A0A096N4N0_PAPAN Loading...

Transcription factor SOX

AlphaFold DB (A0A2K5L3D6), UniProt , Accession A0A096N4N0, Species PAPAN (Papio anubis, Olive baboon), Gene SOX12, Length 314 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.6	Very low	47.3	Very low	246 Å²	246	172.7 Å²	172.7	100%	1.212	87%	0.867	S	S	*	*				0	116.2	0	-132.3	153.9	-175.6	0	0	107.4
2	V	49.5	Very low	47.5	Very low	122 Å²	122	171.3 Å²	171.3	74%	0.739	86%	0.864	S	S	*	*			trans	-67.1	142.8	-179.4	168.6	0	0	0	0	110.6
3	Q	46.7	Very low	47.7	Very low	169 Å²	169	164.6 Å²	164.6	79%	0.79	86%	0.864	S	S	*	*			trans	164.6	143.8	144.1	-91.3	142.4	75.5	0	0	109.1
4	Q	46.6	Very low	47.8	Very low	174 Å²	174	157 Å²	157	81%	0.813	85%	0.845	S	S	*	*			cis	-171.2	152.4	-22.4	-118.2	-170.8	94.4	0	0	104.8
5	R	49.7	Very low	48.7	Very low	251 Å²	251	154.5 Å²	154.5	95%	0.947	84%	0.84	S	S	*	*			trans	-61.9	150	174.7	-67.2	162.9	131.8	-160.4	-3.8	111.4
6	G	39.9	Very low	49.5	Very low	80 Å²	80	151.8 Å²	151.8	83%	0.825	83%	0.833	S	S	*	*			trans	-154.8	96.5	169.8	0	0	0	0	0	112.6
7	A	47.6	Very low	50.3	Low	102 Å²	102	149.5 Å²	149.5	84%	0.843	83%	0.827	S	S	*	*			trans	-64.8	144.8	174.2	0	0	0	0	0	112
8	R	44.9	Very low	50.3	Low	253 Å²	253	148.4 Å²	148.4	96%	0.955	83%	0.828	S	S	*	*			trans	-123.8	86.2	159.9	-158.4	171.7	-169.7	-93.5	-0.6	109.5
9	A	49.2	Very low	50.5	Low	89 Å²	89	143.2 Å²	143.2	74%	0.736	81%	0.811	S	S	*	*			trans	-96.5	123.7	163.4	0	0	0	0	0	109.2
10	K	49.8	Very low	50.9	Low	192 Å²	192	143 Å²	143	84%	0.835	82%	0.816	S	S	*	*				66.5	118.4	129	-158.3	159.4	168.5	175.3	0	119.1
11	R	49.8	Very low	50.3	Low	222 Å²	222	138.6 Å²	138.6	84%	0.838	80%	0.802	S	S	*	*			trans	148.1	121.9	149	-78.5	156	-161.3	-88.4	6.2	105.1
12	D	49.8	Very low	50.5	Low	156 Å²	156	133.2 Å²	133.2	83%	0.834	79%	0.786	S	S	*	*			cis	-143.1	132.1	41.6	-78.2	-78.7	0	0	0	112	G14	D12-G14 PolarHBondContact O-N 3.36Å
13	G	50	Low	50.2	Low	84 Å²	84	131.8 Å²	131.8	87%	0.866	79%	0.787	S	S	*	*			trans	-80.2	95.9	158.3	0	0	0	0	0	108.2
14	G	48.6	Very low	50.2	Low	58 Å²	58	132 Å²	132	60%	0.598	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-85.5	137.6	156.8	0	0	0	0	0	108.4	D12	D12-G14 PolarHBondContact O-N 3.36Å
15	P	61.9	Low	50	Low	119 Å²	119	131.5 Å²	131.5	77%	0.773	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-57.9	143.5	172.5	25.7	-32.4	0	0	0	109.3
16	P	62.2	Low	49.6	Very low	111 Å²	111	121.9 Å²	121.9	72%	0.721	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-56	148.2	170.3	26.8	-33.7	0	0	0	108.7
17	P	61.8	Low	49.7	Very low	113 Å²	113	121.6 Å²	121.6	73%	0.734	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-52.2	137.9	174.4	24.9	-33.7	0	0	0	108	G19	P17-G19 PolarHBondContact O-N 3.42Å
