CB 3.37Å; K112-I116 WeakPolarHBondContact O-CD1 3.32Å; K112-I116 WeakPolarHBondContact O-CG1 3.43Å; K112-I116 PolarHBondContact O-N 2.76Å
113	Y	64.7	Low	65.8	Low	37 Å²	37	79.7 Å²	79.7	15%	0.145	43%	0.43	C	S	.	.	H	α-helix	trans	-72.5	-33.5	179.8	-64.8	-62.9	0	0	0	112.9	E109 L110 K111 I116 F117 S170	E109-Y113 HydrophobicContact CB-CD2 4.28Å; E109-Y113 HydrophobicContact CB-CE2 3.98Å; E109-Y113 WeakPolarHBondContact O-CD2 3.46Å; E109-Y113 PolarHBondContact O-N 3.42Å; L110-Y113 PolarHBondContact O-N 3.35Å; K111-Y113 VanDerWaalsContact C-N 3.27Å; K111-Y113 PolarHBondContact O-N 2.8Å; Y113-I116 HydrophobicContact CD1-CD1 4.12Å; Y113-I116 PolarHBondContact O-N 3.07Å; Y113-F117 WeakPolarHBondContact O-CB 3.4Å; Y113-F117 PolarHBondContact O-N 2.76Å; Y113-S170 WeakPolarHBondContact CD1-OG 3.35Å; Y113-S170 VanDerWaalsContact CD2-CB 3.41Å; Y113-S170 WeakPolarHBondContact CD2-OG 3.23Å; Y113-S170 VanDerWaalsContact CE1-OG 3.27Å; Y113-S170 WeakPolarHBondContact CE1-OG 3.4Å; Y113-S170 VanDerWaalsContact CE2-CB 3.41Å; Y113-S170 VanDerWaalsContact CZ-CB 3.47Å
114	E	70.6	Confident	67.2	Low	117 Å²	117	79.9 Å²	79.9	55%	0.547	46%	0.455	S	S	.	.	H	α-helix	trans	-66	-41.6	170.9	-172.1	173.9	-167.7	0	0	111.2	L110 K111 F117 G118	L110-E114 WeakPolarHBondContact O-CB 3.43Å; L110-E114 PolarHBondContact O-N 3.47Å; K111-E114 PolarHBondContact O-N 2.94Å; E114-F117 PolarHBondContact O-N 3.12Å; E114-G118 PolarHBondContact O-N 3.34Å
115	D	77.6	Confident	68.8	Low	99 Å²	99	75.7 Å²	75.7	53%	0.529	43%	0.433	S	S	.	.	H	α-helix	trans	-62.6	-43.9	174.5	-70.9	-25.8	0	0	0	110.8	K111 K112 G118 S119	K111-D115 WeakPolarHBondContact O-CB 3.44Å; K111-D115 PolarHBondContact O-N 3.49Å; K112-D115 PolarHBondContact O-N 3.5Å; D115-G118 PolarHBondContact O-N 2.96Å; D115-S119 WeakPolarHBondContact O-CB 3.38Å; D115-S119 PolarHBondContact O-N 3.41Å
116	I	73.1	Confident	70.1	Confident	51 Å²	51	78.3 Å²	78.3	26%	0.262	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-47.6	173.8	-70	163.6	0	0	0	110.4	K112 Y113 G118 S119 L120 V135 M166	K112-I116 WeakPolarHBondContact O-CB 3.37Å; K112-I116 WeakPolarHBondContact O-CD1 3.32Å; K112-I116 WeakPolarHBondContact O-CG1 3.43Å; K112-I116 PolarHBondContact O-N 2.76Å; Y113-I116 HydrophobicContact CD1-CD1 4.12Å; Y113-I116 PolarHBondContact O-N 3.07Å; I116-G118 VanDerWaalsContact C-N 3.29Å; I116-G118 PolarHBondContact O-N 2.88Å; I116-S119 WeakPolarHBondContact CA-OG 3.19Å; I116-S119 PolarHBondContact O-N 3.17Å; I116-S119 VanDerWaalsContact O-N 3.13Å; I116-S119 PolarHBondContact O-OG 2.97Å; I116-L120 HydrophobicContact CG2-CD1 4.22Å; I116-L120 WeakPolarHBondContact O-CG 3.44Å; I116-L120 PolarHBondContact O-N 3.33Å; I116-L120 VanDerWaalsContact O-N 3.09Å; I116-V135 HydrophobicContact CG2-CG1 3.75Å; I116-V135 HydrophobicContact CG2-CG2 4.22Å; I116-M166 HydrophobicContact CG2-CE 4.09Å
117	F	74.8	Confident	71.2	Confident	11 Å²	11	72.5 Å²	72.5	5%	0.048	42%	0.417	C	S	.	.	H	α-helix	trans	-58.8	-42.7	178.3	-176.2	-86.5	0	0	0	111	Y113 E114 L120 P122 L127 K163 M166	Y113-F117 WeakPolarHBondContact O-CB 3.4Å; Y113-F117 PolarHBondContact O-N 2.76Å; E114-F117 PolarHBondContact O-N 3.12Å; F117-L120 PolarHBondContact O-N 3.41Å; F117-P122 HydrophobicContact CD1-CB 4.43Å; F117-P122 HydrophobicContact CD1-CG 4.06Å; F117-P122 HydrophobicContact CE1-CB 3.63Å; F117-P122 HydrophobicContact CE1-CG 3.52Å; F117-P122 HydrophobicContact CZ-CB 3.69Å; F117-P122 HydrophobicContact CZ-CG 4.14Å; F117-P122 WeakPolarHBondContact O-CD 3.3Å; F117-L127 HydrophobicContact CD2-CD1 3.25Å; F117-L127 HydrophobicContact CD2-CG 3.87Å; F117-L127 HydrophobicContact CE2-CD1 3.53Å; F117-L127 HydrophobicContact CE2-CG 3.63Å; F117-L127 HydrophobicContact CG-CD1 4.06Å; F117-L127 HydrophobicContact CZ-CG 4.27Å; F117-K163 HydrophobicContact CD1-CG 4.04Å; F117-K163 HydrophobicContact CD2-CG 4.41Å; F117-K163 HydrophobicContact CE1-CD 4.12Å; F117-K163 HydrophobicContact CE1-CG 3.44Å; F117-K163 VanDerWaalsContact CE1-CG 3.44Å; F117-K163 HydrophobicContact CE2-CG 3.88Å; F117-K163 HydrophobicContact CG-CG 4.5Å; F117-K163 HydrophobicContact CZ-CB 4.4Å; F117-K163 HydrophobicContact CZ-CD 4.46Å; F117-K163 HydrophobicContact CZ-CG 3.37Å; F117-M166 HydrophobicContact CD2-CB 3.9Å; F117-M166 HydrophobicContact CD2-CG 3.95Å; F117-M166 HydrophobicContact CE2-CB 4.34Å
118	G	77.2	Confident	72.3	Confident	42 Å²	42	69.4 Å²	69.4	43%	0.433	40%	0.395	S	S	.	.	H	α-helix	trans	-64.5	-41.2	174.4	0	0	0	0	0	112.8	E114 D115 I116 L120 N121	E114-G118 PolarHBondContact O-N 3.34Å; D115-G118 PolarHBondContact O-N 2.96Å; I116-G118 VanDerWaalsContact C-N 3.29Å; I116-G118 PolarHBondContact O-N 2.88Å; G118-L120 PolarHBondContact O-N 2.88Å; G118-N121 PolarHBondContact O-N 3.16Å
119	S	79.8	Confident	73.2	Confident	84 Å²	84	63.5 Å²	63.5	59%	0.587	37%	0.371	S	S	*	.	H	α-helix	trans	-66	-24.8	179.5	77.3	0	0	0	0	113.8	D115 I116 N121	D115-S119 WeakPolarHBondContact O-CB 3.38Å; D115-S119 PolarHBondContact O-N 3.41Å; I116-S119 WeakPolarHBondContact CA-OG 3.19Å; I116-S119 PolarHBondContact O-N 3.17Å; I116-S119 VanDerWaalsContact O-N 3.13Å; I116-S119 PolarHBondContact O-OG 2.97Å; S119-N121 VanDerWaalsContact C-N 3.27Å; S119-N121 PolarHBondContact O-N 3.5Å
120	L	72.5	Confident	74.2	Confident	22 Å²	22	69.5 Å²	69.5	12%	0.115	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-1.8	-179	-75.5	175.4	0	0	0	114.1	I116 F117 G118 L127 Q131 V135	I116-L120 HydrophobicContact CG2-CD1 4.22Å; I116-L120 WeakPolarHBondContact O-CG 3.44Å; I116-L120 PolarHBondContact O-N 3.33Å; I116-L120 VanDerWaalsContact O-N 3.09Å; F117-L120 PolarHBondContact O-N 3.41Å; G118-L120 PolarHBondContact O-N 2.88Å; L120-L127 HydrophobicContact CB-CD1 4.27Å; L120-L127 HydrophobicContact CB-CD2 3.46Å; L120-L127 VanDerWaalsContact CB-CD2 3.46Å; L120-L127 HydrophobicContact CD1-CD1 3.67Å; L120-L127 HydrophobicContact CD1-CD2 4.22Å; L120-Q131 HydrophobicContact CD2-CB 4.47Å; L120-Q131 PolarHBondContact O-NE2 3.48Å; L120-V135 HydrophobicContact CD1-CB 4.33Å; L120-V135 HydrophobicContact CD1-CG2 3.75Å; L120-V135 HydrophobicContact CD2-CB 4.48Å; L120-V135 HydrophobicContact CD2-CG2 3.33Å; L120-V135 HydrophobicContact CG-CG2 3.78Å
121	N	73.8	Confident	74.8	Confident	121 Å²	121	68.9 Å²	68.9	65%	0.647	39%	0.394	S	S	*	.			trans	52.5	75.2	-177.5	-70.7	4.8	0	0	0	112.6	G118 S119 V123 Q131	G118-N121 PolarHBondContact O-N 3.16Å; S119-N121 VanDerWaalsContact C-N 3.27Å; S119-N121 PolarHBondContact O-N 3.5Å; N121-V123 PolarHBondContact O-N 3.07Å; N121-Q131 PolarHBondContact O-NE2 2.95Å
122	P	76.7	Confident	75.1	Confident	44 Å²	44	62.5 Å²	62.5	29%	0.286	37%	0.367	S	S	.	.			trans	-64.2	125.8	-179.9	28.5	-34.7	0	0	0	110.5	F117 K126 L127	F117-P122 HydrophobicContact CD1-CB 4.43Å; F117-P122 HydrophobicContact CD1-CG 4.06Å; F117-P122 HydrophobicContact CE1-CB 3.63Å; F117-P122 HydrophobicContact CE1-CG 3.52Å; F117-P122 HydrophobicContact CZ-CB 3.69Å; F117-P122 HydrophobicContact CZ-CG 4.14Å; F117-P122 WeakPolarHBondContact O-CD 3.3Å; P122-K126 WeakPolarHBondContact CA-O 3.35Å; P122-L127 HydrophobicContact CB-CD2 3.95Å; P122-L127 HydrophobicContact CB-CG 4.35Å
123	V	75.6	Confident	75.2	Confident	118 Å²	118	62.4 Å²	62.4	72%	0.715	37%	0.366	S	S	*	.	B	Isolated β-bridge	trans	-90.7	110.3	177	-177.8	0	0	0	0	107.4	N121 G125 K126	N121-V123 PolarHBondContact O-N 3.07Å; V123-G125 VanDerWaalsContact C-N 3.35Å; V123-G125 PolarHBondContact O-N 3.32Å; V123-K126 PolarHBondContact N-O 3.47Å; V123-K126 PolarHBondContact O-N 3.41Å
124	G	76.2	Confident	75.5	Confident	81 Å²	81	63.4 Å²	63.4	84%	0.835	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	25.4	-178.6	0	0	0	0	0	114.5	K126	G124-K126 VanDerWaalsContact C-N 3.26Å; G124-K126 PolarHBondContact O-N 2.8Å
125	G	76.3	Confident	75.5	Confident	37 Å²	37	59.7 Å²	59.7	38%	0.381	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	11.6	-178.9	0	0	0	0	0	114.2	V123	V123-G125 VanDerWaalsContact C-N 3.35Å; V123-G125 PolarHBondContact O-N 3.32Å
126	K	78.4	Confident	75.1	Confident	71 Å²	71	55.4 Å²	55.4	31%	0.309	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-127.2	147.7	177.6	-60.2	-169.6	170.3	-160.9	0	110.5	P122 V123 G124 D158 Y160 L161 D162	P122-K126 WeakPolarHBondContact CA-O 3.35Å; V123-K126 PolarHBondContact N-O 3.47Å; V123-K126 PolarHBondContact O-N 3.41Å; G124-K126 VanDerWaalsContact C-N 3.26Å; G124-K126 PolarHBondContact O-N 2.8Å; K126-D158 IonicContact NZ-OD2 2.58Å; K126-D158 PolarHBondContact NZ-OD2 3.42Å; K126-Y160 HydrophobicContact CB-CD1 4.48Å; K126-Y160 HydrophobicContact CB-CG 4.45Å; K126-L161 CarbonylContact C-O 3.57Å; K126-L161 WeakPolarHBondContact CA-O 3.24Å; K126-D162 HydrophobicContact CG-CB 4.49Å
127	L	77.5	Confident	74.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.1	174	-68.2	173.1	0	0	0	109.5	F117 L120 P122 Q131 V132 Y160 L161 M166	F117-L127 HydrophobicContact CD2-CD1 3.25Å; F117-L127 HydrophobicContact CD2-CG 3.87Å; F117-L127 HydrophobicContact CE2-CD1 3.53Å; F117-L127 HydrophobicContact CE2-CG 3.63Å; F117-L127 HydrophobicContact CG-CD1 4.06Å; F117-L127 HydrophobicContact CZ-CG 4.27Å; L120-L127 HydrophobicContact CB-CD1 4.27Å; L120-L127 HydrophobicContact CB-CD2 3.46Å; L120-L127 VanDerWaalsContact CB-CD2 3.46Å; L120-L127 HydrophobicContact CD1-CD1 3.67Å; L120-L127 HydrophobicContact CD1-CD2 4.22Å; P122-L127 HydrophobicContact CB-CD2 3.95Å; P122-L127 HydrophobicContact CB-CG 4.35Å; L127-Q131 HydrophobicContact CD2-CB 4.42Å; L127-V132 HydrophobicContact CB-CG2 3.47Å; L127-V132 VanDerWaalsContact CB-CG2 3.47Å; L127-V132 HydrophobicContact CD1-CG2 3.83Å; L127-V132 HydrophobicContact CG-CG2 4.27Å; L127-Y160 CarbonylContact O-C 3.45Å; L127-Y160 WeakPolarHBondContact O-CA 3.2Å; L127-L161 PolarHBondContact N-O 2.99Å; L127-L161 PolarHBondContact O-N 2.84Å; L127-M166 HydrophobicContact CD1-SD 4.2Å
128	S	80.9	Confident	74.4	Confident	31 Å²	31	65.3 Å²	65.3	22%	0.217	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	154	172.7	63.6	0	0	0	0	110.8	E130 Q131 V132	S128-E130 PolarHBondContact O-N 3.34Å; S128-E130 VanDerWaalsContact O-N 3.12Å; S128-Q131 WeakPolarHBondContact O-CB 3.49Å; S128-Q131 PolarHBondContact O-N 3.07Å; S128-Q131 WeakPolarHBondContact OG-CG 3.37Å; S128-Q131 PolarHBondContact OG-N 2.82Å; S128-Q131 PolarHBondContact OG-OE1 3.2Å; S128-V132 PolarHBondContact O-N 3.38Å; S128-V132 VanDerWaalsContact O-N 3.15Å
129	G	76.1	Confident	73.8	Confident	11 Å²	11	65.3 Å²	65.3	11%	0.113	38%	0.382	C	S	.	.	H	α-helix	trans	-57.5	-27.5	175.7	0	0	0	0	0	115	K133 G159	G129-K133 WeakPolarHBondContact O-CB 3.35Å; G129-K133 VanDerWaalsContact O-CD 3.24Å; G129-K133 WeakPolarHBondContact O-CD 3.12Å; G129-K133 WeakPolarHBondContact O-CG 3.43Å; G129-K133 PolarHBondContact O-N 2.82Å; G129-G159 PolarHBondContact N-O 3.01Å
130	E	77.3	Confident	73	Confident	167 Å²	167	64.5 Å²	64.5	78%	0.78	39%	0.387	S	S	*	.	H	α-helix	trans	-69.5	-40.7	174.3	-168.4	168.6	-169.4	0	0	112.6	S128 S134	S128-E130 PolarHBondContact O-N 3.34Å; S128-E130 VanDerWaalsContact O-N 3.12Å; E130-S134 PolarHBondContact O-N 3.3Å; E130-S134 VanDerWaalsContact O-N 3.09Å
131	Q	77.2	Confident	72.6	Confident	46 Å²	46	64.4 Å²	64.4	22%	0.215	39%	0.387	C	S	.	.	H	α-helix	trans	-63.4	-50.4	176.7	-72.4	166.1	-66	0	0	111	L120 N121 L127 S128 S134	L120-Q131 HydrophobicContact CD2-CB 4.47Å; L120-Q131 PolarHBondContact O-NE2 3.48Å; N121-Q131 PolarHBondContact O-NE2 2.95Å; L127-Q131 HydrophobicContact CD2-CB 4.42Å; S128-Q131 WeakPolarHBondContact O-CB 3.49Å; S128-Q131 PolarHBondContact O-N 3.07Å; S128-Q131 WeakPolarHBondContact OG-CG 3.37Å; S128-Q131 PolarHBondContact OG-N 2.82Å; S128-Q131 PolarHBondContact OG-OE1 3.2Å; Q131-S134 PolarHBondContact O-N 3.1Å; Q131-S134 PolarHBondContact O-OG 2.78Å