18	P	51.8	Low	49.7	Very low	130 Å²	130	127.1 Å²	127.1	84%	0.844	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-54.9	116.8	173.3	24.2	-31.4	0	0	0	106.1
19	G	53.2	Low	50	Low	50 Å²	50	120.2 Å²	120.2	52%	0.515	73%	0.732	S	S	.	*	P	Polyproline II helix	trans	-50.3	156.8	165.6	0	0	0	0	0	108.4	P17 G21	P17-G19 PolarHBondContact O-N 3.42Å; G19-G21 PolarHBondContact O-N 2.9Å
20	P	58	Low	50.1	Low	139 Å²	139	119.6 Å²	119.6	90%	0.903	72%	0.72	S	S	*	*	S	Bend	trans	-48.7	111.1	177.8	23	-32.7	0	0	0	107.8
21	G	39.3	Very low	50.7	Low	51 Å²	51	113.3 Å²	113.3	53%	0.526	71%	0.71	S	S	.	*			trans	-60.2	164.5	-178	0	0	0	0	0	109.7	G19 A23	G19-G21 PolarHBondContact O-N 2.9Å; G21-A23 PolarHBondContact O-N 2.82Å
22	P	50.3	Low	51.5	Low	133 Å²	133	108 Å²	108	86%	0.864	69%	0.69	S	S	*	*			trans	-71.5	72.4	172.8	33.2	-32.8	0	0	0	108.3	E24	P22-E24 PolarHBondContact O-N 3.38Å
23	A	43.5	Very low	52.7	Low	92 Å²	92	101.8 Å²	101.8	76%	0.76	66%	0.659	S	S	*	*			trans	-73.5	115.4	164.5	0	0	0	0	0	106.6	G21	G21-A23 PolarHBondContact O-N 2.82Å
24	E	46.1	Very low	54.1	Low	173 Å²	173	103.3 Å²	103.3	81%	0.808	64%	0.641	S	S	*	*			trans	70.1	75.9	174.9	-67.3	-133.9	125	0	0	117.1	P22 G26	P22-E24 PolarHBondContact O-N 3.38Å; E24-G26 PolarHBondContact O-N 2.84Å
25	E	42.7	Very low	55.7	Low	163 Å²	163	102.5 Å²	102.5	76%	0.762	63%	0.625	S	S	*	*			trans	-68.9	60.7	139	-170.6	161.2	-150.4	0	0	109.6	R28	E25-R28 IonicContact OE1-NE 3.34Å
26	G	40.9	Very low	56.5	Low	49 Å²	49	104 Å²	104	51%	0.505	63%	0.634	S	S	.	*			trans	-133.5	19.4	-173.8	0	0	0	0	0	112.8	E24	E24-G26 PolarHBondContact O-N 2.84Å
27	A	42.3	Very low	57.3	Low	75 Å²	75	103.9 Å²	103.9	62%	0.62	64%	0.636	S	S	*	*			trans	-175.4	75	165.4	0	0	0	0	0	108.9	E29	A27-E29 HydrophobicContact CB-CB 4.47Å; A27-E29 PolarHBondContact O-N 3.38Å
28	R	47.4	Very low	58.5	Low	218 Å²	218	101.1 Å²	101.1	82%	0.823	63%	0.629	S	S	*	*			trans	-74.8	41.4	153.1	-69.8	-175.4	168.5	-161.9	1	110.2	E25 P30	E25-R28 IonicContact OE1-NE 3.34Å; R28-P30 WeakPolarHBondContact O-CD 3.33Å
29	E	52.7	Low	60.3	Low	108 Å²	108	100.5 Å²	100.5	51%	0.505	61%	0.614	S	S	.	*			trans	-72.9	102.4	154.3	-84.3	-72.7	132.9	0	0	104	A27 G31 K99	A27-E29 HydrophobicContact CB-CB 4.47Å; A27-E29 PolarHBondContact O-N 3.38Å; E29-G31 PolarHBondContact O-N 2.89Å; E29-G31 VanDerWaalsContact O-N 3.1Å; E29-K99 IonicContact OE1-NZ 2.76Å; E29-K99 PolarHBondContact OE1-NZ 3.07Å; E29-K99 VanDerWaalsContact OE2-CE 3.23Å; E29-K99 WeakPolarHBondContact OE2-CE 3.37Å; E29-K99 IonicContact OE2-NZ 3.84Å; E29-K99 PolarHBondContact OE2-NZ 2.91Å
30	P	51	Low	62.2	Low	75 Å²	75	100 Å²	100	49%	0.487	60%	0.599	S	S	.	*			trans	-55.1	130.4	176.8	25.1	-32.2	0	0	0	106.4	R28 W32	R28-P30 WeakPolarHBondContact O-CD 3.33Å; P30-W32 HydrophobicContact CB-CG 4.12Å; P30-W32 HydrophobicContact CG-CD2 4.29Å; P30-W32 HydrophobicContact CG-CG 4.18Å; P30-W32 PolarHBondContact O-N 3.11Å