132	V	73.2	Confident	72.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-69.9	-36.3	-179.6	-176.3	0	0	0	0	111.5	L127 S128 S134 V135 L136 W150 L161 M166	L127-V132 HydrophobicContact CB-CG2 3.47Å; L127-V132 VanDerWaalsContact CB-CG2 3.47Å; L127-V132 HydrophobicContact CD1-CG2 3.83Å; L127-V132 HydrophobicContact CG-CG2 4.27Å; S128-V132 PolarHBondContact O-N 3.38Å; S128-V132 VanDerWaalsContact O-N 3.15Å; V132-S134 PolarHBondContact O-N 3.19Å; V132-V135 PolarHBondContact O-N 3.2Å; V132-V135 VanDerWaalsContact O-N 3.16Å; V132-L136 HydrophobicContact CG1-CD1 3.79Å; V132-L136 HydrophobicContact CG1-CG 4.02Å; V132-L136 WeakPolarHBondContact O-CB 3.43Å; V132-L136 WeakPolarHBondContact O-CG 3.47Å; V132-L136 PolarHBondContact O-N 3.22Å; V132-W150 HydrophobicContact CB-CZ3 3.93Å; V132-W150 HydrophobicContact CG1-CZ3 4.39Å; V132-W150 HydrophobicContact CG2-CZ3 4.29Å; V132-L161 HydrophobicContact CB-CD1 3.92Å; V132-L161 HydrophobicContact CG1-CD1 3.7Å; V132-L161 HydrophobicContact CG2-CD1 3.61Å; V132-M166 HydrophobicContact CG1-CE 4.4Å; V132-M166 HydrophobicContact CG1-SD 4.02Å; V132-M166 HydrophobicContact CG2-SD 4.26Å
133	K	70.1	Confident	72.2	Confident	121 Å²	121	63.9 Å²	63.9	53%	0.526	39%	0.388	S	S	.	.	H	α-helix	trans	-56.1	-38.2	172.4	-82	169.1	-170.2	178.2	0	111.8	G129 V135 L136 F137	G129-K133 WeakPolarHBondContact O-CB 3.35Å; G129-K133 VanDerWaalsContact O-CD 3.24Å; G129-K133 WeakPolarHBondContact O-CD 3.12Å; G129-K133 WeakPolarHBondContact O-CG 3.43Å; G129-K133 PolarHBondContact O-N 2.82Å; K133-V135 PolarHBondContact O-N 3.18Å; K133-L136 PolarHBondContact O-N 3.5Å; K133-F137 WeakPolarHBondContact O-CB 3.39Å; K133-F137 PolarHBondContact O-N 3.47Å
134	S	71.4	Confident	72	Confident	58 Å²	58	67.2 Å²	67.2	41%	0.406	39%	0.393	S	S	.	.	H	α-helix	trans	-63.5	-41.1	178.4	74	0	0	0	0	112.8	E130 Q131 V132 F137 N138	E130-S134 PolarHBondContact O-N 3.3Å; E130-S134 VanDerWaalsContact O-N 3.09Å; Q131-S134 PolarHBondContact O-N 3.1Å; Q131-S134 PolarHBondContact O-OG 2.78Å; V132-S134 PolarHBondContact O-N 3.19Å; S134-F137 PolarHBondContact O-N 3.33Å; S134-N138 VanDerWaalsContact O-CG 3.3Å; S134-N138 PolarHBondContact O-N 3.2Å; S134-N138 VanDerWaalsContact O-N 3.15Å; S134-N138 PolarHBondContact O-OD1 3.4Å
135	V	70	Confident	71.6	Confident	39 Å²	39	63.6 Å²	63.6	24%	0.236	35%	0.354	C	S	.	.	H	α-helix	trans	-70.8	-42.8	176.5	164.9	0	0	0	0	111.6	I116 L120 V132 K133 F137 N138 S139	I116-V135 HydrophobicContact CG2-CG1 3.75Å; I116-V135 HydrophobicContact CG2-CG2 4.22Å; L120-V135 HydrophobicContact CD1-CB 4.33Å; L120-V135 HydrophobicContact CD1-CG2 3.75Å; L120-V135 HydrophobicContact CD2-CB 4.48Å; L120-V135 HydrophobicContact CD2-CG2 3.33Å; L120-V135 HydrophobicContact CG-CG2 3.78Å; V132-V135 PolarHBondContact O-N 3.2Å; V132-V135 VanDerWaalsContact O-N 3.16Å; K133-V135 PolarHBondContact O-N 3.18Å; V135-F137 VanDerWaalsContact C-N 3.32Å; V135-F137 PolarHBondContact O-N 2.69Å; V135-N138 WeakPolarHBondContact O-CB 3.17Å; V135-N138 PolarHBondContact O-N 3.4Å; V135-S139 PolarHBondContact O-N 2.64Å
136	L	68.9	Low	71.4	Confident	9 Å²	9	62.3 Å²	62.3	5%	0.047	34%	0.339	C	S	.	.	H	α-helix	trans	-65.9	-34.4	175.8	-77.5	-179.3	0	0	0	112	V132 K133 N138 S139 L146 V169 Y173	V132-L136 HydrophobicContact CG1-CD1 3.79Å; V132-L136 HydrophobicContact CG1-CG 4.02Å; V132-L136 WeakPolarHBondContact O-CB 3.43Å; V132-L136 WeakPolarHBondContact O-CG 3.47Å; V132-L136 PolarHBondContact O-N 3.22Å; K133-L136 PolarHBondContact O-N 3.5Å; L136-N138 VanDerWaalsContact C-N 3.33Å; L136-S139 WeakPolarHBondContact O-CB 3.14Å; L136-S139 PolarHBondContact O-N 2.97Å; L136-S139 PolarHBondContact O-OG 3.44Å; L136-L146 HydrophobicContact CB-CD1 4.26Å; L136-L146 HydrophobicContact CB-CD2 3.62Å; L136-L146 HydrophobicContact CB-CG 4.43Å; L136-L146 HydrophobicContact CD1-CD2 4.26Å; L136-L146 HydrophobicContact CD2-CD2 4.23Å; L136-L146 HydrophobicContact CG-CD2 4.25Å; L136-V169 HydrophobicContact CD1-CG1 4.35Å; L136-V169 HydrophobicContact CD2-CG1 4.15Å; L136-Y173 HydrophobicContact CD2-CD2 3.63Å; L136-Y173 HydrophobicContact CD2-CE2 3.87Å
137	F	69.2	Low	71.2	Confident	132 Å²	132	60.3 Å²	60.3	58%	0.579	34%	0.338	S	S	*	.	H	α-helix	trans	-69.9	-33.3	176.2	-162.2	-95.1	0	0	0	111.6	K133 S134 V135 S139 G140 V143 L146	K133-F137 WeakPolarHBondContact O-CB 3.39Å; K133-F137 PolarHBondContact O-N 3.47Å; S134-F137 PolarHBondContact O-N 3.33Å; V135-F137 VanDerWaalsContact C-N 3.32Å; V135-F137 PolarHBondContact O-N 2.69Å; F137-S139 PolarHBondContact O-N 3.47Å; F137-G140 PolarHBondContact O-N 2.74Å; F137-G140 VanDerWaalsContact O-N 3.17Å; F137-V143 HydrophobicContact CD2-CG2 4.31Å; F137-V143 HydrophobicContact CE2-CG2 3.89Å; F137-L146 HydrophobicContact CD2-CD1 4.39Å
138	N	65.1	Low	70.9	Confident	138 Å²	138	62.2 Å²	62.2	74%	0.738	35%	0.346	S	S	*	.	H	α-helix	trans	-64	-17.8	172.8	-72.6	-9.3	0	0	0	113.2	S134 V135 L136 G140	S134-N138 VanDerWaalsContact O-CG 3.3Å; S134-N138 PolarHBondContact O-N 3.2Å; S134-N138 VanDerWaalsContact O-N 3.15Å; S134-N138 PolarHBondContact O-OD1 3.4Å; V135-N138 WeakPolarHBondContact O-CB 3.17Å; V135-N138 PolarHBondContact O-N 3.4Å; L136-N138 VanDerWaalsContact C-N 3.33Å; N138-G140 VanDerWaalsContact C-N 3.26Å; N138-G140 PolarHBondContact O-N 3.02Å
139	S	63.7	Low	70.3	Confident	41 Å²	41	60.7 Å²	60.7	29%	0.287	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-12.3	174.6	72.1	0	0	0	0	115.1	V135 L136 F137 L141 Y173	V135-S139 PolarHBondContact O-N 2.64Å; L136-S139 WeakPolarHBondContact O-CB 3.14Å; L136-S139 PolarHBondContact O-N 2.97Å; L136-S139 PolarHBondContact O-OG 3.44Å; F137-S139 PolarHBondContact O-N 3.47Å; S139-L141 VanDerWaalsContact C-N 3.31Å; S139-L141 PolarHBondContact O-N 2.87Å; S139-L141 WeakPolarHBondContact OG-CG 3.4Å; S139-L141 PolarHBondContact OG-N 2.94Å; S139-Y173 WeakPolarHBondContact CB-OH 3.49Å
140	G	63.5	Low	70.3	Confident	68 Å²	68	61.9 Å²	61.9	70%	0.701	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	5.6	-177.7	0	0	0	0	0	115.1	F137 N138	F137-G140 PolarHBondContact O-N 2.74Å; F137-G140 VanDerWaalsContact O-N 3.17Å; N138-G140 VanDerWaalsContact C-N 3.26Å; N138-G140 PolarHBondContact O-N 3.02Å
141	L	64.8	Low	70.2	Confident	19 Å²	19	60 Å²	60	10%	0.099	33%	0.329	C	S	.	.			trans	-74.8	144.9	176	-68	175.7	0	0	0	112.4	S139 L146 I149 Y173 T177 W180	S139-L141 VanDerWaalsContact C-N 3.31Å; S139-L141 PolarHBondContact O-N 2.87Å; S139-L141 WeakPolarHBondContact OG-CG 3.4Å; S139-L141 PolarHBondContact OG-N 2.94Å; L141-L146 HydrophobicContact CB-CD2 3.76Å; L141-L146 HydrophobicContact CB-CG 4.16Å; L141-L146 HydrophobicContact CD1-CD2 4.09Å; L141-I149 HydrophobicContact CD1-CD1 4.07Å; L141-Y173 HydrophobicContact CD1-CD2 4.06Å; L141-Y173 HydrophobicContact CD1-CE2 3.62Å; L141-T177 HydrophobicContact CD1-CG2 4.01Å; L141-W180 HydrophobicContact CD2-CB 4.02Å; L141-W180 HydrophobicContact CD2-CD2 4.13Å; L141-W180 HydrophobicContact CD2-CE3 4.24Å; L141-W180 HydrophobicContact CD2-CG 3.96Å
142	P	70.6	Confident	69.8	Low	55 Å²	55	59.1 Å²	59.1	36%	0.357	33%	0.325	S	S	.	.			trans	-63.8	143	175.9	-24.8	35.7	0	0	0	113.2	K144 V145 L146 W180	P142-K144 PolarHBondContact O-N 3.06Å; P142-V145 HydrophobicContact CB-CG2 4.16Å; P142-V145 HydrophobicContact CG-CG2 4.34Å; P142-V145 WeakPolarHBondContact O-CB 3.32Å; P142-V145 PolarHBondContact O-N 3.09Å; P142-L146 PolarHBondContact O-N 3.41Å; P142-L146 VanDerWaalsContact O-N 3.14Å; P142-W180 HydrophobicContact CB-CH2 4.49Å; P142-W180 HydrophobicContact CG-CH2 3.39Å; P142-W180 HydrophobicContact CG-CZ2 3.94Å; P142-W180 HydrophobicContact CG-CZ3 3.69Å
143	V	69.8	Low	69.7	Low	99 Å²	99	59.1 Å²	59.1	60%	0.6	33%	0.325	S	S	*	.	H	α-helix	trans	-51.7	-32.1	-178.9	-178.2	0	0	0	0	113.5	F137 L146 G147	F137-V143 HydrophobicContact CD2-CG2 4.31Å; F137-V143 HydrophobicContact CE2-CG2 3.89Å; V143-L146 PolarHBondContact O-N 2.89Å; V143-G147 PolarHBondContact O-N 3.47Å
144	K	71.5	Confident	70.1	Confident	189 Å²	189	54 Å²	54	82%	0.822	30%	0.303	S	S	*	.	H	α-helix	trans	-63.2	-41.8	176.7	-66.9	-175.4	179	179.6	0	112.5	P142 G147 K148	P142-K144 PolarHBondContact O-N 3.06Å; K144-G147 PolarHBondContact O-N 3.16Å; K144-K148 PolarHBondContact O-N 2.93Å; K144-K148 VanDerWaalsContact O-N 3.16Å
145	V	68.5	Low	70.1	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.03	29%	0.29	C	S	.	.	H	α-helix	trans	-70.2	-42.7	178.5	-170.7	0	0	0	0	109.4	P142 G147 K148 I149 W180	P142-V145 HydrophobicContact CB-CG2 4.16Å; P142-V145 HydrophobicContact CG-CG2 4.34Å; P142-V145 WeakPolarHBondContact O-CB 3.32Å; P142-V145 PolarHBondContact O-N 3.09Å; V145-G147 VanDerWaalsContact C-N 3.3Å; V145-G147 PolarHBondContact O-N 3.14Å; V145-K148 WeakPolarHBondContact O-CB 3.48Å; V145-K148 PolarHBondContact O-N 3.42Å; V145-K148 VanDerWaalsContact O-N 3.09Å; V145-I149 HydrophobicContact CG1-CD1 3.95Å; V145-I149 HydrophobicContact CG1-CG1 4.45Å; V145-I149 VanDerWaalsContact O-CG1 3.31Å; V145-I149 WeakPolarHBondContact O-CG1 3.24Å; V145-I149 PolarHBondContact O-N 3.4Å; V145-W180 HydrophobicContact CG1-CG 4.43Å; V145-W180 HydrophobicContact CG2-CD2 4.19Å; V145-W180 HydrophobicContact CG2-CH2 4.32Å; V145-W180 HydrophobicContact CG2-CZ2 3.28Å
146	L	72.9	Confident	70.3	Confident	9 Å²	9	53.5 Å²	53.5	5%	0.047	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-40.5	176.2	-61.3	179.8	0	0	0	112	L136 F137 L141 P142 V143 K148 I149 W150	L136-L146 HydrophobicContact CB-CD1 4.26Å; L136-L146 HydrophobicContact CB-CD2 3.62Å; L136-L146 HydrophobicContact CB-CG 4.43Å; L136-L146 HydrophobicContact CD1-CD2 4.26Å; L136-L146 HydrophobicContact CD2-CD2 4.23Å; L136-L146 HydrophobicContact CG-CD2 4.25Å; F137-L146 HydrophobicContact CD2-CD1 4.39Å; L141-L146 HydrophobicContact CB-CD2 3.76Å; L141-L146 HydrophobicContact CB-CG 4.16Å; L141-L146 HydrophobicContact CD1-CD2 4.09Å; P142-L146 PolarHBondContact O-N 3.41Å; P142-L146 VanDerWaalsContact O-N 3.14Å; V143-L146 PolarHBondContact O-N 2.89Å; L146-K148 VanDerWaalsContact C-N 3.33Å; L146-I149 HydrophobicContact CD2-CD1 4.16Å; L146-I149 PolarHBondContact O-N 2.69Å; L146-W150 VanDerWaalsContact O-CB 3.32Å; L146-W150 WeakPolarHBondContact O-CB 3.33Å; L146-W150 PolarHBondContact O-N 3.39Å
147	G	73	Confident	70.6	Confident	29 Å²	29	60.9 Å²	60.9	30%	0.299	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-41.3	173.4	0	0	0	0	0	112.3	V143 K144 V145 W150 E151	V143-G147 PolarHBondContact O-N 3.47Å; K144-G147 PolarHBondContact O-N 3.16Å; V145-G147 VanDerWaalsContact C-N 3.3Å; V145-G147 PolarHBondContact O-N 3.14Å; G147-W150 WeakPolarHBondContact O-CB 3.37Å; G147-W150 PolarHBondContact O-N 3.23Å; G147-E151 WeakPolarHBondContact O-CG 3.16Å; G147-E151 PolarHBondContact O-N 2.88Å
148	K	71.4	Confident	71.1	Confident	40 Å²	40	57.3 Å²	57.3	17%	0.174	31%	0.309	C	S	.	.	H	α-helix	trans	-67.5	-46.5	176.7	-169.9	69.4	-175	-172.4	0	112.1	K144 V145 L146 W150 E151 L152 V192 D194	K144-K148 PolarHBondContact O-N 2.93Å; K144-K148 VanDerWaalsContact O-N 3.16Å; V145-K148 WeakPolarHBondContact O-CB 3.48Å; V145-K148 PolarHBondContact O-N 3.42Å; V145-K148 VanDerWaalsContact O-N 3.09Å; L146-K148 VanDerWaalsContact C-N 3.33Å; K148-W150 PolarHBondContact O-N 2.85Å; K148-E151 PolarHBondContact O-N 3.48Å; K148-L152 HydrophobicContact CG-CD1 4Å; K148-L152 HydrophobicContact CG-CG 4.43Å; K148-L152 VanDerWaalsContact O-CB 3.28Å; K148-L152 WeakPolarHBondContact O-CB 3.06Å; K148-L152 WeakPolarHBondContact O-CG 3.43Å; K148-L152 PolarHBondContact O-N 3.12Å; K148-V192 HydrophobicContact CG-CG1 3.97Å; K148-D194 WeakPolarHBondContact CE-OD1 3.41Å; K148-D194 PolarHBondContact NZ-O 3.21Å; K148-D194 IonicContact NZ-OD1 2.67Å; K148-D194 PolarHBondContact NZ-OD1 3.09Å
149	I	68.5	Low	71.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-54.5	-46.4	174.5	-66.8	160.8	0	0	0	109.9	L141 V145 L146 L152 S153 V169 Y173 L176	L141-I149 HydrophobicContact CD1-CD1 4.07Å; V145-I149 HydrophobicContact CG1-CD1 3.95Å; V145-I149 HydrophobicContact CG1-CG1 4.45Å; V145-I149 VanDerWaalsContact O-CG1 3.31Å; V145-I149 WeakPolarHBondContact O-CG1 3.24Å; V145-I149 PolarHBondContact O-N 3.4Å; L146-I149 HydrophobicContact CD2-CD1 4.16Å; L146-I149 PolarHBondContact O-N 2.69Å; I149-L152 PolarHBondContact O-N 2.91Å; I149-S153 WeakPolarHBondContact O-CB 3.39Å; I149-S153 PolarHBondContact O-N 3.28Å; I149-S153 PolarHBondContact O-OG 2.95Å; I149-V169 HydrophobicContact CG2-CG1 3.93Å; I149-Y173 HydrophobicContact CD1-CD2 4.46Å; I149-L176 HydrophobicContact CB-CD1 4.41Å; I149-L176 HydrophobicContact CD1-CB 4.45Å; I149-L176 HydrophobicContact CD1-CD1 4.34Å; I149-L176 HydrophobicContact CG1-CB 4.37Å; I149-L176 HydrophobicContact CG1-CD1 3.39Å; I149-L176 HydrophobicContact CG1-CG 4.46Å