31	G	61.7	Low	64	Low	60 Å²	60	98.4 Å²	98.4	62%	0.619	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	35.8	174.9	0	0	0	0	0	113.6	E29 C33 K34	E29-G31 PolarHBondContact O-N 2.89Å; E29-G31 VanDerWaalsContact O-N 3.1Å; G31-C33 PolarHBondContact O-N 3.28Å; G31-K34 PolarHBondContact O-N 3.23Å
32	W	66.6	Low	66.7	Low	110 Å²	110	102.8 Å²	102.8	42%	0.417	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-53	-36.9	175.7	-89	13.6	0	0	0	111.9	P30 M44 L96	P30-W32 HydrophobicContact CB-CG 4.12Å; P30-W32 HydrophobicContact CG-CD2 4.29Å; P30-W32 HydrophobicContact CG-CG 4.18Å; P30-W32 PolarHBondContact O-N 3.11Å; W32-M44 HydrophobicContact CD2-CE 4.04Å; W32-M44 HydrophobicContact CE3-CE 3.64Å; W32-M44 HydrophobicContact CH2-CE 3.41Å; W32-M44 VanDerWaalsContact CH2-CE 3.41Å; W32-M44 HydrophobicContact CZ2-CE 3.83Å; W32-M44 HydrophobicContact CZ3-CE 3.31Å; W32-L96 HydrophobicContact CE3-CD1 4.49Å; W32-L96 HydrophobicContact CE3-CD2 3.93Å; W32-L96 HydrophobicContact CZ3-CD1 3.89Å; W32-L96 HydrophobicContact CZ3-CD2 3.74Å; W32-L96 HydrophobicContact CZ3-CG 4.47Å
33	C	74.2	Confident	68.9	Low	27 Å²	27	98.4 Å²	98.4	18%	0.182	55%	0.55	C	S	.	*	S	Bend	trans	-98.5	-20.3	-175.7	-63	0	0	0	0	114.1	G31 I40 K41 H100 Y104	G31-C33 PolarHBondContact O-N 3.28Å; C33-I40 CarbonylContact O-C 3.58Å; C33-I40 WeakPolarHBondContact O-CA 3.44Å; C33-K41 PolarHBondContact O-N 3.18Å; C33-H100 PolarHBondContact SG-ND1 3.47Å; C33-H100 VanDerWaalsContact SG-ND1 3.44Å; C33-Y104 HydrophobicContact CB-CE2 3.6Å
34	K	80.1	Confident	71.4	Confident	116 Å²	116	96.3 Å²	96.3	50%	0.504	53%	0.525	S	S	.	.	B	Isolated β-bridge	trans	-117	119.1	-178.8	-89.2	171.3	169.6	161.4	0	111.5	G31 I40 Y104	G31-K34 PolarHBondContact O-N 3.23Å; K34-I40 HydrophobicContact CG-CG1 4.14Å; K34-Y104 HydrophobicContact CD-CE1 4.16Å; K34-Y104 WeakPolarHBondContact CD-OH 3.33Å; K34-Y104 VanDerWaalsContact CE-CE1 3.42Å; K34-Y104 HydrophobicContact CG-CE1 4.4Å
35	T	82.1	Confident	73.9	Confident	41 Å²	41	92.4 Å²	92.4	25%	0.252	51%	0.51	S	S	.	.			trans	-72.1	158.1	168.8	60.4	0	0	0	0	110.7	S37 G38 H39 K41	T35-S37 PolarHBondContact O-N 3.47Å; T35-G38 PolarHBondContact O-N 2.77Å; T35-H39 PolarHBondContact N-O 3.2Å; T35-H39 WeakPolarHBondContact OG1-CB 3.38Å; T35-H39 PolarHBondContact OG1-N 3.35Å; T35-H39 VanDerWaalsContact OG1-N 3.13Å; T35-H39 PolarHBondContact OG1-O 2.88Å; T35-K41 HydrophobicContact CG2-CD 3.85Å; T35-K41 HydrophobicContact CG2-CG 3.81Å
36	P	77.9	Confident	76.5	Confident	149 Å²	149	85.5 Å²	85.5	97%	0.968	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-18.2	172.1	-25	34.5	0	0	0	114	G38	P36-G38 VanDerWaalsContact C-N 3.25Å; P36-G38 PolarHBondContact O-N 3.06Å
37	S	81	Confident	79.2	Confident	110 Å²	110	85.6 Å²	85.6	77%	0.769	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	0.2	175	-177.1	0	0	0	0	113.5	T35 H39	T35-S37 PolarHBondContact O-N 3.47Å; S37-H39 PolarHBondContact O-N 3.45Å
38	G	86.3	Confident	81.9	Confident	55 Å²	55	86.5 Å²	86.5	57%	0.567	46%	0.46	S	S	*	.	S	Bend	trans	77.5	-2.6	-173.6	0	0	0	0	0	114.5	T35 P36	T35-G38 PolarHBondContact O-N 2.77Å; P36-G38 VanDerWaalsContact C-N 3.25Å; P36-G38 PolarHBondContact O-N 3.06Å
39	H	89.6	Confident	84.2	Confident	116 Å²	116	76.4 Å²	76.4	54%	0.537	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-73.3	130	175.9	172.1	63.6	0	0	0	111	T35 S37	T35-H39 PolarHBondContact N-O 3.2Å; T35-H39 WeakPolarHBondContact OG1-CB 3.38Å; T35-H39 PolarHBondContact OG1-N 3.35Å; T35-H39 VanDerWaalsContact OG1-N 3.13Å; T35-H39 PolarHBondContact OG1-O 2.88Å; S37-H39 PolarHBondContact O-N 3.45Å
40	I	93.3	Very high	86.4	Confident	39 Å²	39	71.9 Å²	71.9	20%	0.2	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-84.4	117.1	176.8	-60.4	162.5	0	0	0	110	C33 K34 H100 Y104 Y107	C33-I40 CarbonylContact O-C 3.58Å; C33-I40 WeakPolarHBondContact O-CA 3.44Å; K34-I40 HydrophobicContact CG-CG1 4.14Å; I40-H100 WeakPolarHBondContact CG2-CE1 3.2Å; I40-Y104 HydrophobicContact CD1-CD1 3.42Å; I40-Y104 VanDerWaalsContact CD1-CD1 3.42Å; I40-Y104 HydrophobicContact CD1-CE1 3.82Å; I40-Y104 HydrophobicContact CD1-CG 4.04Å; I40-Y104 HydrophobicContact CG1-CD1 4.09Å; I40-Y104 HydrophobicContact CG1-CE1 4.05Å; I40-Y104 HydrophobicContact CG2-CD1 4.36Å; I40-Y104 HydrophobicContact CG2-CD2 4.05Å; I40-Y104 HydrophobicContact CG2-CE2 4.27Å; I40-Y104 HydrophobicContact CG2-CG 4.11Å; I40-Y107 HydrophobicContact CB-CD2 3.99Å; I40-Y107 HydrophobicContact CB-CE2 3.99Å; I40-Y107 HydrophobicContact CG2-CD2 3.58Å; I40-Y107 HydrophobicContact CG2-CE2 3.68Å
41	K	94.8	Very high	88.6	Confident	106 Å²	106	68.4 Å²	68.4	46%	0.461	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-78	151.5	175.8	-63.9	176.1	65.5	-171.7	0	110.4	C33 T35 H100	C33-K41 PolarHBondContact O-N 3.18Å; T35-K41 HydrophobicContact CG2-CD 3.85Å; T35-K41 HydrophobicContact CG2-CG 3.81Å; K41-H100 PolarHBondContact O-CE1 3.25Å
42	R	96.1	Very high	90.2	Very high	143 Å²	143	68.6 Å²	68.6	54%	0.54	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-60.7	150.1	173.1	-57.4	-177.5	-152.8	-159.9	16.2	111.5	Y107 Y109	R42-Y107 WeakPolarHBondContact CG-OH 3.45Å; R42-Y109 PolarHBondContact NH1-OH 3.25Å; R42-Y109 PolarHBondContact NH2-OH 3.28Å
43	P	96.3	Very high	91.6	Very high	42 Å²	42	68 Å²	68	27%	0.273	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-62.4	151.7	165.9	27.9	-33	0	0	0	110.3	H100	P43-H100 HydrophobicContact CB-CB 4.03Å; P43-H100 HydrophobicContact CG-CB 4.19Å