150	W	75.3	Confident	72.5	Confident	35 Å²	35	56.1 Å²	56.1	13%	0.133	30%	0.299	C	S	.	.	H	α-helix	trans	-57.4	-54.6	177.4	178.6	-81.3	0	0	0	112	V132 L146 G147 K148 L152 S153 D154 G159 L161	V132-W150 HydrophobicContact CB-CZ3 3.93Å; V132-W150 HydrophobicContact CG1-CZ3 4.39Å; V132-W150 HydrophobicContact CG2-CZ3 4.29Å; L146-W150 VanDerWaalsContact O-CB 3.32Å; L146-W150 WeakPolarHBondContact O-CB 3.33Å; L146-W150 PolarHBondContact O-N 3.39Å; G147-W150 WeakPolarHBondContact O-CB 3.37Å; G147-W150 PolarHBondContact O-N 3.23Å; K148-W150 PolarHBondContact O-N 2.85Å; W150-L152 PolarHBondContact O-N 3.15Å; W150-S153 PolarHBondContact O-N 3.02Å; W150-S153 VanDerWaalsContact O-N 3.1Å; W150-D154 PolarHBondContact NE1-OD2 3.06Å; W150-D154 VanDerWaalsContact O-CB 3.31Å; W150-D154 WeakPolarHBondContact O-CB 3.29Å; W150-D154 PolarHBondContact O-N 3.11Å; W150-G159 WeakPolarHBondContact CZ2-O 3.44Å; W150-L161 HydrophobicContact CE3-CD1 3.75Å; W150-L161 HydrophobicContact CE3-CG 4.48Å; W150-L161 HydrophobicContact CH2-CD1 3.64Å; W150-L161 HydrophobicContact CH2-CG 3.74Å; W150-L161 HydrophobicContact CZ2-CG 4.46Å; W150-L161 HydrophobicContact CZ3-CD1 3.13Å; W150-L161 HydrophobicContact CZ3-CG 3.77Å
151	E	75.5	Confident	73.1	Confident	129 Å²	129	52.9 Å²	52.9	60%	0.603	27%	0.266	S	S	*	.	H	α-helix	trans	-61	-27.8	-178.8	-74.7	176.8	-172	0	0	113.5	G147 K148	G147-E151 WeakPolarHBondContact O-CG 3.16Å; G147-E151 PolarHBondContact O-N 2.88Å; K148-E151 PolarHBondContact O-N 3.48Å
152	L	69.6	Low	73.7	Confident	27 Å²	27	53.3 Å²	53.3	14%	0.141	27%	0.268	C	S	.	.	H	α-helix	trans	-79.5	-34.4	177.9	-78.7	-178.9	0	0	0	112.3	K148 I149 W150 L176 L196	K148-L152 HydrophobicContact CG-CD1 4Å; K148-L152 HydrophobicContact CG-CG 4.43Å; K148-L152 VanDerWaalsContact O-CB 3.28Å; K148-L152 WeakPolarHBondContact O-CB 3.06Å; K148-L152 WeakPolarHBondContact O-CG 3.43Å; K148-L152 PolarHBondContact O-N 3.12Å; I149-L152 PolarHBondContact O-N 2.91Å; W150-L152 PolarHBondContact O-N 3.15Å; L152-L176 HydrophobicContact CD1-CD1 4.4Å; L152-L196 HydrophobicContact CB-CD1 3.39Å; L152-L196 HydrophobicContact CD1-CD1 4.07Å; L152-L196 HydrophobicContact CD2-CB 4.09Å; L152-L196 HydrophobicContact CD2-CD1 3.66Å; L152-L196 HydrophobicContact CG-CD1 3.86Å
153	S	70.8	Confident	73.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-86.8	-31.4	-177.1	-52.3	0	0	0	0	113.4	I149 W150 I155 E165 V169	I149-S153 WeakPolarHBondContact O-CB 3.39Å; I149-S153 PolarHBondContact O-N 3.28Å; I149-S153 PolarHBondContact O-OG 2.95Å; W150-S153 PolarHBondContact O-N 3.02Å; W150-S153 VanDerWaalsContact O-N 3.1Å; S153-I155 VanDerWaalsContact C-N 3.32Å; S153-I155 PolarHBondContact O-N 2.77Å; S153-E165 WeakPolarHBondContact O-CG 3.23Å; S153-V169 VanDerWaalsContact OG-CA 3.22Å; S153-V169 WeakPolarHBondContact OG-CA 3.34Å; S153-V169 WeakPolarHBondContact OG-CG2 3.47Å; S153-V169 PolarHBondContact OG-N 2.78Å
154	D	77.7	Confident	73.6	Confident	12 Å²	12	54.5 Å²	54.5	6%	0.064	26%	0.263	C	S	.	.			trans	-78.2	79.2	177.4	-175.1	1.6	0	0	0	109.8	W150 D156 R157 D158 G159	W150-D154 PolarHBondContact NE1-OD2 3.06Å; W150-D154 VanDerWaalsContact O-CB 3.31Å; W150-D154 WeakPolarHBondContact O-CB 3.29Å; W150-D154 PolarHBondContact O-N 3.11Å; D154-D156 VanDerWaalsContact C-N 3.35Å; D154-R157 WeakPolarHBondContact OD1-CA 3.31Å; D154-R157 PolarHBondContact OD1-N 3.01Å; D154-R157 WeakPolarHBondContact OD2-CA 3.36Å; D154-D158 PolarHBondContact OD1-N 2.98Å; D154-G159 PolarHBondContact OD2-N 3.3Å
155	I	71.6	Confident	73.7	Confident	26 Å²	26	45.5 Å²	45.5	13%	0.133	22%	0.223	C	C	.	.	S	Bend	trans	-66.5	-40.9	-175.6	-66.7	-175.4	0	0	0	110.3	S153 E165 L168 I201 K205 I208	S153-I155 VanDerWaalsContact C-N 3.32Å; S153-I155 PolarHBondContact O-N 2.77Å; I155-E165 PolarHBondContact N-OE1 3.05Å; I155-L168 HydrophobicContact CD1-CD1 3.28Å; I155-L168 HydrophobicContact CG1-CD1 3.8Å; I155-I201 HydrophobicContact CD1-CG2 3.92Å; I155-K205 HydrophobicContact CB-CD 3.97Å; I155-K205 HydrophobicContact CD1-CB 3.95Å; I155-K205 HydrophobicContact CD1-CD 4.22Å; I155-K205 HydrophobicContact CG2-CB 4.22Å; I155-K205 HydrophobicContact CG2-CD 4.05Å; I155-I208 HydrophobicContact CG2-CG2 4.36Å
156	D	75.2	Confident	73.6	Confident	62 Å²	62	45.6 Å²	45.6	33%	0.332	22%	0.224	S	C	.	.	S	Bend	trans	-89.3	-4.8	-176.4	64.5	26.4	0	0	0	114.2	D154 D158 K205	D154-D156 VanDerWaalsContact C-N 3.35Å; D156-D158 PolarHBondContact O-N 2.97Å; D156-D158 WeakPolarHBondContact OD1-CB 3.27Å; D156-D158 PolarHBondContact OD1-N 3.02Å; D156-K205 IonicContact OD2-NZ 2.71Å; D156-K205 PolarHBondContact OD2-NZ 3.26Å
157	R	74.5	Confident	73.2	Confident	164 Å²	164	46 Å²	46	62%	0.619	23%	0.227	S	C	*	.			trans	55.2	32.7	176.5	-61.4	-172.8	177.8	-159.9	-3.9	112.4	D154 G159	D154-R157 WeakPolarHBondContact OD1-CA 3.31Å; D154-R157 PolarHBondContact OD1-N 3.01Å; D154-R157 WeakPolarHBondContact OD2-CA 3.36Å; R157-G159 VanDerWaalsContact C-N 3.29Å
158	D	79.4	Confident	72.7	Confident	57 Å²	57	44.7 Å²	44.7	31%	0.305	21%	0.213	S	C	.	.	S	Bend	trans	-83.7	-9.4	178.5	83	-4.9	0	0	0	112.4	K126 D154 D156 Y160	K126-D158 IonicContact NZ-OD2 2.58Å; K126-D158 PolarHBondContact NZ-OD2 3.42Å; D154-D158 PolarHBondContact OD1-N 2.98Å; D156-D158 PolarHBondContact O-N 2.97Å; D156-D158 WeakPolarHBondContact OD1-CB 3.27Å; D156-D158 PolarHBondContact OD1-N 3.02Å; D158-Y160 VanDerWaalsContact C-N 3.33Å; D158-Y160 VanDerWaalsContact O-CD2 3.29Å; D158-Y160 WeakPolarHBondContact O-CD2 2.94Å; D158-Y160 VanDerWaalsContact OD1-CA 3.3Å; D158-Y160 WeakPolarHBondContact OD1-CA 3.46Å; D158-Y160 WeakPolarHBondContact OD1-CB 3.35Å; D158-Y160 PolarHBondContact OD1-N 2.68Å
159	G	78	Confident	72.3	Confident	35 Å²	35	42.9 Å²	42.9	36%	0.361	21%	0.206	S	C	.	.	S	Bend	trans	83.5	8.1	-178.9	0	0	0	0	0	114.1	G129 W150 D154 R157	G129-G159 PolarHBondContact N-O 3.01Å; W150-G159 WeakPolarHBondContact CZ2-O 3.44Å; D154-G159 PolarHBondContact OD2-N 3.3Å; R157-G159 VanDerWaalsContact C-N 3.29Å
160	Y	80.2	Confident	71.9	Confident	118 Å²	118	43 Å²	43	46%	0.463	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	159.2	174.7	-56	-93.3	0	0	0	109.7	K126 L127 D158	K126-Y160 HydrophobicContact CB-CD1 4.48Å; K126-Y160 HydrophobicContact CB-CG 4.45Å; L127-Y160 CarbonylContact O-C 3.45Å; L127-Y160 WeakPolarHBondContact O-CA 3.2Å; D158-Y160 VanDerWaalsContact C-N 3.33Å; D158-Y160 VanDerWaalsContact O-CD2 3.29Å; D158-Y160 WeakPolarHBondContact O-CD2 2.94Å; D158-Y160 VanDerWaalsContact OD1-CA 3.3Å; D158-Y160 WeakPolarHBondContact OD1-CA 3.46Å; D158-Y160 WeakPolarHBondContact OD1-CB 3.35Å; D158-Y160 PolarHBondContact OD1-N 2.68Å
161	L	75.6	Confident	71.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.5	172.2	-73.6	156.9	0	0	0	108.5	K126 L127 V132 W150 E165 V169	K126-L161 CarbonylContact C-O 3.57Å; K126-L161 WeakPolarHBondContact CA-O 3.24Å; L127-L161 PolarHBondContact N-O 2.99Å; L127-L161 PolarHBondContact O-N 2.84Å; V132-L161 HydrophobicContact CB-CD1 3.92Å; V132-L161 HydrophobicContact CG1-CD1 3.7Å; V132-L161 HydrophobicContact CG2-CD1 3.61Å; W150-L161 HydrophobicContact CE3-CD1 3.75Å; W150-L161 HydrophobicContact CE3-CG 4.48Å; W150-L161 HydrophobicContact CH2-CD1 3.64Å; W150-L161 HydrophobicContact CH2-CG 3.74Å; W150-L161 HydrophobicContact CZ2-CG 4.46Å; W150-L161 HydrophobicContact CZ3-CD1 3.13Å; W150-L161 HydrophobicContact CZ3-CG 3.77Å; L161-E165 WeakPolarHBondContact CA-OE2 3.29Å; L161-E165 HydrophobicContact CB-CB 4.36Å; L161-E165 HydrophobicContact CD2-CB 3.52Å; L161-V169 HydrophobicContact CD1-CG2 3.63Å; L161-V169 HydrophobicContact CD2-CG2 3.63Å; L161-V169 HydrophobicContact CG-CG2 4.3Å
162	D	77.2	Confident	70.2	Confident	28 Å²	28	36.8 Å²	36.8	15%	0.15	18%	0.182	C	C	.	.			trans	-74.4	177.8	167.1	66.8	35.2	0	0	0	111.3	K126 D164 E165 M166 K205	K126-D162 HydrophobicContact CG-CB 4.49Å; D162-D164 PolarHBondContact O-N 2.86Å; D162-D164 WeakPolarHBondContact OD1-CA 3.06Å; D162-D164 WeakPolarHBondContact OD1-CB 3.49Å; D162-D164 PolarHBondContact OD1-N 2.76Å; D162-E165 PolarHBondContact N-OE2 3.45Å; D162-E165 PolarHBondContact O-N 2.86Å; D162-E165 WeakPolarHBondContact OD1-CB 3.34Å; D162-E165 VanDerWaalsContact OD1-CG 3.32Å; D162-E165 WeakPolarHBondContact OD1-CG 3.32Å; D162-E165 PolarHBondContact OD1-N 3.42Å; D162-M166 WeakPolarHBondContact O-CB 2.97Å; D162-M166 PolarHBondContact O-N 3.48Å; D162-K205 VanDerWaalsContact OD2-CE 3.23Å; D162-K205 WeakPolarHBondContact OD2-CE 3.45Å; D162-K205 IonicContact OD2-NZ 2.78Å; D162-K205 PolarHBondContact OD2-NZ 2.96Å
163	K	71.1	Confident	69.8	Low	117 Å²	117	38 Å²	38	51%	0.509	19%	0.185	S	C	.	.	H	α-helix	trans	-60	-37.2	178.9	-71.6	-174.9	176.2	-165	0	112.3	F117 C167	F117-K163 HydrophobicContact CD1-CG 4.04Å; F117-K163 HydrophobicContact CD2-CG 4.41Å; F117-K163 HydrophobicContact CE1-CD 4.12Å; F117-K163 HydrophobicContact CE1-CG 3.44Å; F117-K163 VanDerWaalsContact CE1-CG 3.44Å; F117-K163 HydrophobicContact CE2-CG 3.88Å; F117-K163 HydrophobicContact CG-CG 4.5Å; F117-K163 HydrophobicContact CZ-CB 4.4Å; F117-K163 HydrophobicContact CZ-CD 4.46Å; F117-K163 HydrophobicContact CZ-CG 3.37Å; K163-C167 PolarHBondContact O-N 2.84Å; K163-C167 PolarHBondContact O-SG 3.07Å
164	D	67.4	Low	69	Low	62 Å²	62	42.1 Å²	42.1	33%	0.332	21%	0.205	S	C	.	.	H	α-helix	trans	-72	-41.4	-177.2	-68	-15	0	0	0	109.7	D162 C167 L168 P202 S204	D162-D164 PolarHBondContact O-N 2.86Å; D162-D164 WeakPolarHBondContact OD1-CA 3.06Å; D162-D164 WeakPolarHBondContact OD1-CB 3.49Å; D162-D164 PolarHBondContact OD1-N 2.76Å; D164-C167 WeakPolarHBondContact O-CB 3.43Å; D164-C167 PolarHBondContact O-N 2.9Å; D164-L168 PolarHBondContact O-N 2.77Å; D164-L168 VanDerWaalsContact O-N 3.1Å; D164-P202 HydrophobicContact CB-CB 4.37Å; D164-P202 HydrophobicContact CB-CG 4.19Å; D164-S204 PolarHBondContact OD2-OG 3.36Å
165	E	73.9	Confident	67.9	Low	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-72.1	-36.1	176.6	-67.1	173.3	146.4	0	0	112.8	S153 I155 L161 D162 C167 L168 V169 K205	S153-E165 WeakPolarHBondContact O-CG 3.23Å; I155-E165 PolarHBondContact N-OE1 3.05Å; L161-E165 WeakPolarHBondContact CA-OE2 3.29Å; L161-E165 HydrophobicContact CB-CB 4.36Å; L161-E165 HydrophobicContact CD2-CB 3.52Å; D162-E165 PolarHBondContact N-OE2 3.45Å; D162-E165 PolarHBondContact O-N 2.86Å; D162-E165 WeakPolarHBondContact OD1-CB 3.34Å; D162-E165 VanDerWaalsContact OD1-CG 3.32Å; D162-E165 WeakPolarHBondContact OD1-CG 3.32Å; D162-E165 PolarHBondContact OD1-N 3.42Å; E165-C167 PolarHBondContact O-N 3.24Å; E165-L168 HydrophobicContact CG-CD1 4.37Å; E165-L168 CarbonylContact O-C 3.59Å; E165-L168 WeakPolarHBondContact O-CA 3.08Å; E165-L168 VanDerWaalsContact O-CB 3.24Å; E165-L168 WeakPolarHBondContact O-CB 3.22Å; E165-L168 PolarHBondContact O-N 2.66Å; E165-V169 WeakPolarHBondContact O-CG2 3.45Å; E165-V169 PolarHBondContact O-N 2.73Å; E165-K205 HydrophobicContact CG-CD 4.38Å; E165-K205 IonicContact OE1-NZ 3.54Å; E165-K205 PolarHBondContact OE1-NZ 3.12Å; E165-K205 IonicContact OE2-NZ 2.81Å
166	M	66.6	Low	67.1	Low	7 Å²	7	43.2 Å²	43.2	3%	0.034	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-33	172	-174.6	66.9	-176.4	0	0	110.8	I116 F117 L127 V132 D162 L168 V169 S170	I116-M166 HydrophobicContact CG2-CE 4.09Å; F117-M166 HydrophobicContact CD2-CB 3.9Å; F117-M166 HydrophobicContact CD2-CG 3.95Å; F117-M166 HydrophobicContact CE2-CB 4.34Å; L127-M166 HydrophobicContact CD1-SD 4.2Å; V132-M166 HydrophobicContact CG1-CE 4.4Å; V132-M166 HydrophobicContact CG1-SD 4.02Å; V132-M166 HydrophobicContact CG2-SD 4.26Å; D162-M166 WeakPolarHBondContact O-CB 2.97Å; D162-M166 PolarHBondContact O-N 3.48Å; M166-L168 VanDerWaalsContact C-N 3.33Å; M166-V169 WeakPolarHBondContact O-CB 3.12Å; M166-V169 PolarHBondContact O-N 3.06Å; M166-V169 HydrophobicContact SD-CB 4.35Å; M166-V169 HydrophobicContact SD-CG2 4.39Å; M166-S170 WeakPolarHBondContact O-CB 3.02Å; M166-S170 PolarHBondContact O-N 2.97Å; M166-S170 PolarHBondContact O-OG 2.68Å
167	C	64.7	Low	66.2	Low	18 Å²	18	41.9 Å²	41.9	12%	0.122	21%	0.207	C	C	.	.	H	α-helix	trans	-74.6	-26.1	173.3	-63.4	0	0	0	0	112.8	W103 I105 L110 K163 D164 E165 S170 S171	W103-C167 HydrophobicContact CH2-CB 3.3Å; W103-C167 HydrophobicContact CZ2-CB 2.96Å; I105-C167 HydrophobicContact CD1-CB 3.9Å; I105-C167 VanDerWaalsContact CD1-O 3.29Å; I105-C167 WeakPolarHBondContact CD1-O 3.21Å; L110-C167 VanDerWaalsContact CD1-SG 3.54Å; K163-C167 PolarHBondContact O-N 2.84Å; K163-C167 PolarHBondContact O-SG 3.07Å; D164-C167 WeakPolarHBondContact O-CB 3.43Å; D164-C167 PolarHBondContact O-N 2.9Å; E165-C167 PolarHBondContact O-N 3.24Å; C167-S170 WeakPolarHBondContact O-CB 3.19Å; C167-S170 PolarHBondContact O-N 3.31Å; C167-S171 WeakPolarHBondContact O-CB 3.26Å; C167-S171 PolarHBondContact O-N 2.84Å
168	L	62.9	Low	65.1	Low	1 Å²	1	37 Å²	37	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-65.9	-47.7	165.6	-61	171.6	0	0	0	111.5	I155 D164 E165 M166 S170 S171 D172 M200 P202	I155-L168 HydrophobicContact CD1-CD1 3.28Å; I155-L168 HydrophobicContact CG1-CD1 3.8Å; D164-L168 PolarHBondContact O-N 2.77Å; D164-L168 VanDerWaalsContact O-N 3.1Å; E165-L168 HydrophobicContact CG-CD1 4.37Å; E165-L168 CarbonylContact O-C 3.59Å; E165-L168 WeakPolarHBondContact O-CA 3.08Å; E165-L168 VanDerWaalsContact O-CB 3.24Å; E165-L168 WeakPolarHBondContact O-CB 3.22Å; E165-L168 PolarHBondContact O-N 2.66Å; M166-L168 VanDerWaalsContact C-N 3.33Å; L168-S170 PolarHBondContact O-N 3.34Å; L168-S171 CarbonylContact O-C 3.59Å; L168-S171 PolarHBondContact O-N 3.03Å; L168-D172 WeakPolarHBondContact O-CB 3.3Å; L168-D172 PolarHBondContact O-N 2.84Å; L168-M200 WeakPolarHBondContact CD2-O 2.92Å; L168-P202 HydrophobicContact CD1-CG 3.77Å; L168-P202 HydrophobicContact CD2-CG 3.71Å; L168-P202 HydrophobicContact CG-CG 3.75Å
169	V	62.5	Low	63.6	Low	3 Å²	3	40.5 Å²	40.5	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-48.6	-42.4	171.3	177	0	0	0	0	108.5	L136 I149 S153 L161 E165 M166 Y173	L136-V169 HydrophobicContact CD1-CG1 4.35Å; L136-V169 HydrophobicContact CD2-CG1 4.15Å; I149-V169 HydrophobicContact CG2-CG1 3.93Å; S153-V169 VanDerWaalsContact OG-CA 3.22Å; S153-V169 WeakPolarHBondContact OG-CA 3.34Å; S153-V169 WeakPolarHBondContact OG-CG2 3.47Å; S153-V169 PolarHBondContact OG-N 2.78Å; L161-V169 HydrophobicContact CD1-CG2 3.63Å; L161-V169 HydrophobicContact CD2-CG2 3.63Å; L161-V169 HydrophobicContact CG-CG2 4.3Å; E165-V169 WeakPolarHBondContact O-CG2 3.45Å; E165-V169 PolarHBondContact O-N 2.73Å; M166-V169 WeakPolarHBondContact O-CB 3.12Å; M166-V169 PolarHBondContact O-N 3.06Å; M166-V169 HydrophobicContact SD-CB 4.35Å; M166-V169 HydrophobicContact SD-CG2 4.39Å; V169-Y173 VanDerWaalsContact O-CA 3.23Å; V169-Y173 WeakPolarHBondContact O-CA 2.78Å; V169-Y173 WeakPolarHBondContact O-CB 3.45Å; V169-Y173 PolarHBondContact O-N 3.18Å
170	S	59.2	Low	62.2	Low	3 Å²	3	41.6 Å²	41.6	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-71.4	-41.4	-177.4	-58.1	0	0	0	0	113.6	Y113 M166 C167 L168 Y173 M174	Y113-S170 WeakPolarHBondContact CD1-OG 3.35Å; Y113-S170 VanDerWaalsContact CD2-CB 3.41Å; Y113-S170 WeakPolarHBondContact CD2-OG 3.23Å; Y113-S170 VanDerWaalsContact CE1-OG 3.27Å; Y113-S170 WeakPolarHBondContact CE1-OG 3.4Å; Y113-S170 VanDerWaalsContact CE2-CB 3.41Å; Y113-S170 VanDerWaalsContact CZ-CB 3.47Å; M166-S170 WeakPolarHBondContact O-CB 3.02Å; M166-S170 PolarHBondContact O-N 2.97Å; M166-S170 PolarHBondContact O-OG 2.68Å; C167-S170 WeakPolarHBondContact O-CB 3.19Å; C167-S170 PolarHBondContact O-N 3.31Å; L168-S170 PolarHBondContact O-N 3.34Å; S170-Y173 PolarHBondContact O-N 3.5Å; S170-M174 PolarHBondContact O-N 3.08Å
171	S	58.7	Low	60.9	Low	24 Å²	24	43.7 Å²	43.7	17%	0.168	22%	0.215	C	C	.	.	H	α-helix	trans	-64.8	-48.7	174.5	-124.1	0	0	0	0	111.5	C167 L168 Y173 V175 M200	C167-S171 WeakPolarHBondContact O-CB 3.26Å; C167-S171 PolarHBondContact O-N 2.84Å; L168-S171 CarbonylContact O-C 3.59Å; L168-S171 PolarHBondContact O-N 3.03Å; S171-Y173 VanDerWaalsContact C-N 3.33Å; S171-V175 WeakPolarHBondContact O-CG2 3.44Å; S171-V175 PolarHBondContact O-N 3.26Å; S171-M200 WeakPolarHBondContact OG-CE 3.34Å
172	D	58.1	Low	59.7	Low	8 Å²	8	52.4 Å²	52.4	4%	0.043	25%	0.253	C	S	.	.	H	α-helix	trans	-68.7	-33.1	175.7	-68.3	-45.4	0	0	0	111.3	L168 L176 L196	L168-D172 WeakPolarHBondContact O-CB 3.3Å; L168-D172 PolarHBondContact O-N 2.84Å; D172-L176 HydrophobicContact CB-CD1 4.23Å; D172-L176 WeakPolarHBondContact O-CA 3.48Å; D172-L176 WeakPolarHBondContact O-CB 3.37Å; D172-L176 WeakPolarHBondContact O-CD1 2.9Å; D172-L176 WeakPolarHBondContact O-CG 3.46Å; D172-L176 PolarHBondContact O-N 2.79Å; D172-L196 WeakPolarHBondContact OD1-CD1 3.26Å; D172-L196 WeakPolarHBondContact OD2-CD1 3.07Å
173	Y	60.3	Low	58.5	Low	53 Å²	53	53.7 Å²	53.7	21%	0.208	26%	0.264	C	S	.	.	H	α-helix	trans	-69.7	-43.8	178.4	175.2	-87.9	0	0	0	110	L136 S139 L141 I149 V169 S170 S171 V175 L176 T177	L136-Y173 HydrophobicContact CD2-CD2 3.63Å; L136-Y173 HydrophobicContact CD2-CE2 3.87Å; S139-Y173 WeakPolarHBondContact CB-OH 3.49Å; L141-Y173 HydrophobicContact CD1-CD2 4.06Å; L141-Y173 HydrophobicContact CD1-CE2 3.62Å; I149-Y173 HydrophobicContact CD1-CD2 4.46Å; V169-Y173 VanDerWaalsContact O-CA 3.23Å; V169-Y173 WeakPolarHBondContact O-CA 2.78Å; V169-Y173 WeakPolarHBondContact O-CB 3.45Å; V169-Y173 PolarHBondContact O-N 3.18Å; S170-Y173 PolarHBondContact O-N 3.5Å; S171-Y173 VanDerWaalsContact C-N 3.33Å; Y173-V175 VanDerWaalsContact C-N 3.33Å; Y173-V175 PolarHBondContact O-N 2.99Å; Y173-L176 CarbonylContact O-C 3.59Å; Y173-L176 PolarHBondContact O-N 2.94Å; Y173-T177 HydrophobicContact CD1-CG2 3.85Å; Y173-T177 HydrophobicContact CD2-CG2 4.07Å; Y173-T177 HydrophobicContact CE1-CG2 3.52Å; Y173-T177 HydrophobicContact CE2-CG2 3.76Å; Y173-T177 HydrophobicContact CG-CG2 4.1Å; Y173-T177 VanDerWaalsContact CZ-CG2 3.45Å; Y173-T177 VanDerWaalsContact O-CB 3.3Å; Y173-T177 WeakPolarHBondContact O-CB 3.17Å; Y173-T177 VanDerWaalsContact O-CG2 3.26Å; Y173-T177 WeakPolarHBondContact O-CG2 3.43Å; Y173-T177 PolarHBondContact O-N 3.39Å; Y173-T177 PolarHBondContact O-OG1 2.89Å
174	M	55.1	Low	57.4	Low	86 Å²	86	53.8 Å²	53.8	42%	0.424	27%	0.271	S	S	.	.	H	α-helix	trans	-64.8	-40.9	177	-170.8	172.2	76.9	0	0	111.7	S170 T177 S178	S170-M174 PolarHBondContact O-N 3.08Å; M174-T177 WeakPolarHBondContact CA-OG1 3.42Å; M174-T177 PolarHBondContact O-OG1 2.91Å; M174-T177 VanDerWaalsContact O-OG1 3.08Å; M174-S178 WeakPolarHBondContact O-CB 3.41Å; M174-S178 PolarHBondContact O-N 3.39Å; M174-S178 PolarHBondContact O-OG 2.84Å
175	V	54.4	Low	56.4	Low	49 Å²	49	54.3 Å²	54.3	30%	0.297	29%	0.29	S	S	.	.	H	α-helix	trans	-63	-54.9	173.1	175.8	0	0	0	0	108.9	S171 Y173 T177 S178 Y179 M200	S171-V175 WeakPolarHBondContact O-CG2 3.44Å; S171-V175 PolarHBondContact O-N 3.26Å; Y173-V175 VanDerWaalsContact C-N 3.33Å; Y173-V175 PolarHBondContact O-N 2.99Å; V175-T177 VanDerWaalsContact C-N 3.34Å; V175-T177 PolarHBondContact O-N 3.28Å; V175-S178 CarbonylContact O-C 3.6Å; V175-S178 PolarHBondContact O-N 3.01Å; V175-S178 PolarHBondContact O-OG 2.74Å; V175-Y179 HydrophobicContact CG1-CD2 3.59Å; V175-Y179 HydrophobicContact CG1-CE2 3.57Å; V175-Y179 VanDerWaalsContact O-CD2 3.24Å; V175-Y179 WeakPolarHBondContact O-CD2 3.36Å; V175-Y179 PolarHBondContact O-N 3.5Å; V175-M200 HydrophobicContact CG2-CE 4.08Å; V175-M200 HydrophobicContact CG2-SD 4.24Å
176	L	54.4	Low	55	Low	13 Å²	13	57.3 Å²	57.3	7%	0.068	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-30.2	-176.5	-73.2	161.8	0	0	0	113.3	I149 L152 D172 Y173 Y179 W180 V192	I149-L176 HydrophobicContact CB-CD1 4.41Å; I149-L176 HydrophobicContact CD1-CB 4.45Å; I149-L176 HydrophobicContact CD1-CD1 4.34Å; I149-L176 HydrophobicContact CG1-CB 4.37Å; I149-L176 HydrophobicContact CG1-CD1 3.39Å; I149-L176 HydrophobicContact CG1-CG 4.46Å; L152-L176 HydrophobicContact CD1-CD1 4.4Å; D172-L176 HydrophobicContact CB-CD1 4.23Å; D172-L176 WeakPolarHBondContact O-CA 3.48Å; D172-L176 WeakPolarHBondContact O-CB 3.37Å; D172-L176 WeakPolarHBondContact O-CD1 2.9Å; D172-L176 WeakPolarHBondContact O-CG 3.46Å; D172-L176 PolarHBondContact O-N 2.79Å; Y173-L176 CarbonylContact O-C 3.59Å; Y173-L176 PolarHBondContact O-N 2.94Å; L176-Y179 PolarHBondContact O-N 3.45Å; L176-W180 VanDerWaalsContact O-CB 3.23Å; L176-W180 WeakPolarHBondContact O-CB 3.13Å; L176-W180 PolarHBondContact O-N 3.16Å; L176-V192 HydrophobicContact CD2-CG1 3.7Å
177	T	55.8	Low	53.8	Low	34 Å²	34	64.7 Å²	64.7	21%	0.209	35%	0.354	C	S	.	.	H	α-helix	trans	-71.2	-39.8	170.7	52.6	0	0	0	0	111	L141 Y173 M174 V175 Y179 W180 E181	L141-T177 HydrophobicContact CD1-CG2 4.01Å; Y173-T177 HydrophobicContact CD1-CG2 3.85Å; Y173-T177 HydrophobicContact CD2-CG2 4.07Å; Y173-T177 HydrophobicContact CE1-CG2 3.52Å; Y173-T177 HydrophobicContact CE2-CG2 3.76Å; Y173-T177 HydrophobicContact CG-CG2 4.1Å; Y173-T177 VanDerWaalsContact CZ-CG2 3.45Å; Y173-T177 VanDerWaalsContact O-CB 3.3Å; Y173-T177 WeakPolarHBondContact O-CB 3.17Å; Y173-T177 VanDerWaalsContact O-CG2 3.26Å; Y173-T177 WeakPolarHBondContact O-CG2 3.43Å; Y173-T177 PolarHBondContact O-N 3.39Å; Y173-T177 PolarHBondContact O-OG1 2.89Å; M174-T177 WeakPolarHBondContact CA-OG1 3.42Å; M174-T177 PolarHBondContact O-OG1 2.91Å; M174-T177 VanDerWaalsContact O-OG1 3.08Å; V175-T177 VanDerWaalsContact C-N 3.34Å; V175-T177 PolarHBondContact O-N 3.28Å; T177-Y179 VanDerWaalsContact C-N 3.29Å; T177-Y179 PolarHBondContact O-N 2.86Å; T177-W180 PolarHBondContact O-N 3.28Å; T177-E181 WeakPolarHBondContact O-CB 3.45Å; T177-E181 PolarHBondContact O-N 3.29Å
178	S	50.9	Low	52.6	Low	61 Å²	61	71.4 Å²	71.4	43%	0.427	38%	0.384	S	S	.	.	H	α-helix	trans	-64.2	-37.2	173.3	75.5	0	0	0	0	111.5	M174 V175 K182	M174-S178 WeakPolarHBondContact O-CB 3.41Å; M174-S178 PolarHBondContact O-N 3.39Å; M174-S178 PolarHBondContact O-OG 2.84Å; V175-S178 CarbonylContact O-C 3.6Å; V175-S178 PolarHBondContact O-N 3.01Å; V175-S178 PolarHBondContact O-OG 2.74Å; S178-K182 WeakPolarHBondContact O-CB 3.44Å; S178-K182 PolarHBondContact O-N 3.18Å; S178-K182 VanDerWaalsContact O-N 3.07Å
179	Y	49.4	Very low	51.5	Low	131 Å²	131	78 Å²	78	51%	0.514	42%	0.419	S	S	.	.	H	α-helix	trans	-70.1	-39.2	172.8	-86.5	-90.8	0	0	0	111.7	V175 L176 T177 S183	V175-Y179 HydrophobicContact CG1-CD2 3.59Å; V175-Y179 HydrophobicContact CG1-CE2 3.57Å; V175-Y179 VanDerWaalsContact O-CD2 3.24Å; V175-Y179 WeakPolarHBondContact O-CD2 3.36Å; V175-Y179 PolarHBondContact O-N 3.5Å; L176-Y179 PolarHBondContact O-N 3.45Å; T177-Y179 VanDerWaalsContact C-N 3.29Å; T177-Y179 PolarHBondContact O-N 2.86Å; Y179-S183 WeakPolarHBondContact O-CB 3.34Å; Y179-S183 PolarHBondContact O-N 2.76Å
180	W	48.2	Very low	50.7	Low	58 Å²	58	85 Å²	85	22%	0.22	46%	0.456	C	S	.	.	H	α-helix	trans	-70.8	-40.5	178.2	-109.9	75.6	0	0	0	113.1	L141 P142 V145 L176 T177 S183 N184	L141-W180 HydrophobicContact CD2-CB 4.02Å; L141-W180 HydrophobicContact CD2-CD2 4.13Å; L141-W180 HydrophobicContact CD2-CE3 4.24Å; L141-W180 HydrophobicContact CD2-CG 3.96Å; P142-W180 HydrophobicContact CB-CH2 4.49Å; P142-W180 HydrophobicContact CG-CH2 3.39Å; P142-W180 HydrophobicContact CG-CZ2 3.94Å; P142-W180 HydrophobicContact CG-CZ3 3.69Å; V145-W180 HydrophobicContact CG1-CG 4.43Å; V145-W180 HydrophobicContact CG2-CD2 4.19Å; V145-W180 HydrophobicContact CG2-CH2 4.32Å; V145-W180 HydrophobicContact CG2-CZ2 3.28Å; L176-W180 VanDerWaalsContact O-CB 3.23Å; L176-W180 WeakPolarHBondContact O-CB 3.13Å; L176-W180 PolarHBondContact O-N 3.16Å; T177-W180 PolarHBondContact O-N 3.28Å; W180-S183 PolarHBondContact O-N 3.3Å; W180-N184 VanDerWaalsContact CZ3-ND2 3.3Å; W180-N184 WeakPolarHBondContact CZ3-ND2 3.37Å; W180-N184 WeakPolarHBondContact CZ3-OD1 3.4Å; W180-N184 VanDerWaalsContact O-CB 3.26Å; W180-N184 WeakPolarHBondContact O-CB 3.47Å; W180-N184 PolarHBondContact O-N 2.87Å
181	E	52.9	Low	50.4	Low	162 Å²	162	89.8 Å²	89.8	76%	0.757	49%	0.487	S	S	*	.	H	α-helix	trans	-67.6	-40.6	176.5	-171.9	168.6	-152.5	0	0	110.7	T177	T177-E181 WeakPolarHBondContact O-CB 3.45Å; T177-E181 PolarHBondContact O-N 3.29Å