44	M	96.8	Very high	92.7	Very high	48 Å²	48	68 Å²	68	24%	0.236	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-77.4	131	178.2	-68.5	-170.3	-68.5	0	0	110	W32 M48 V49 A93 L96	W32-M44 HydrophobicContact CD2-CE 4.04Å; W32-M44 HydrophobicContact CE3-CE 3.64Å; W32-M44 HydrophobicContact CH2-CE 3.41Å; W32-M44 VanDerWaalsContact CH2-CE 3.41Å; W32-M44 HydrophobicContact CZ2-CE 3.83Å; W32-M44 HydrophobicContact CZ3-CE 3.31Å; M44-M48 HydrophobicContact CB-CB 3.97Å; M44-M48 HydrophobicContact CG-CB 4.27Å; M44-V49 HydrophobicContact CB-CG2 3.77Å; M44-V49 HydrophobicContact CE-CG2 4.47Å; M44-A93 WeakPolarHBondContact O-CB 3.43Å; M44-L96 HydrophobicContact CB-CD1 4.25Å; M44-L96 HydrophobicContact CE-CD1 4.14Å
45	N	98.1	Very high	93.5	Very high	90 Å²	90	65.9 Å²	65.9	48%	0.481	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-74.8	171.5	169.2	71.9	16.8	0	0	0	111.1	F47 M48 V49	N45-F47 VanDerWaalsContact C-N 3.34Å; N45-F47 PolarHBondContact O-N 3.1Å; N45-F47 PolarHBondContact OD1-N 2.69Å; N45-M48 PolarHBondContact O-N 2.72Å; N45-M48 WeakPolarHBondContact OD1-CB 3.43Å; N45-M48 WeakPolarHBondContact OD1-CG 3.48Å; N45-M48 PolarHBondContact OD1-N 3.42Å; N45-V49 WeakPolarHBondContact O-CG2 2.97Å; N45-V49 PolarHBondContact O-N 2.92Å
46	A	97.6	Very high	94.1	Very high	18 Å²	18	70.7 Å²	70.7	15%	0.149	36%	0.364	C	S	.	.	H	α-helix	trans	-54.2	-46.8	-176	0	0	0	0	0	113.1	M48 V49 W50 W78 V90 A93	A46-M48 VanDerWaalsContact C-N 3.34Å; A46-M48 PolarHBondContact O-N 3.42Å; A46-V49 PolarHBondContact O-N 2.82Å; A46-W50 PolarHBondContact O-N 3.32Å; A46-W78 HydrophobicContact CB-CH2 4.17Å; A46-W78 HydrophobicContact CB-CZ2 4.12Å; A46-V90 HydrophobicContact CB-CB 4.48Å; A46-V90 HydrophobicContact CB-CG2 3.9Å; A46-A93 HydrophobicContact CB-CB 4.13Å
47	F	98	Very high	95	Very high	52 Å²	52	68.7 Å²	68.7	23%	0.228	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-40.7	177.1	172.3	-100.1	0	0	0	112.3	N45 W50 S51 L74 W78	N45-F47 VanDerWaalsContact C-N 3.34Å; N45-F47 PolarHBondContact O-N 3.1Å; N45-F47 PolarHBondContact OD1-N 2.69Å; F47-W50 AromaticContact CD2-CE3 3.97Å; F47-W50 HydrophobicContact CD2-CE3 3.97Å; F47-W50 HydrophobicContact CD2-CZ3 4.14Å; F47-W50 HydrophobicContact CE2-CE3 4.05Å; F47-W50 AromaticContact CE2-CZ3 3.79Å; F47-W50 HydrophobicContact CE2-CZ3 3.79Å; F47-W50 PolarHBondContact O-N 3.16Å; F47-S51 WeakPolarHBondContact O-CB 3.34Å; F47-S51 PolarHBondContact O-N 3.27Å; F47-S51 PolarHBondContact O-OG 3.38Å; F47-L74 HydrophobicContact CZ-CB 4.49Å; F47-W78 HydrophobicContact CD2-CB 3.77Å; F47-W78 AromaticContact CD2-CD1 3.86Å; F47-W78 AromaticContact CD2-CD2 3.93Å; F47-W78 HydrophobicContact CD2-CD2 3.93Å; F47-W78 AromaticContact CD2-CG 3.55Å; F47-W78 HydrophobicContact CD2-CG 3.55Å; F47-W78 HydrophobicContact CE2-CB 3.89Å; F47-W78 HydrophobicContact CE2-CG 4.19Å