182	K	50.7	Low	49.9	Very low	183 Å²	183	90.7 Å²	90.7	80%	0.796	49%	0.491	S	S	*	.	H	α-helix	trans	-71	-31	175.1	-162.5	171.4	-175	-179.8	0	113	S178	S178-K182 WeakPolarHBondContact O-CB 3.44Å; S178-K182 PolarHBondContact O-N 3.18Å; S178-K182 VanDerWaalsContact O-N 3.07Å
183	S	51.2	Low	49.7	Very low	55 Å²	55	93.2 Å²	93.2	39%	0.385	51%	0.509	S	S	.	.	H	α-helix	trans	-87.4	-26	-179.5	-165.6	0	0	0	0	113.4	Y179 W180 G185 A186	Y179-S183 WeakPolarHBondContact O-CB 3.34Å; Y179-S183 PolarHBondContact O-N 2.76Å; W180-S183 PolarHBondContact O-N 3.3Å; S183-G185 PolarHBondContact O-N 3.44Å; S183-G185 VanDerWaalsContact O-N 3.12Å; S183-A186 PolarHBondContact O-N 3.4Å; S183-A186 VanDerWaalsContact O-O 3.05Å
184	N	48.1	Very low	49.4	Very low	119 Å²	119	96.3 Å²	96.3	64%	0.636	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-6.1	174.8	-92.9	-12.1	0	0	0	114.7	W180	W180-N184 VanDerWaalsContact CZ3-ND2 3.3Å; W180-N184 WeakPolarHBondContact CZ3-ND2 3.37Å; W180-N184 WeakPolarHBondContact CZ3-OD1 3.4Å; W180-N184 VanDerWaalsContact O-CB 3.26Å; W180-N184 WeakPolarHBondContact O-CB 3.47Å; W180-N184 PolarHBondContact O-N 2.87Å
185	G	46.5	Very low	49	Very low	72 Å²	72	97.5 Å²	97.5	74%	0.742	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-12.3	167.7	0	0	0	0	0	114.2	S183	S183-G185 PolarHBondContact O-N 3.44Å; S183-G185 VanDerWaalsContact O-N 3.12Å
186	A	44.3	Very low	48.7	Very low	64 Å²	64	96.2 Å²	96.2	53%	0.529	53%	0.532	S	S	.	.	S	Bend	trans	-113	102.1	-178.5	0	0	0	0	0	109	S183 E188	S183-A186 PolarHBondContact O-N 3.4Å; S183-A186 VanDerWaalsContact O-O 3.05Å; A186-E188 PolarHBondContact O-N 2.81Å
187	L	42.3	Very low	48.5	Very low	161 Å²	161	100.7 Å²	100.7	84%	0.843	56%	0.556	S	S	*	*			trans	-26.6	120.7	167	-77	142.9	0	0	0	113.2
188	E	38.1	Very low	48.1	Very low	160 Å²	160	104.9 Å²	104.9	75%	0.748	57%	0.573	S	S	*	*	S	Bend	trans	50.8	101.5	141.6	-139	174.1	158.3	0	0	115.9	A186	A186-E188 PolarHBondContact O-N 2.81Å
189	N	40.2	Very low	48	Very low	140 Å²	140	109.1 Å²	109.1	75%	0.749	59%	0.591	S	S	*	*			trans	128.1	3.2	142.3	-62.5	-64.7	0	0	0	119.8
190	D	45.9	Very low	48.1	Very low	148 Å²	148	104.9 Å²	104.9	79%	0.791	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-94.7	125.2	177.8	-80.3	-29.6	0	0	0	114.4
191	P	53.5	Low	48.1	Very low	105 Å²	105	102.3 Å²	102.3	68%	0.682	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-75.1	140.8	-170.7	30.7	-34.3	0	0	0	111.8
192	V	48.4	Very low	48	Very low	42 Å²	42	94.6 Å²	94.6	26%	0.255	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-47.5	129.2	167.3	177.9	0	0	0	0	109	K148 L176 D194	K148-V192 HydrophobicContact CG-CG1 3.97Å; L176-V192 HydrophobicContact CD2-CG1 3.7Å; V192-D194 PolarHBondContact O-N 2.64Å
193	P	53.5	Low	48	Very low	62 Å²	62	89.5 Å²	89.5	40%	0.403	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-52.9	124.8	-178.8	-26.2	33.2	0	0	0	111.7	T195	P193-T195 PolarHBondContact O-N 3.43Å
194	D	52.7	Low	48.2	Very low	118 Å²	118	91.2 Å²	91.2	63%	0.631	53%	0.528	S	S	*	.	S	Bend	trans	-75.5	-7	-174.9	-90	-39.9	0	0	0	114.2	K148 V192	K148-D194 WeakPolarHBondContact CE-OD1 3.41Å; K148-D194 PolarHBondContact NZ-O 3.21Å; K148-D194 IonicContact NZ-OD1 2.67Å; K148-D194 PolarHBondContact NZ-OD1 3.09Å; V192-D194 PolarHBondContact O-N 2.64Å
195	T	46.9	Very low	48.4	Very low	110 Å²	110	86.3 Å²	86.3	68%	0.675	50%	0.501	S	S	*	.	S	Bend	trans	-125.3	123.7	-171.9	54.1	0	0	0	0	111.9	P193	P193-T195 PolarHBondContact O-N 3.43Å
196	L	49.4	Very low	48.9	Very low	23 Å²	23	86.1 Å²	86.1	12%	0.12	48%	0.478	C	S	.	.			trans	-62	131.3	168.6	-146.4	93.3	0	0	0	110.1	L152 D172 Q198 I201	L152-L196 HydrophobicContact CB-CD1 3.39Å; L152-L196 HydrophobicContact CD1-CD1 4.07Å; L152-L196 HydrophobicContact CD2-CB 4.09Å; L152-L196 HydrophobicContact CD2-CD1 3.66Å; L152-L196 HydrophobicContact CG-CD1 3.86Å; D172-L196 WeakPolarHBondContact OD1-CD1 3.26Å; D172-L196 WeakPolarHBondContact OD2-CD1 3.07Å; L196-Q198 PolarHBondContact O-N 3.09Å; L196-I201 HydrophobicContact CD2-CG1 4.08Å
197	N	49.2	Very low	49.1	Very low	107 Å²	107	85.4 Å²	85.4	57%	0.572	48%	0.478	S	S	*	.			trans	-65.6	117.3	166.6	-79.3	-22.9	0	0	0	108.7	N199 M200	N197-N199 PolarHBondContact O-N 3.31Å; N197-M200 HydrophobicContact CB-CG 4.44Å; N197-M200 WeakPolarHBondContact O-CG 3.3Å; N197-M200 PolarHBondContact O-N 3.44Å
198	Q	48	Very low	49.8	Very low	122 Å²	122	82 Å²	82	57%	0.57	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-57.5	-15.5	-175.6	-54	-177	16	0	0	114.1	L196 M200 I201 F209	L196-Q198 PolarHBondContact O-N 3.09Å; Q198-M200 PolarHBondContact O-N 3.13Å; Q198-I201 HydrophobicContact CB-CD1 4.4Å; Q198-F209 HydrophobicContact CB-CE1 4.33Å; Q198-F209 VanDerWaalsContact CD-CE1 3.46Å; Q198-F209 HydrophobicContact CG-CD1 4.31Å; Q198-F209 HydrophobicContact CG-CE1 3.46Å; Q198-F209 VanDerWaalsContact CG-CE1 3.46Å; Q198-F209 HydrophobicContact CG-CZ 3.85Å
199	N	48.3	Very low	50.4	Low	149 Å²	149	77.1 Å²	77.1	80%	0.797	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-71.4	-12.2	176.5	-66.7	-22.6	0	0	0	113.7	N197	N197-N199 PolarHBondContact O-N 3.31Å
200	M	51	Low	50.7	Low	42 Å²	42	79.8 Å²	79.8	21%	0.207	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-90.1	-12.7	179.9	-51.5	-151	87.9	0	0	112.9	L168 S171 V175 N197 Q198	L168-M200 WeakPolarHBondContact CD2-O 2.92Å; S171-M200 WeakPolarHBondContact OG-CE 3.34Å; V175-M200 HydrophobicContact CG2-CE 4.08Å; V175-M200 HydrophobicContact CG2-SD 4.24Å; N197-M200 HydrophobicContact CB-CG 4.44Å; N197-M200 WeakPolarHBondContact O-CG 3.3Å; N197-M200 PolarHBondContact O-N 3.44Å; Q198-M200 PolarHBondContact O-N 3.13Å
201	I	49.8	Very low	51	Low	5 Å²	5	78.5 Å²	78.5	3%	0.026	43%	0.427	C	S	.	.	S	Bend	trans	-70.6	130.5	-172.5	-58.1	167.8	0	0	0	111	I155 L196 Q198 K205 R206 F209	I155-I201 HydrophobicContact CD1-CG2 3.92Å; L196-I201 HydrophobicContact CD2-CG1 4.08Å; Q198-I201 HydrophobicContact CB-CD1 4.4Å; I201-K205 HydrophobicContact CG2-CB 4.27Å; I201-R206 HydrophobicContact CB-CG 4.14Å; I201-R206 HydrophobicContact CG2-CG 3.86Å; I201-R206 PolarHBondContact O-NE 3.17Å; I201-R206 VanDerWaalsContact O-NE 3.14Å; I201-F209 HydrophobicContact CD1-CB 3.68Å; I201-F209 HydrophobicContact CD1-CD1 3.72Å; I201-F209 HydrophobicContact CD1-CD2 3.34Å; I201-F209 HydrophobicContact CD1-CE1 4.18Å; I201-F209 HydrophobicContact CD1-CE2 3.82Å; I201-F209 HydrophobicContact CD1-CG 3.28Å; I201-F209 HydrophobicContact CD1-CZ 4.21Å
202	P	49.6	Very low	50.6	Low	0 Å²	0	80.2 Å²	80.2	0%	0	42%	0.42	C	S	.	.			trans	-55.8	141.7	177.5	-21	35.2	0	0	0	109.2	W103 D164 L168 S204 K205 R206	W103-P202 HydrophobicContact CE3-CB 4.48Å; W103-P202 HydrophobicContact CH2-CG 4.4Å; W103-P202 HydrophobicContact CZ3-CB 3.66Å; W103-P202 HydrophobicContact CZ3-CG 3.77Å; D164-P202 HydrophobicContact CB-CB 4.37Å; D164-P202 HydrophobicContact CB-CG 4.19Å; L168-P202 HydrophobicContact CD1-CG 3.77Å; L168-P202 HydrophobicContact CD2-CG 3.71Å; L168-P202 HydrophobicContact CG-CG 3.75Å; P202-S204 PolarHBondContact O-N 3.32Å; P202-K205 PolarHBondContact O-N 3.38Å; P202-R206 PolarHBondContact O-N 2.84Å
203	P	51.9	Low	50.4	Low	76 Å²	76	81.3 Å²	81.3	49%	0.494	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-47.3	-38.2	173.5	-25.3	32.8	0	0	0	112	K205 R206	P203-K205 VanDerWaalsContact C-N 3.29Å; P203-K205 PolarHBondContact O-N 2.69Å; P203-R206 PolarHBondContact O-N 3.5Å
204	S	55.2	Low	49.8	Very low	90 Å²	90	82.2 Å²	82.2	63%	0.629	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-57.8	-29.8	177.4	-49.1	0	0	0	0	115	D164 P202	D164-S204 PolarHBondContact OD2-OG 3.36Å; P202-S204 PolarHBondContact O-N 3.32Å
205	K	52.4	Low	49.3	Very low	16 Å²	16	81.9 Å²	81.9	7%	0.07	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-116	1.1	-176.2	-60.7	-158.7	-178.2	-167.4	0	114.4	I155 D156 D162 E165 I201 P202 P203 G207 I208 F209	I155-K205 HydrophobicContact CB-CD 3.97Å; I155-K205 HydrophobicContact CD1-CB 3.95Å; I155-K205 HydrophobicContact CD1-CD 4.22Å; I155-K205 HydrophobicContact CG2-CB 4.22Å; I155-K205 HydrophobicContact CG2-CD 4.05Å; D156-K205 IonicContact OD2-NZ 2.71Å; D156-K205 PolarHBondContact OD2-NZ 3.26Å; D162-K205 VanDerWaalsContact OD2-CE 3.23Å; D162-K205 WeakPolarHBondContact OD2-CE 3.45Å; D162-K205 IonicContact OD2-NZ 2.78Å; D162-K205 PolarHBondContact OD2-NZ 2.96Å; E165-K205 HydrophobicContact CG-CD 4.38Å; E165-K205 IonicContact OE1-NZ 3.54Å; E165-K205 PolarHBondContact OE1-NZ 3.12Å; E165-K205 IonicContact OE2-NZ 2.81Å; I201-K205 HydrophobicContact CG2-CB 4.27Å; P202-K205 PolarHBondContact O-N 3.38Å; P203-K205 VanDerWaalsContact C-N 3.29Å; P203-K205 PolarHBondContact O-N 2.69Å; K205-G207 PolarHBondContact O-N 3.43Å; K205-I208 HydrophobicContact CB-CD1 4.41Å; K205-I208 HydrophobicContact CG-CD1 4.38Å; K205-I208 PolarHBondContact O-N 2.52Å; K205-F209 PolarHBondContact O-N 3.15Å
206	R	57.1	Low	49	Very low	68 Å²	68	85.6 Å²	85.6	26%	0.257	45%	0.45	S	S	.	.	H	α-helix	trans	-58.5	-30.1	175.4	-75.8	179.9	-172.9	-166.2	-2.2	113.7	I201 P202 P203 I208 R210	I201-R206 HydrophobicContact CB-CG 4.14Å; I201-R206 HydrophobicContact CG2-CG 3.86Å; I201-R206 PolarHBondContact O-NE 3.17Å; I201-R206 VanDerWaalsContact O-NE 3.14Å; P202-R206 PolarHBondContact O-N 2.84Å; P203-R206 PolarHBondContact O-N 3.5Å; R206-I208 VanDerWaalsContact C-N 3.31Å; R206-I208 PolarHBondContact O-N 3.5Å; R206-R210 PolarHBondContact O-N 3.2Å
207	G	48.5	Very low	48.3	Very low	50 Å²	50	88.6 Å²	88.6	52%	0.515	47%	0.472	S	S	.	.	H	α-helix	trans	-64.5	-33.2	175.8	0	0	0	0	0	113.6	K205	K205-G207 PolarHBondContact O-N 3.43Å
208	I	55.7	Low	47.5	Very low	90 Å²	90	90 Å²	90	46%	0.462	49%	0.485	S	S	.	.	H	α-helix	trans	-78.2	-36.1	-177.7	-62.8	158.4	0	0	0	110.5	I155 K205 R206	I155-I208 HydrophobicContact CG2-CG2 4.36Å; K205-I208 HydrophobicContact CB-CD1 4.41Å; K205-I208 HydrophobicContact CG-CD1 4.38Å; K205-I208 PolarHBondContact O-N 2.52Å; R206-I208 VanDerWaalsContact C-N 3.31Å; R206-I208 PolarHBondContact O-N 3.5Å
209	F	51	Low	46.8	Very low	57 Å²	57	93.9 Å²	93.9	25%	0.25	50%	0.503	C	S	.	.	H	α-helix	trans	-67.9	-38.4	179.4	-164.3	-90.1	0	0	0	113.1	Q198 I201 K205 I211 R212 S213	Q198-F209 HydrophobicContact CB-CE1 4.33Å; Q198-F209 VanDerWaalsContact CD-CE1 3.46Å; Q198-F209 HydrophobicContact CG-CD1 4.31Å; Q198-F209 HydrophobicContact CG-CE1 3.46Å; Q198-F209 VanDerWaalsContact CG-CE1 3.46Å; Q198-F209 HydrophobicContact CG-CZ 3.85Å; I201-F209 HydrophobicContact CD1-CB 3.68Å; I201-F209 HydrophobicContact CD1-CD1 3.72Å; I201-F209 HydrophobicContact CD1-CD2 3.34Å; I201-F209 HydrophobicContact CD1-CE1 4.18Å; I201-F209 HydrophobicContact CD1-CE2 3.82Å; I201-F209 HydrophobicContact CD1-CG 3.28Å; I201-F209 HydrophobicContact CD1-CZ 4.21Å; K205-F209 PolarHBondContact O-N 3.15Å; F209-I211 VanDerWaalsContact C-N 3.3Å; F209-I211 PolarHBondContact O-N 3.48Å; F209-R212 PolarHBondContact O-N 3.28Å; F209-S213 PolarHBondContact O-N 3.17Å; F209-S213 PolarHBondContact O-OG 3.47Å
210	R	47.6	Very low	46.2	Very low	196 Å²	196	91.2 Å²	91.2	74%	0.74	50%	0.496	S	S	*	.	H	α-helix	trans	-65.2	-27.2	179.8	-77.3	-172.8	-177.6	166.3	0.6	114.5	R206 R212 S214	R206-R210 PolarHBondContact O-N 3.2Å; R210-R212 VanDerWaalsContact C-N 3.28Å; R210-S214 PolarHBondContact O-OG 3.46Å
211	I	50.5	Low	45.8	Very low	121 Å²	121	98 Å²	98	62%	0.621	53%	0.527	S	S	*	.	H	α-helix	trans	-73.1	-25.6	178.4	-61.4	171.2	0	0	0	111	F209 S214	F209-I211 VanDerWaalsContact C-N 3.3Å; F209-I211 PolarHBondContact O-N 3.48Å; I211-S214 PolarHBondContact O-OG 3.42Å
212	R	46.7	Very low	45.2	Very low	140 Å²	140	101.5 Å²	101.5	53%	0.528	56%	0.564	S	S	.	*	H	α-helix	trans	-87.2	-31.1	-174.8	-151.5	174.5	-172.1	171.2	5.7	113.4	F209 R210 S214 T215	F209-R212 PolarHBondContact O-N 3.28Å; R210-R212 VanDerWaalsContact C-N 3.28Å; R212-S214 VanDerWaalsContact C-N 3.33Å; R212-T215 PolarHBondContact O-OG1 3.48Å
213	S	43.9	Very low	44.7	Very low	66 Å²	66	113.4 Å²	113.4	46%	0.462	61%	0.609	S	S	.	*	H	α-helix	trans	-76.2	-20.3	179.9	-39.6	0	0	0	0	113.6	F209	F209-S213 PolarHBondContact O-N 3.17Å; F209-S213 PolarHBondContact O-OG 3.47Å
214	S	39.5	Very low	43.9	Very low	80 Å²	80	115 Å²	115	56%	0.559	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-4.6	-174.9	40.3	0	0	0	0	114.3	R210 I211 R212	R210-S214 PolarHBondContact O-OG 3.46Å; I211-S214 PolarHBondContact O-OG 3.42Å; R212-S214 VanDerWaalsContact C-N 3.33Å
215	T	42.5	Very low	43.3	Very low	112 Å²	112	115.9 Å²	115.9	69%	0.687	63%	0.626	S	S	*	*	S	Bend	trans	-103.5	11	-177	42.9	0	0	0	0	114.9	R212	R212-T215 PolarHBondContact O-OG1 3.48Å
216	Q	41.8	Very low	42.7	Very low	188 Å²	188	120.1 Å²	120.1	88%	0.879	65%	0.653	S	S	*	*	S	Bend	trans	-111.9	6.5	179.2	-92.6	-178.9	33.5	0	0	116
217	S	33.8	Very low	41.8	Very low	85 Å²	85	125.4 Å²	125.4	59%	0.594	68%	0.678	S	S	*	*	S	Bend	trans	-135.6	132.5	172.1	41.5	0	0	0	0	109.5
218	T	32.4	Very low	41.6	Very low	138 Å²	138	129.2 Å²	129.2	85%	0.847	70%	0.697	S	S	*	*			trans	84.9	90.6	-178.9	69.9	0	0	0	0	116.7
219	E	34	Very low	40.8	Very low	203 Å²	203	129.4 Å²	129.4	95%	0.949	71%	0.706	S	S	*	*			trans	-159.8	79.5	137.4	-109.5	177.9	-171.3	0	0	109.2
220	S	36.2	Very low	40	Very low	92 Å²	92	132.5 Å²	132.5	64%	0.643	73%	0.734	S	S	*	*			trans	-84.1	144.6	156	48.5	0	0	0	0	108.8
221	H	41.9	Very low	39.8	Very low	185 Å²	185	128.7 Å²	128.7	86%	0.856	73%	0.734	S	S	*	*			trans	84.4	98.3	166.7	-51.2	-68.4	0	0	0	118.8
222	G	36.3	Very low	39.1	Very low	78 Å²	78	130.1 Å²	130.1	80%	0.804	74%	0.736	S	S	*	*				109.5	129.2	116.9	0	0	0	0	0	118
223	R	40.4	Very low	38.9	Very low	251 Å²	251	131 Å²	131	95%	0.947	75%	0.751	S	S	*	*			trans	82.7	100.6	160.8	-77.6	179.6	162.3	-168.7	-4.6	119.3
224	S	34.2	Very low	38.9	Very low	109 Å²	109	135.2 Å²	135.2	76%	0.762	76%	0.761	S	S	*	*			trans	-62.3	166.3	133.8	-48.2	0	0	0	0	110.1
225	P	43	Very low	38.9	Very low	109 Å²	109	135 Å²	135	71%	0.708	77%	0.772	S	S	*	*			cis	-151.1	172.7	26.9	39.7	-16.1	0	0	0	119.1
226	T	40.5	Very low	39	Very low	105 Å²	105	137.5 Å²	137.5	64%	0.644	78%	0.781	S	S	*	*			trans	77.2	130.2	140	26.5	0	0	0	0	125
227	F	38.6	Very low	39.1	Very low	178 Å²	178	134.8 Å²	134.8	78%	0.781	78%	0.782	S	S	*	*			trans	66.8	111.1	144.2	-70	-66.1	0	0	0	119.8
228	S	43.1	Very low	39.5	Very low	130 Å²	130	141.6 Å²	141.6	91%	0.909	80%	0.795	S	S	*	*				-166.5	144.5	121.8	-84.3	0	0	0	0	111.9
229	S	39	Very low	40.1	Very low	94 Å²	94	142.4 Å²	142.4	66%	0.657	79%	0.794	S	S	*	*			trans	-113.9	140.2	-156	-37.2	0	0	0	0	111.9
230	C	34.8	Very low	40.4	Very low	123 Å²	123	143.8 Å²	143.8	83%	0.831	79%	0.79	S	S	*	*			trans	63.4	166.5	144.2	-59	0	0	0	0	118.7
231	P	43.7	Very low	40.5	Very low	115 Å²	115	144.4 Å²	144.4	75%	0.747	80%	0.801	S	S	*	*			cis	-139	147.3	16.6	42.4	-22.5	0	0	0	116.5
232	F	34.4	Very low	40.4	Very low	151 Å²	151	139.3 Å²	139.3	66%	0.662	80%	0.799	S	S	*	*				63.8	116.6	105.8	-166.9	-94.9	0	0	0	118.2	K234	F232-K234 HydrophobicContact CE1-CD 3.93Å; F232-K234 HydrophobicContact CE1-CG 3.92Å; F232-K234 HydrophobicContact CE2-CD 3.92Å; F232-K234 VanDerWaalsContact CE2-CE 3.49Å; F232-K234 HydrophobicContact CE2-CG 3.76Å; F232-K234 HydrophobicContact CZ-CD 3.27Å; F232-K234 HydrophobicContact CZ-CG 3.43Å; F232-K234 VanDerWaalsContact CZ-CG 3.43Å
233	N	42.5	Very low	40.8	Very low	159 Å²	159	141.3 Å²	141.3	85%	0.85	80%	0.801	S	S	*	*			trans	-145.5	136.1	139.3	-152.8	4.3	0	0	0	111.7
234	K	44.4	Very low	41.4	Very low	154 Å²	154	135.6 Å²	135.6	67%	0.67	79%	0.793	S	S	*	*			trans	-92.3	139.1	-177.7	-76.9	171.9	168.9	162.9	0	110.2	F232	F232-K234 HydrophobicContact CE1-CD 3.93Å; F232-K234 HydrophobicContact CE1-CG 3.92Å; F232-K234 HydrophobicContact CE2-CD 3.92Å; F232-K234 VanDerWaalsContact CE2-CE 3.49Å; F232-K234 HydrophobicContact CE2-CG 3.76Å; F232-K234 HydrophobicContact CZ-CD 3.27Å; F232-K234 HydrophobicContact CZ-CG 3.43Å; F232-K234 VanDerWaalsContact CZ-CG 3.43Å
235	G	38.7	Very low	41.9	Very low	77 Å²	77	134.7 Å²	134.7	79%	0.794	79%	0.793	S	S	*	*			trans	-150.7	112.3	164.7	0	0	0	0	0	110.1
236	L	44.9	Very low	41.8	Very low	164 Å²	164	134.1 Å²	134.1	86%	0.859	79%	0.791	S	S	*	*			trans	-74.1	141.1	-176	-67.6	84.5	0	0	0	112
237	S	43.9	Very low	42.2	Very low	130 Å²	130	135.9 Å²	135.9	91%	0.909	80%	0.796	S	S	*	*				-174.5	131.4	115.5	-88.4	0	0	0	0	111.8
238	R	42.1	Very low	42.2	Very low	228 Å²	228	134.3 Å²	134.3	86%	0.86	79%	0.791	S	S	*	*			trans	-113.5	134.6	-174.1	-171.9	-174.6	-72.8	160.8	-6.5	105.3
239	N	45.5	Very low	41.9	Very low	155 Å²	155	133.4 Å²	133.4	83%	0.829	78%	0.78	S	S	*	*			trans	166.9	153.1	147.1	-80.8	-19.2	0	0	0	109
240	R	40.6	Very low	42	Very low	232 Å²	232	133.9 Å²	133.9	88%	0.875	78%	0.783	S	S	*	*			cis	-179.6	132	-33.5	-167.1	171.3	-175.3	179.8	0.3	104
241	A	37.7	Very low	42.2	Very low	105 Å²	105	133.9 Å²	133.9	87%	0.868	78%	0.784	S	S	*	*			trans	-8.9	154.6	165.4	0	0	0	0	0	123.3
242	G	40.3	Very low	42.1	Very low	79 Å²	79	136.9 Å²	136.9	81%	0.814	79%	0.791	S	S	*	*			trans	126.4	139.4	153.1	0	0	0	0	0	112.3
243	S	44	Very low	42.3	Very low	120 Å²	120	138.3 Å²	138.3	84%	0.839	80%	0.799	S	S	*	*			cis	-169.3	172.2	2.2	-163	0	0	0	0	108
244	V	52.7	Low	42	Very low	131 Å²	131	142.1 Å²	142.1	79%	0.794	80%	0.802	S	S	*	*			trans	-89.9	171	-166.2	-68.3	0	0	0	0	116.1
245	A	45.8	Very low	41.7	Very low	90 Å²	90	138.5 Å²	138.5	74%	0.744	80%	0.801	S	S	*	*			trans	78.7	146.4	153.1	0	0	0	0	0	116.3
246	S	41.6	Very low	41.8	Very low	96 Å²	96	140.6 Å²	140.6	67%	0.671	80%	0.803	S	S	*	*			cis	-164.4	148.1	30.3	-76.3	0	0	0	0	109.2
247	L	47.3	Very low	41.7	Very low	142 Å²	142	138.2 Å²	138.2	74%	0.743	80%	0.8	S	S	*	*				56	143.2	107.5	-51.1	168	0	0	0	115.1
248	E	39.1	Very low	41.8	Very low	146 Å²	146	137.9 Å²	137.9	68%	0.682	80%	0.795	S	S	*	*			cis	-176.6	153.9	4.3	-113.3	176.3	119.8	0	0	107.9
249	T	36.3	Very low	41.5	Very low	110 Å²	110	131.2 Å²	131.2	68%	0.675	79%	0.789	S	S	*	*			trans	63.1	123.7	137.7	65.4	0	0	0	0	124.8
250	S	40.9	Very low	41.4	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	79%	0.787	S	S	*	*				74.6	122	126.9	61.5	0	0	0	0	121.5
251	S	39.2	Very low	41.5	Very low	123 Å²	123	129 Å²	129	86%	0.86	78%	0.78	S	S	*	*				-175.2	147.9	102.1	-80.6	0	0	0	0	114.1
252	M	41.8	Very low	41.7	Very low	178 Å²	178	130.1 Å²	130.1	88%	0.877	78%	0.778	S	S	*	*			trans	-70.4	162.4	-178.7	-127.6	85	72.1	0	0	113.9
253	E	39.7	Very low	41.6	Very low	181 Å²	181	133.4 Å²	133.4	85%	0.846	78%	0.776	S	S	*	*			trans	161	109.1	130.5	-77.8	-146	113.6	0	0	108.5
254	R	35.6	Very low	41.2	Very low	240 Å²	240	132.8 Å²	132.8	91%	0.906	77%	0.772	S	S	*	*				58.9	129.6	79.2	-156.5	172.3	-131.6	-113.6	1.3	112.4
255	A	38.5	Very low	40.8	Very low	78 Å²	78	138.5 Å²	138.5	65%	0.645	78%	0.779	S	S	*	*			cis	-169.1	170.3	-1.3	0	0	0	0	0	109.7
256	S	41.2	Very low	40.2	Very low	120 Å²	120	139.6 Å²	139.6	84%	0.839	78%	0.781	S	S	*	*			trans	115.9	118.9	141.2	-47.6	0	0	0	0	118.7
257	S	41.6	Very low	40.6	Very low	115 Å²	115	143 Å²	143	80%	0.804	79%	0.791	S	S	*	*			trans	-82.9	-159.7	177.7	-39.5	0	0	0	0	113.3
258	P	46.7	Very low	40	Very low	122 Å²	122	141.8 Å²	141.8	79%	0.792	79%	0.794	S	S	*	*			cis	-131.9	178.9	-45.5	25.4	-3.8	0	0	0	114.5
259	A	35.5	Very low	39.8	Very low	88 Å²	88	138.3 Å²	138.3	73%	0.727	80%	0.797	S	S	*	*			trans	82.1	125.7	148.7	0	0	0	0	0	121.5
260	K	43.3	Very low	40	Very low	183 Å²	183	139.8 Å²	139.8	80%	0.796	81%	0.807	S	S	*	*				168.5	114.5	124.2	-88.1	167.8	-177.6	-179.5	0	112.4
261	H	41.8	Very low	39.9	Very low	157 Å²	157	140.5 Å²	140.5	73%	0.727	81%	0.809	S	S	*	*			trans	48.4	156	135.5	-47.6	-51.3	0	0	0	121
262	P	43.3	Very low	40	Very low	129 Å²	129	138.7 Å²	138.7	84%	0.838	80%	0.801	S	S	*	*			cis	-146.1	173.6	37.4	38.6	-15	0	0	0	120.1
263	I	37.3	Very low	40	Very low	149 Å²	149	135.9 Å²	135.9	76%	0.764	80%	0.796	S	S	*	*			trans	-80.7	147.4	-176.4	-64.8	157.6	0	0	0	111.6
264	S	35.6	Very low	40	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	79%	0.793	S	S	*	*			trans	129	113	144.1	-83	0	0	0	0	113.7
265	R	43.7	Very low	40.3	Very low	251 Å²	251	129 Å²	129	95%	0.947	79%	0.786	S	S	*	*			trans	-160.9	116	134.7	-101.7	157.4	-165.8	-160.4	3.9	109.8
266	S	34.8	Very low	40.1	Very low	113 Å²	113	129.3 Å²	129.3	79%	0.79	78%	0.783	S	S	*	*			trans	-81.8	127	174.1	-176.8	0	0	0	0	109.7
267	L	48.9	Very low	39.9	Very low	166 Å²	166	131.2 Å²	131.2	87%	0.869	78%	0.779	S	S	*	*			trans	-156.1	88.9	162	-68.6	176.9	0	0	0	105.2
268	S	36	Very low	39.8	Very low	118 Å²	118	135.8 Å²	135.8	83%	0.825	78%	0.78	S	S	*	*				38.1	96.7	82.5	-175.2	0	0	0	0	113.4
269	G	34.1	Very low	39.4	Very low	72 Å²	72	136.7 Å²	136.7	74%	0.742	77%	0.773	S	S	*	*			trans	110.5	64	156.3	0	0	0	0	0	116.5
270	T	41.5	Very low	39.6	Very low	142 Å²	142	140.2 Å²	140.2	87%	0.871	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-85.1	122.9	157	18.3	0	0	0	0	109
271	P	38.1	Very low	39.5	Very low	119 Å²	119	138.4 Å²	138.4	77%	0.773	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-69.1	140.6	171.8	29.6	-29.8	0	0	0	108.8
272	A	40	Very low	39.5	Very low	84 Å²	84	134 Å²	134	69%	0.694	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-52.9	140.9	176.5	0	0	0	0	0	110.6	V274	A272-V274 PolarHBondContact O-N 3.16Å; A272-V274 VanDerWaalsContact O-N 3.17Å
273	P	43.7	Very low	39.9	Very low	119 Å²	119	136.6 Å²	136.6	77%	0.773	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-60.4	124	172.2	26.4	-31.6	0	0	0	108.2	I275	P273-I275 PolarHBondContact O-N 2.94Å; P273-I275 VanDerWaalsContact O-N 3.07Å
274	V	39.8	Very low	40.7	Very low	130 Å²	130	136.6 Å²	136.6	79%	0.788	76%	0.76	S	S	*	*			trans	-63	110.3	168.8	176.3	0	0	0	0	105.9	A272 S276	A272-V274 PolarHBondContact O-N 3.16Å; A272-V274 VanDerWaalsContact O-N 3.17Å; V274-S276 VanDerWaalsContact C-N 3.26Å; V274-S276 PolarHBondContact O-N 3.04Å
275	I	41.8	Very low	41.5	Very low	147 Å²	147	137.6 Å²	137.6	75%	0.754	76%	0.763	S	S	*	*			trans	-61.6	96.3	166.5	-64.7	170	0	0	0	105.5	P273 Q277	P273-I275 PolarHBondContact O-N 2.94Å; P273-I275 VanDerWaalsContact O-N 3.07Å; I275-Q277 VanDerWaalsContact C-N 3.32Å; I275-Q277 PolarHBondContact O-N 3.04Å
276	S	34.2	Very low	42.3	Very low	84 Å²	84	129.7 Å²	129.7	59%	0.587	74%	0.743	S	S	*	*			trans	-60	106.2	157.4	-78.4	0	0	0	0	105	V274 Y278	V274-S276 VanDerWaalsContact C-N 3.26Å; V274-S276 PolarHBondContact O-N 3.04Å; S276-Y278 VanDerWaalsContact C-N 3.26Å; S276-Y278 WeakPolarHBondContact O-CD2 3.28Å; S276-Y278 PolarHBondContact O-N 2.81Å
277	Q	35.4	Very low	43.7	Very low	161 Å²	161	129.1 Å²	129.1	75%	0.752	73%	0.731	S	S	*	*			trans	-54.2	101.2	166.1	-74	177.9	-42.4	0	0	106	I275 H279	I275-Q277 VanDerWaalsContact C-N 3.32Å; I275-Q277 PolarHBondContact O-N 3.04Å; Q277-H279 PolarHBondContact O-N 2.58Å
278	Y	39.8	Very low	44.8	Very low	211 Å²	211	124.8 Å²	124.8	83%	0.827	71%	0.712	S	S	*	*			trans	-61.8	89.4	161.7	-69.8	-82.4	0	0	0	105.1	S276 F280	S276-Y278 VanDerWaalsContact C-N 3.26Å; S276-Y278 WeakPolarHBondContact O-CD2 3.28Å; S276-Y278 PolarHBondContact O-N 2.81Å; Y278-F280 PolarHBondContact O-N 3.17Å
279	H	38.2	Very low	46.6	Very low	140 Å²	140	122.6 Å²	122.6	65%	0.648	70%	0.696	S	S	*	*			trans	-63.7	97.4	162.9	-114.8	-110.7	0	0	0	104.6	Q277 N281	Q277-H279 PolarHBondContact O-N 2.58Å; H279-N281 PolarHBondContact O-N 3.45Å
280	F	40	Very low	48.4	Very low	163 Å²	163	125.7 Å²	125.7	72%	0.715	69%	0.691	S	S	*	*			trans	-57.8	93.9	163.1	-110.6	-84	0	0	0	106.1	Y278 T282	Y278-F280 PolarHBondContact O-N 3.17Å; F280-T282 HydrophobicContact CD1-CG2 3.94Å; F280-T282 VanDerWaalsContact CD1-OG1 3.28Å; F280-T282 WeakPolarHBondContact CD1-OG1 3.22Å; F280-T282 HydrophobicContact CE1-CG2 4.35Å; F280-T282 PolarHBondContact O-N 3.08Å
281	N	41.5	Very low	50.1	Low	145 Å²	145	125.9 Å²	125.9	78%	0.775	68%	0.676	S	S	*	*			trans	-79.5	67.4	165.6	-71.2	-41.1	0	0	0	106.8	H279	H279-N281 PolarHBondContact O-N 3.45Å
282	T	41.7	Very low	52.2	Low	65 Å²	65	124.9 Å²	124.9	40%	0.399	66%	0.661	S	S	.	*			trans	-117.2	98.9	166.6	39.8	0	0	0	0	106.9	F280 E284	F280-T282 HydrophobicContact CD1-CG2 3.94Å; F280-T282 VanDerWaalsContact CD1-OG1 3.28Å; F280-T282 WeakPolarHBondContact CD1-OG1 3.22Å; F280-T282 HydrophobicContact CE1-CG2 4.35Å; F280-T282 PolarHBondContact O-N 3.08Å; T282-E284 PolarHBondContact O-N 3.25Å
283	D	52.5	Low	54.2	Low	183 Å²	183	124.1 Å²	124.1	98%	0.979	66%	0.655	S	S	*	*			trans	-67.7	20.5	157	-78.9	-49.8	0	0	0	111.5
284	E	53	Low	56.1	Low	149 Å²	149	120.2 Å²	120.2	70%	0.696	63%	0.628	S	S	*	*	S	Bend	trans	-108.3	126.3	167.5	-108.2	-165.3	146	0	0	108.7	T282 V286	T282-E284 PolarHBondContact O-N 3.25Å; E284-V286 PolarHBondContact O-N 2.92Å
285	P	52.6	Low	58.3	Low	127 Å²	127	118.5 Å²	118.5	83%	0.825	61%	0.609	S	S	*	*			trans	-68.1	99.4	170.2	28.9	-31	0	0	0	108	D287	P285-D287 PolarHBondContact O-N 2.82Å; P285-D287 VanDerWaalsContact O-N 3.16Å
286	V	60.4	Low	60.4	Low	85 Å²	85	120.3 Å²	120.3	52%	0.515	61%	0.607	S	S	.	*			trans	-57.1	121.2	164	178.8	0	0	0	0	106.2	E284 T288	E284-V286 PolarHBondContact O-N 2.92Å; V286-T288 VanDerWaalsContact C-N 3.28Å; V286-T288 PolarHBondContact O-N 2.76Å
287	D	65.1	Low	62.8	Low	102 Å²	102	124 Å²	124	55%	0.545	61%	0.608	S	S	.	*			trans	-65.4	93	175.1	-170.1	-0.4	0	0	0	108.5	P285 S289	P285-D287 PolarHBondContact O-N 2.82Å; P285-D287 VanDerWaalsContact O-N 3.16Å; D287-S289 PolarHBondContact O-N 3.26Å; D287-S289 VanDerWaalsContact OD1-CB 3.22Å; D287-S289 WeakPolarHBondContact OD1-CB 3.48Å; D287-S289 PolarHBondContact OD1-N 3.48Å; D287-S289 VanDerWaalsContact OD1-N 3.17Å; D287-S289 PolarHBondContact OD1-OG 2.6Å
288	T	72	Confident	65.2	Low	75 Å²	75	117.7 Å²	117.7	46%	0.46	58%	0.579	S	S	.	*			trans	-77.4	-8.9	179	55.1	0	0	0	0	111.9	V286 E290 W291 E292	V286-T288 VanDerWaalsContact C-N 3.28Å; V286-T288 PolarHBondContact O-N 2.76Å; T288-E290 VanDerWaalsContact C-N 3.27Å; T288-E290 PolarHBondContact O-N 3.33Å; T288-W291 PolarHBondContact O-N 3.37Å; T288-E292 WeakPolarHBondContact O-CG 3.49Å; T288-E292 PolarHBondContact O-N 2.91Å; T288-E292 PolarHBondContact OG1-OE1 2.79Å; T288-E292 VanDerWaalsContact OG1-OE1 3.08Å
289	S	72.5	Confident	67.4	Low	71 Å²	71	108.7 Å²	108.7	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-63.9	-32.3	-170.1	70.5	0	0	0	0	112.9	D287 W291	D287-S289 PolarHBondContact O-N 3.26Å; D287-S289 VanDerWaalsContact OD1-CB 3.22Å; D287-S289 WeakPolarHBondContact OD1-CB 3.48Å; D287-S289 PolarHBondContact OD1-N 3.48Å; D287-S289 VanDerWaalsContact OD1-N 3.17Å; D287-S289 PolarHBondContact OD1-OG 2.6Å; S289-W291 VanDerWaalsContact C-N 3.34Å
290	E	72.7	Confident	69.4	Low	137 Å²	137	106.8 Å²	106.8	64%	0.64	55%	0.548	S	S	*	.	H	α-helix	trans	-69.9	-32.3	176.8	-61	-164.7	147.1	0	0	112.3	T288	T288-E290 VanDerWaalsContact C-N 3.27Å; T288-E290 PolarHBondContact O-N 3.33Å
291	W	77.5	Confident	71.6	Confident	147 Å²	147	104.1 Å²	104.1	56%	0.557	54%	0.541	S	S	*	.	H	α-helix	trans	-98.4	-18.1	-171.6	-50.1	105	0	0	0	113.5	T288 S289 A293 D294 F295	T288-W291 PolarHBondContact O-N 3.37Å; S289-W291 VanDerWaalsContact C-N 3.34Å; W291-A293 VanDerWaalsContact C-N 3.26Å; W291-A293 PolarHBondContact O-N 3.04Å; W291-D294 PolarHBondContact O-N 3.12Å; W291-F295 WeakPolarHBondContact O-CB 3.5Å; W291-F295 PolarHBondContact O-N 3.1Å
292	E	81.7	Confident	73.6	Confident	98 Å²	98	100 Å²	100	46%	0.458	53%	0.533	S	S	.	.	H	α-helix	trans	-59.7	-36.3	176.1	-84.4	177.4	-152	0	0	112.6	T288 R296	T288-E292 WeakPolarHBondContact O-CG 3.49Å; T288-E292 PolarHBondContact O-N 2.91Å; T288-E292 PolarHBondContact OG1-OE1 2.79Å; T288-E292 VanDerWaalsContact OG1-OE1 3.08Å; E292-R296 WeakPolarHBondContact O-CB 3.4Å; E292-R296 PolarHBondContact O-N 2.96Å
293	A	82.6	Confident	75.7	Confident	68 Å²	68	101.3 Å²	101.3	56%	0.562	54%	0.538	S	S	*	.	H	α-helix	trans	-67.3	-39.3	177	0	0	0	0	0	111.8	W291 R297	W291-A293 VanDerWaalsContact C-N 3.26Å; W291-A293 PolarHBondContact O-N 3.04Å; A293-R297 PolarHBondContact O-N 3.36Å
294	D	84.3	Confident	77.2	Confident	37 Å²	37	94.7 Å²	94.7	20%	0.198	51%	0.513	C	S	.	.	H	α-helix	trans	-71.7	-41.8	176.6	-79.8	-34.4	0	0	0	111.8	W291 R296 R297 L298 F314	W291-D294 PolarHBondContact O-N 3.12Å; D294-R296 PolarHBondContact O-N 3.18Å; D294-R297 WeakPolarHBondContact O-CB 3.43Å; D294-R297 PolarHBondContact O-N 2.84Å; D294-R297 VanDerWaalsContact O-N 3.1Å; D294-R297 IonicContact OD1-CZ 3.52Å; D294-R297 IonicContact OD1-NE 3.61Å; D294-R297 IonicContact OD1-NH2 2.71Å; D294-R297 PolarHBondContact OD1-NH2 3.31Å; D294-L298 WeakPolarHBondContact O-CG 3.4Å; D294-L298 PolarHBondContact O-N 3.02Å; D294-F314 HydrophobicContact CB-CE2 4.12Å; D294-F314 HydrophobicContact CB-CZ 4.16Å
295	F	86.2	Confident	78.7	Confident	93 Å²	93	93 Å²	93	41%	0.408	51%	0.508	S	S	.	.	H	α-helix	trans	-57.2	-49.9	174.9	-174.1	-86.5	0	0	0	111.1	W291 R297 L298 D299 G304 V306	W291-F295 WeakPolarHBondContact O-CB 3.5Å; W291-F295 PolarHBondContact O-N 3.1Å; F295-R297 PolarHBondContact O-N 3.04Å; F295-L298 PolarHBondContact O-N 3.49Å; F295-D299 HydrophobicContact CD1-CB 4.29Å; F295-D299 HydrophobicContact CE1-CB 3.98Å; F295-D299 WeakPolarHBondContact O-CB 3.38Å; F295-D299 PolarHBondContact O-N 3.34Å; F295-G304 WeakPolarHBondContact CZ-O 3.35Å; F295-V306 HydrophobicContact CD2-CG2 3.86Å; F295-V306 HydrophobicContact CE1-CG2 4.29Å; F295-V306 HydrophobicContact CE2-CB 4.5Å; F295-V306 HydrophobicContact CE2-CG2 3.49Å; F295-V306 VanDerWaalsContact CE2-CG2 3.49Å; F295-V306 HydrophobicContact CG-CG2 4.41Å; F295-V306 HydrophobicContact CZ-CG2 3.72Å
296	R	84.2	Confident	80.2	Confident	185 Å²	185	88 Å²	88	70%	0.698	48%	0.475	S	S	*	.	H	α-helix	trans	-63.9	-22.4	178.9	-165.7	177.7	-61.1	153	8	113.3	E292 D294	E292-R296 WeakPolarHBondContact O-CB 3.4Å; E292-R296 PolarHBondContact O-N 2.96Å; D294-R296 PolarHBondContact O-N 3.18Å
297	R	85.2	Confident	81.4	Confident	163 Å²	163	87.3 Å²	87.3	62%	0.615	47%	0.471	S	S	*	.	H	α-helix	trans	-81.1	-30.5	174.6	-179.3	171	61.5	147.4	-3.4	112.1	A293 D294 F295	A293-R297 PolarHBondContact O-N 3.36Å; D294-R297 WeakPolarHBondContact O-CB 3.43Å; D294-R297 PolarHBondContact O-N 2.84Å; D294-R297 VanDerWaalsContact O-N 3.1Å; D294-R297 IonicContact OD1-CZ 3.52Å; D294-R297 IonicContact OD1-NE 3.61Å; D294-R297 IonicContact OD1-NH2 2.71Å; D294-R297 PolarHBondContact OD1-NH2 3.31Å; F295-R297 PolarHBondContact O-N 3.04Å
298	L	85.5	Confident	82.3	Confident	28 Å²	28	83.9 Å²	83.9	15%	0.147	46%	0.46	C	S	.	.	H	α-helix	trans	-85.6	-35.9	179.8	-64.3	168.2	0	0	0	112.1	D294 F295 S300 V306 D310 V311 F314	D294-L298 WeakPolarHBondContact O-CG 3.4Å; D294-L298 PolarHBondContact O-N 3.02Å; F295-L298 PolarHBondContact O-N 3.49Å; L298-S300 VanDerWaalsContact C-N 3.3Å; L298-S300 PolarHBondContact O-N 3.41Å; L298-S300 PolarHBondContact O-OG 2.71Å; L298-V306 HydrophobicContact CB-CG1 3.62Å; L298-V306 HydrophobicContact CB-CG2 4.05Å; L298-D310 WeakPolarHBondContact CD2-O 3.39Å; L298-D310 WeakPolarHBondContact O-CB 3.03Å; L298-V311 HydrophobicContact CD1-CG1 4.44Å; L298-F314 HydrophobicContact CD1-CB 4.03Å; L298-F314 HydrophobicContact CD1-CD1 4.07Å; L298-F314 HydrophobicContact CD1-CD2 4.23Å; L298-F314 HydrophobicContact CD1-CG 3.86Å; L298-F314 HydrophobicContact CD2-CB 3.89Å; L298-F314 HydrophobicContact CD2-CG 4.42Å
299	D	86.8	Confident	82.8	Confident	21 Å²	21	86.2 Å²	86.2	11%	0.112	47%	0.469	C	S	.	.			trans	-71.1	82.1	172.9	-177.6	1.5	0	0	0	109.8	F295 D301 G302 D303 G304 L305 V306	F295-D299 HydrophobicContact CD1-CB 4.29Å; F295-D299 HydrophobicContact CE1-CB 3.98Å; F295-D299 WeakPolarHBondContact O-CB 3.38Å; F295-D299 PolarHBondContact O-N 3.34Å; D299-D301 VanDerWaalsContact C-N 3.34Å; D299-G302 WeakPolarHBondContact OD1-CA 3.4Å; D299-G302 PolarHBondContact OD1-N 3Å; D299-G302 WeakPolarHBondContact OD2-CA 3.48Å; D299-D303 PolarHBondContact OD1-N 3.42Å; D299-D303 VanDerWaalsContact OD1-N 3.15Å; D299-G304 WeakPolarHBondContact OD2-CA 3.39Å; D299-G304 PolarHBondContact OD2-N 3.13Å; D299-L305 VanDerWaalsContact CG-O 3.29Å; D299-V306 HydrophobicContact CB-CG2 3.93Å
300	S	79.8	Confident	83.4	Confident	100 Å²	100	84.9 Å²	84.9	70%	0.699	46%	0.457	S	S	*	.	S	Bend	trans	-75.4	-23.8	-173.2	-64.7	0	0	0	0	113.1	L298	L298-S300 VanDerWaalsContact C-N 3.3Å; L298-S300 PolarHBondContact O-N 3.41Å; L298-S300 PolarHBondContact O-OG 2.71Å
301	D	85.1	Confident	84	Confident	107 Å²	107	79.1 Å²	79.1	57%	0.572	43%	0.431	S	S	*	.	S	Bend	trans	-100.2	-8.1	178.9	54.3	-15.3	0	0	0	113.6	D299 D303	D299-D301 VanDerWaalsContact C-N 3.34Å; D301-D303 VanDerWaalsContact C-N 3.25Å; D301-D303 PolarHBondContact O-N 3.09Å
302	G	83.3	Confident	84.3	Confident	60 Å²	60	76.9 Å²	76.9	62%	0.619	43%	0.425	S	S	*	.			trans	68.9	25.3	173.9	0	0	0	0	0	112.7	D299 G304	D299-G302 WeakPolarHBondContact OD1-CA 3.4Å; D299-G302 PolarHBondContact OD1-N 3Å; D299-G302 WeakPolarHBondContact OD2-CA 3.48Å; G302-G304 VanDerWaalsContact C-N 3.26Å
303	D	85.8	Confident	84.3	Confident	91 Å²	91	76 Å²	76	49%	0.487	43%	0.429	S	S	.	.	S	Bend	trans	-85.5	-2.6	-177.6	80.5	-15.2	0	0	0	112.3	D299 D301 L305	D299-D303 PolarHBondContact OD1-N 3.42Å; D299-D303 VanDerWaalsContact OD1-N 3.15Å; D301-D303 VanDerWaalsContact C-N 3.25Å; D301-D303 PolarHBondContact O-N 3.09Å; D303-L305 VanDerWaalsContact C-N 3.28Å; D303-L305 VanDerWaalsContact OD1-CA 3.3Å; D303-L305 WeakPolarHBondContact OD1-CA 3.37Å; D303-L305 VanDerWaalsContact OD1-CB 3.26Å; D303-L305 WeakPolarHBondContact OD1-CB 3.5Å; D303-L305 PolarHBondContact OD1-N 3.25Å; D303-L305 VanDerWaalsContact OD1-O 3.12Å
304	G	84.7	Confident	84.5	Confident	45 Å²	45	75 Å²	75	46%	0.464	41%	0.412	S	S	.	.	S	Bend	trans	79.8	11.5	-176.5	0	0	0	0	0	113	F295 D299 G302	F295-G304 WeakPolarHBondContact CZ-O 3.35Å; D299-G304 WeakPolarHBondContact OD2-CA 3.39Å; D299-G304 PolarHBondContact OD2-N 3.13Å; G302-G304 VanDerWaalsContact C-N 3.26Å
305	L	84.3	Confident	84.6	Confident	114 Å²	114	75.9 Å²	75.9	60%	0.597	42%	0.415	S	S	*	.			trans	-124.3	159.5	173.9	-55.9	171.9	0	0	0	108.7	D299 D303	D299-L305 VanDerWaalsContact CG-O 3.29Å; D303-L305 VanDerWaalsContact C-N 3.28Å; D303-L305 VanDerWaalsContact OD1-CA 3.3Å; D303-L305 WeakPolarHBondContact OD1-CA 3.37Å; D303-L305 VanDerWaalsContact OD1-CB 3.26Å; D303-L305 WeakPolarHBondContact OD1-CB 3.5Å; D303-L305 PolarHBondContact OD1-N 3.25Å; D303-L305 VanDerWaalsContact OD1-O 3.12Å
306	V	85.4	Confident	84.6	Confident	22 Å²	22	75.5 Å²	75.5	13%	0.133	42%	0.416	C	S	.	.			trans	-128.6	129.2	174.7	-178.3	0	0	0	0	105.9	F295 L298 D299 D310 V311 W329	F295-V306 HydrophobicContact CD2-CG2 3.86Å; F295-V306 HydrophobicContact CE1-CG2 4.29Å; F295-V306 HydrophobicContact CE2-CB 4.5Å; F295-V306 HydrophobicContact CE2-CG2 3.49Å; F295-V306 VanDerWaalsContact CE2-CG2 3.49Å; F295-V306 HydrophobicContact CG-CG2 4.41Å; F295-V306 HydrophobicContact CZ-CG2 3.72Å; L298-V306 HydrophobicContact CB-CG1 3.62Å; L298-V306 HydrophobicContact CB-CG2 4.05Å; D299-V306 HydrophobicContact CB-CG2 3.93Å; V306-D310 HydrophobicContact CG1-CB 3.42Å; V306-D310 VanDerWaalsContact CG1-CB 3.42Å; V306-V311 HydrophobicContact CB-CG1 4.06Å; V306-V311 HydrophobicContact CG1-CB 4.42Å; V306-V311 HydrophobicContact CG1-CG1 3.36Å; V306-W329 WeakPolarHBondContact O-CH2 3.48Å
307	T	84.8	Confident	84.6	Confident	70 Å²	70	74 Å²	74	43%	0.429	42%	0.417	S	S	.	.			trans	-78.3	160.8	-179.6	75.7	0	0	0	0	110.9	N309 D310 V311	T307-N309 PolarHBondContact O-N 2.96Å; T307-N309 PolarHBondContact OG1-N 3.1Å; T307-D310 WeakPolarHBondContact CA-OD2 3.43Å; T307-D310 VanDerWaalsContact CB-OD2 3.26Å; T307-D310 WeakPolarHBondContact CB-OD2 3.33Å; T307-D310 WeakPolarHBondContact CG2-OD2 3.38Å; T307-D310 PolarHBondContact N-OD2 3.47Å; T307-D310 WeakPolarHBondContact O-CB 3.35Å; T307-D310 PolarHBondContact O-N 2.8Å; T307-D310 PolarHBondContact OG1-N 2.86Å; T307-D310 PolarHBondContact OG1-OD2 3.28Å; T307-V311 PolarHBondContact O-N 3.04Å; T307-V311 VanDerWaalsContact O-N 3.11Å
308	G	83.4	Confident	84.6	Confident	29 Å²	29	69.9 Å²	69.9	30%	0.299	41%	0.41	S	S	.	.	H	α-helix	trans	-57.3	-26	175.9	0	0	0	0	0	112.7	K312 W329	G308-K312 WeakPolarHBondContact O-CB 3.4Å; G308-K312 PolarHBondContact O-N 3.46Å; G308-W329 VanDerWaalsContact CA-CH2 3.46Å; G308-W329 VanDerWaalsContact N-CH2 3.25Å
309	N	83.1	Confident	84.6	Confident	124 Å²	124	71.7 Å²	71.7	66%	0.663	44%	0.436	S	S	*	.	H	α-helix	trans	-76.4	-31.9	177.2	-159.4	54.3	0	0	0	112.4	T307	T307-N309 PolarHBondContact O-N 2.96Å; T307-N309 PolarHBondContact OG1-N 3.1Å
310	D	84.2	Confident	84.6	Confident	44 Å²	44	74.4 Å²	74.4	24%	0.235	45%	0.45	C	S	.	.	H	α-helix	trans	-73.6	-49.5	178.5	-54.5	-42	0	0	0	110.4	L298 V306 T307 K312	L298-D310 WeakPolarHBondContact CD2-O 3.39Å; L298-D310 WeakPolarHBondContact O-CB 3.03Å; V306-D310 HydrophobicContact CG1-CB 3.42Å; V306-D310 VanDerWaalsContact CG1-CB 3.42Å; T307-D310 WeakPolarHBondContact CA-OD2 3.43Å; T307-D310 VanDerWaalsContact CB-OD2 3.26Å; T307-D310 WeakPolarHBondContact CB-OD2 3.33Å; T307-D310 WeakPolarHBondContact CG2-OD2 3.38Å; T307-D310 PolarHBondContact N-OD2 3.47Å; T307-D310 WeakPolarHBondContact O-CB 3.35Å; T307-D310 PolarHBondContact O-N 2.8Å; T307-D310 PolarHBondContact OG1-N 2.86Å; T307-D310 PolarHBondContact OG1-OD2 3.28Å; D310-K312 VanDerWaalsContact C-N 3.33Å; D310-K312 PolarHBondContact O-N 2.98Å
311	V	86.6	Confident	84.8	Confident	15 Å²	15	73 Å²	73	9%	0.091	44%	0.438	C	S	.	.	H	α-helix	trans	-70.6	-24.4	178.7	-64.7	0	0	0	0	113.7	L298 V306 T307 S313 F314 F315 W329	L298-V311 HydrophobicContact CD1-CG1 4.44Å; V306-V311 HydrophobicContact CB-CG1 4.06Å; V306-V311 HydrophobicContact CG1-CB 4.42Å; V306-V311 HydrophobicContact CG1-CG1 3.36Å; T307-V311 PolarHBondContact O-N 3.04Å; T307-V311 VanDerWaalsContact O-N 3.11Å; V311-S313 VanDerWaalsContact C-N 3.31Å; V311-S313 PolarHBondContact O-N 3.25Å; V311-F314 CarbonylContact O-C 3.58Å; V311-F314 WeakPolarHBondContact O-CA 3.36Å; V311-F314 WeakPolarHBondContact O-CB 3.43Å; V311-F314 PolarHBondContact O-N 2.85Å; V311-F315 HydrophobicContact CB-CD2 3.8Å; V311-F315 HydrophobicContact CB-CE2 3.78Å; V311-F315 HydrophobicContact CG1-CE2 4.28Å; V311-F315 HydrophobicContact CG2-CD2 3.81Å; V311-F315 HydrophobicContact CG2-CE2 3.8Å; V311-F315 PolarHBondContact O-N 3.46Å; V311-W329 HydrophobicContact CB-CZ3 4.22Å; V311-W329 HydrophobicContact CG1-CZ3 3.99Å; V311-W329 HydrophobicContact CG2-CD2 4.35Å; V311-W329 HydrophobicContact CG2-CE3 3.45Å; V311-W329 VanDerWaalsContact CG2-CE3 3.45Å; V311-W329 HydrophobicContact CG2-CH2 3.96Å; V311-W329 HydrophobicContact CG2-CZ3 3.21Å
312	K	83.5	Confident	84.7	Confident	101 Å²	101	74 Å²	74	44%	0.439	44%	0.44	S	S	.	.	H	α-helix	trans	-58	-43.8	-171.3	174.1	177.8	179.8	-174.8	0	112.3	G308 D310 F314 L316	G308-K312 WeakPolarHBondContact O-CB 3.4Å; G308-K312 PolarHBondContact O-N 3.46Å; D310-K312 VanDerWaalsContact C-N 3.33Å; D310-K312 PolarHBondContact O-N 2.98Å; K312-F314 VanDerWaalsContact C-N 3.28Å; K312-F314 PolarHBondContact O-N 3.01Å; K312-L316 HydrophobicContact CG-CD1 3.87Å; K312-L316 HydrophobicContact CG-CG 4.42Å; K312-L316 WeakPolarHBondContact O-CB 3.5Å; K312-L316 WeakPolarHBondContact O-CG 3.46Å; K312-L316 PolarHBondContact O-N 3Å
313	S	82.4	Confident	84.8	Confident	78 Å²	78	76.3 Å²	76.3	55%	0.545	44%	0.438	S	S	.	.	H	α-helix	trans	-69.2	-29.6	179.4	-59.5	0	0	0	0	112.3	V311 Q317	V311-S313 VanDerWaalsContact C-N 3.31Å; V311-S313 PolarHBondContact O-N 3.25Å; S313-Q317 WeakPolarHBondContact O-CG 3.32Å; S313-Q317 PolarHBondContact O-NE2 3.26Å
314	F	85.4	Confident	84.6	Confident	47 Å²	47	74.5 Å²	74.5	21%	0.206	43%	0.43	C	S	.	.	H	α-helix	trans	-73	-49	175.1	-178.1	-100.1	0	0	0	111	D294 L298 V311 K312 L316 Q317	D294-F314 HydrophobicContact CB-CE2 4.12Å; D294-F314 HydrophobicContact CB-CZ 4.16Å; L298-F314 HydrophobicContact CD1-CB 4.03Å; L298-F314 HydrophobicContact CD1-CD1 4.07Å; L298-F314 HydrophobicContact CD1-CD2 4.23Å; L298-F314 HydrophobicContact CD1-CG 3.86Å; L298-F314 HydrophobicContact CD2-CB 3.89Å; L298-F314 HydrophobicContact CD2-CG 4.42Å; V311-F314 CarbonylContact O-C 3.58Å; V311-F314 WeakPolarHBondContact O-CA 3.36Å; V311-F314 WeakPolarHBondContact O-CB 3.43Å; V311-F314 PolarHBondContact O-N 2.85Å; K312-F314 VanDerWaalsContact C-N 3.28Å; K312-F314 PolarHBondContact O-N 3.01Å; F314-L316 PolarHBondContact O-N 3.02Å; F314-Q317 WeakPolarHBondContact O-CB 3.2Å; F314-Q317 PolarHBondContact O-N 2.99Å; F314-Q317 VanDerWaalsContact O-N 3.13Å
315	F	86.4	Confident	84.6	Confident	56 Å²	56	73 Å²	73	25%	0.246	41%	0.411	C	S	.	.	H	α-helix	trans	-65.6	-34.7	178	-78	-33.5	0	0	0	113.5	V311 Q317 T318 L325 W329	V311-F315 HydrophobicContact CB-CD2 3.8Å; V311-F315 HydrophobicContact CB-CE2 3.78Å; V311-F315 HydrophobicContact CG1-CE2 4.28Å; V311-F315 HydrophobicContact CG2-CD2 3.81Å; V311-F315 HydrophobicContact CG2-CE2 3.8Å; V311-F315 PolarHBondContact O-N 3.46Å; F315-Q317 PolarHBondContact O-N 3.11Å; F315-T318 WeakPolarHBondContact O-CB 3.49Å; F315-T318 WeakPolarHBondContact O-CG2 3.26Å; F315-T318 PolarHBondContact O-N 3.2Å; F315-T318 VanDerWaalsContact O-N 3.09Å; F315-T318 PolarHBondContact O-OG1 3.17Å; F315-L325 HydrophobicContact CB-CD1 3.95Å; F315-L325 HydrophobicContact CB-CD2 3.74Å; F315-L325 HydrophobicContact CB-CG 4.34Å; F315-L325 HydrophobicContact CG-CD2 4.18Å; F315-L325 WeakPolarHBondContact O-CD1 3.14Å; F315-W329 HydrophobicContact CE2-CE3 4.33Å
316	L	85.6	Confident	84.5	Confident	85 Å²	85	70.6 Å²	70.6	45%	0.445	41%	0.408	S	S	.	.	H	α-helix	trans	-64.9	-23	175.1	-74.6	170.4	0	0	0	113.2	K312 F314 T318 G319 L325	K312-L316 HydrophobicContact CG-CD1 3.87Å; K312-L316 HydrophobicContact CG-CG 4.42Å; K312-L316 WeakPolarHBondContact O-CB 3.5Å; K312-L316 WeakPolarHBondContact O-CG 3.46Å; K312-L316 PolarHBondContact O-N 3Å; F314-L316 PolarHBondContact O-N 3.02Å; L316-T318 PolarHBondContact O-N 3.07Å; L316-G319 PolarHBondContact O-N 2.96Å; L316-L325 HydrophobicContact CD2-CD1 3.94Å; L316-L325 HydrophobicContact CG-CD1 4.35Å
317	Q	84.6	Confident	84.3	Confident	153 Å²	153	76 Å²	76	72%	0.715	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-17.5	175.2	-70	167.6	46.2	0	0	112.9	S313 F314 F315 G319	S313-Q317 WeakPolarHBondContact O-CG 3.32Å; S313-Q317 PolarHBondContact O-NE2 3.26Å; F314-Q317 WeakPolarHBondContact O-CB 3.2Å; F314-Q317 PolarHBondContact O-N 2.99Å; F314-Q317 VanDerWaalsContact O-N 3.13Å; F315-Q317 PolarHBondContact O-N 3.11Å; Q317-G319 PolarHBondContact O-N 3.39Å
318	T	85.9	Confident	84.2	Confident	77 Å²	77	77.6 Å²	77.6	47%	0.472	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.2	177.2	68.5	0	0	0	0	113.1	F315 L316 L320	F315-T318 WeakPolarHBondContact O-CB 3.49Å; F315-T318 WeakPolarHBondContact O-CG2 3.26Å; F315-T318 PolarHBondContact O-N 3.2Å; F315-T318 VanDerWaalsContact O-N 3.09Å; F315-T318 PolarHBondContact O-OG1 3.17Å; L316-T318 PolarHBondContact O-N 3.07Å; T318-L320 PolarHBondContact O-N 3.17Å; T318-L320 WeakPolarHBondContact OG1-CB 3.3Å; T318-L320 WeakPolarHBondContact OG1-CG 3.47Å; T318-L320 PolarHBondContact OG1-N 3.1Å
319	G	85.7	Confident	83.9	Confident	66 Å²	66	84.5 Å²	84.5	68%	0.68	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	0.5	-175.3	0	0	0	0	0	114.2	L316 Q317	L316-G319 PolarHBondContact O-N 2.96Å; Q317-G319 PolarHBondContact O-N 3.39Å
320	L	85.9	Confident	84	Confident	78 Å²	78	82.6 Å²	82.6	41%	0.408	45%	0.448	S	S	.	.			trans	-67.9	143.9	177.2	-70.1	173.9	0	0	0	111.7	T318 L325 I328	T318-L320 PolarHBondContact O-N 3.17Å; T318-L320 WeakPolarHBondContact OG1-CB 3.3Å; T318-L320 WeakPolarHBondContact OG1-CG 3.47Å; T318-L320 PolarHBondContact OG1-N 3.1Å; L320-L325 HydrophobicContact CB-CD2 3.81Å; L320-L325 HydrophobicContact CB-CG 4.01Å; L320-L325 HydrophobicContact CD1-CD2 3.96Å; L320-I328 HydrophobicContact CD1-CD1 4.31Å
321	P	84.7	Confident	84	Confident	70 Å²	70	84.6 Å²	84.6	46%	0.455	46%	0.459	S	S	.	.			trans	-56.9	141.9	174.1	-25.8	35.3	0	0	0	112.3	N323 V324 L325	P321-N323 WeakPolarHBondContact CB-OD1 3.26Å; P321-N323 PolarHBondContact O-N 2.92Å; P321-N323 VanDerWaalsContact O-N 3.12Å; P321-V324 HydrophobicContact CB-CG2 4.14Å; P321-V324 HydrophobicContact CG-CG2 4.27Å; P321-V324 WeakPolarHBondContact O-CB 3.47Å; P321-V324 PolarHBondContact O-N 3.41Å; P321-L325 PolarHBondContact O-N 2.76Å; P321-L325 VanDerWaalsContact O-N 3.1Å
322	Q	83.7	Confident	83.8	Confident	130 Å²	130	88.4 Å²	88.4	61%	0.607	48%	0.479	S	S	*	.	H	α-helix	trans	-58.6	-30.7	-176.7	-169.9	176	10.6	0	0	113.3	V324 A326	Q322-V324 VanDerWaalsContact C-N 3.35Å; Q322-A326 WeakPolarHBondContact O-CB 3.5Å; Q322-A326 PolarHBondContact O-N 2.59Å
323	N	84	Confident	83.8	Confident	107 Å²	107	87.7 Å²	87.7	57%	0.572	48%	0.482	S	S	*	.	H	α-helix	trans	-68.3	-33.3	175.3	64.7	-61.2	0	0	0	112.6	P321 N327	P321-N323 WeakPolarHBondContact CB-OD1 3.26Å; P321-N323 PolarHBondContact O-N 2.92Å; P321-N323 VanDerWaalsContact O-N 3.12Å; N323-N327 PolarHBondContact O-N 3.06Å; N323-N327 PolarHBondContact O-OD1 2.89Å
324	V	82.1	Confident	83.9	Confident	53 Å²	53	88.3 Å²	88.3	32%	0.321	48%	0.478	S	S	.	.	H	α-helix	trans	-71.6	-45.8	175.8	178.1	0	0	0	0	109.4	P321 Q322 A326 N327 I328	P321-V324 HydrophobicContact CB-CG2 4.14Å; P321-V324 HydrophobicContact CG-CG2 4.27Å; P321-V324 WeakPolarHBondContact O-CB 3.47Å; P321-V324 PolarHBondContact O-N 3.41Å; Q322-V324 VanDerWaalsContact C-N 3.35Å; V324-A326 VanDerWaalsContact C-N 3.26Å; V324-A326 PolarHBondContact O-N 3.42Å; V324-N327 PolarHBondContact O-N 3.47Å; V324-I328 HydrophobicContact CG1-CD1 3.97Å; V324-I328 WeakPolarHBondContact O-CG1 3.37Å; V324-I328 PolarHBondContact O-N 3.43Å
325	L	84.7	Confident	83.8	Confident	14 Å²	14	91.1 Å²	91.1	7%	0.073	50%	0.496	C	S	.	.	H	α-helix	trans	-59.5	-37.1	176.2	-65.2	178.4	0	0	0	112.6	F315 L316 L320 P321 N327 I328 W329	F315-L325 HydrophobicContact CB-CD1 3.95Å; F315-L325 HydrophobicContact CB-CD2 3.74Å; F315-L325 HydrophobicContact CB-CG 4.34Å; F315-L325 HydrophobicContact CG-CD2 4.18Å; F315-L325 WeakPolarHBondContact O-CD1 3.14Å; L316-L325 HydrophobicContact CD2-CD1 3.94Å; L316-L325 HydrophobicContact CG-CD1 4.35Å; L320-L325 HydrophobicContact CB-CD2 3.81Å; L320-L325 HydrophobicContact CB-CG 4.01Å; L320-L325 HydrophobicContact CD1-CD2 3.96Å; P321-L325 PolarHBondContact O-N 2.76Å; P321-L325 VanDerWaalsContact O-N 3.1Å; L325-N327 VanDerWaalsContact C-N 3.29Å; L325-N327 PolarHBondContact O-N 2.95Å; L325-I328 HydrophobicContact CD2-CD1 4.48Å; L325-I328 PolarHBondContact O-N 3.15Å; L325-W329 WeakPolarHBondContact O-CB 3.14Å; L325-W329 PolarHBondContact O-N 2.73Å; L325-W329 VanDerWaalsContact O-N 3.1Å
326	A	81.4	Confident	83.6	Confident	63 Å²	63	93.6 Å²	93.6	52%	0.521	51%	0.514	S	S	.	.	H	α-helix	trans	-70.9	-22	176.1	0	0	0	0	0	113.9	Q322 V324	Q322-A326 WeakPolarHBondContact O-CB 3.5Å; Q322-A326 PolarHBondContact O-N 2.59Å; V324-A326 VanDerWaalsContact C-N 3.26Å; V324-A326 PolarHBondContact O-N 3.42Å
327	N	82	Confident	83.5	Confident	137 Å²	137	94.2 Å²	94.2	73%	0.733	52%	0.519	S	S	*	.	H	α-helix	trans	-85	-28	173.5	-71.9	-7.9	0	0	0	112	N323 V324 L325	N323-N327 PolarHBondContact O-N 3.06Å; N323-N327 PolarHBondContact O-OD1 2.89Å; V324-N327 PolarHBondContact O-N 3.47Å; L325-N327 VanDerWaalsContact C-N 3.29Å; L325-N327 PolarHBondContact O-N 2.95Å
328	I	82.4	Confident	83.4	Confident	102 Å²	102	89.3 Å²	89.3	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-73.1	-36.1	175.7	-66.9	167.5	0	0	0	110.7	L320 V324 L325	L320-I328 HydrophobicContact CD1-CD1 4.31Å; V324-I328 HydrophobicContact CG1-CD1 3.97Å; V324-I328 WeakPolarHBondContact O-CG1 3.37Å; V324-I328 PolarHBondContact O-N 3.43Å; L325-I328 HydrophobicContact CD2-CD1 4.48Å; L325-I328 PolarHBondContact O-N 3.15Å
329	W	78.3	Confident	83.2	Confident	175 Å²	175	90.5 Å²	90.5	66%	0.663	51%	0.505	S	S	*	.			trans	-76.9	0	176.9	-177.4	-91.2	0	0	0	112.7	V306 G308 V311 F315 L325	V306-W329 WeakPolarHBondContact O-CH2 3.48Å; G308-W329 VanDerWaalsContact CA-CH2 3.46Å; G308-W329 VanDerWaalsContact N-CH2 3.25Å; V311-W329 HydrophobicContact CB-CZ3 4.22Å; V311-W329 HydrophobicContact CG1-CZ3 3.99Å; V311-W329 HydrophobicContact CG2-CD2 4.35Å; V311-W329 HydrophobicContact CG2-CE3 3.45Å; V311-W329 VanDerWaalsContact CG2-CE3 3.45Å; V311-W329 HydrophobicContact CG2-CH2 3.96Å; V311-W329 HydrophobicContact CG2-CZ3 3.21Å; F315-W329 HydrophobicContact CE2-CE3 4.33Å; L325-W329 WeakPolarHBondContact O-CB 3.14Å; L325-W329 PolarHBondContact O-N 2.73Å; L325-W329 VanDerWaalsContact O-N 3.1Å

Retrieved 329 of 329 residues in 127.2 ms (Link to these results)

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