48	M	97.7	Very high	95.6	Very high	93 Å²	93	64.3 Å²	64.3	46%	0.458	31%	0.308	S	S	.	.	H	α-helix	trans	-67	-38.3	178.8	-70.6	-66.4	179.9	0	0	111.7	M44 N45 A46 S51 Q52	M44-M48 HydrophobicContact CB-CB 3.97Å; M44-M48 HydrophobicContact CG-CB 4.27Å; N45-M48 PolarHBondContact O-N 2.72Å; N45-M48 WeakPolarHBondContact OD1-CB 3.43Å; N45-M48 WeakPolarHBondContact OD1-CG 3.48Å; N45-M48 PolarHBondContact OD1-N 3.42Å; A46-M48 VanDerWaalsContact C-N 3.34Å; A46-M48 PolarHBondContact O-N 3.42Å; M48-S51 WeakPolarHBondContact CA-OG 3.42Å; M48-S51 PolarHBondContact O-OG 3.38Å; M48-Q52 PolarHBondContact O-N 3.13Å
49	V	97.3	Very high	96	Very high	6 Å²	6	65.9 Å²	65.9	4%	0.036	30%	0.302	C	S	.	.	H	α-helix	trans	-63.8	-49.9	174.4	178.2	0	0	0	0	110.7	M44 N45 A46 H53 F89 E92 A93 L96	M44-V49 HydrophobicContact CB-CG2 3.77Å; M44-V49 HydrophobicContact CE-CG2 4.47Å; N45-V49 WeakPolarHBondContact O-CG2 2.97Å; N45-V49 PolarHBondContact O-N 2.92Å; A46-V49 PolarHBondContact O-N 2.82Å; V49-H53 PolarHBondContact O-ND1 3.1Å; V49-F89 HydrophobicContact CG1-CD1 4.17Å; V49-E92 HydrophobicContact CG1-CB 4.35Å; V49-E92 HydrophobicContact CG1-CG 3.85Å; V49-A93 HydrophobicContact CG2-CB 4.4Å; V49-L96 HydrophobicContact CG2-CD1 3.8Å
50	W	97.8	Very high	96.2	Very high	14 Å²	14	66.1 Å²	66.1	5%	0.053	31%	0.307	C	S	.	.	H	α-helix	trans	-63.9	-51	179.3	170.4	79.6	0	0	0	112.4	A46 F47 Q52 H53 E54 L74 R77 W78 L81 F89	A46-W50 PolarHBondContact O-N 3.32Å; F47-W50 AromaticContact CD2-CE3 3.97Å; F47-W50 HydrophobicContact CD2-CE3 3.97Å; F47-W50 HydrophobicContact CD2-CZ3 4.14Å; F47-W50 HydrophobicContact CE2-CE3 4.05Å; F47-W50 AromaticContact CE2-CZ3 3.79Å; F47-W50 HydrophobicContact CE2-CZ3 3.79Å; F47-W50 PolarHBondContact O-N 3.16Å; W50-Q52 PolarHBondContact O-N 3.11Å; W50-Q52 VanDerWaalsContact O-N 3.16Å; W50-H53 PolarHBondContact O-N 2.91Å; W50-H53 VanDerWaalsContact O-N 3.1Å; W50-E54 HydrophobicContact CH2-CG 4.4Å; W50-E54 HydrophobicContact CZ2-CB 4.26Å; W50-E54 HydrophobicContact CZ2-CG 4.02Å; W50-E54 PolarHBondContact O-N 3.28Å; W50-L74 HydrophobicContact CH2-CB 4.25Å; W50-L74 HydrophobicContact CH2-CD2 3.86Å; W50-L74 WeakPolarHBondContact CH2-O 3.48Å; W50-L74 HydrophobicContact CZ3-CB 3.95Å; W50-L74 HydrophobicContact CZ3-CD2 4.15Å; W50-L74 VanDerWaalsContact CZ3-O 3.31Å; W50-L74 WeakPolarHBondContact CZ3-O 3.4Å; W50-R77 HydrophobicContact CH2-CB 3.98Å; W50-R77 HydrophobicContact CH2-CG 3.93Å; W50-R77 HydrophobicContact CZ2-CB 4.45Å; W50-R77 HydrophobicContact CZ2-CG 3.88Å; W50-W78 HydrophobicContact CB-CE3 4.02Å; W50-W78 HydrophobicContact CB-CH2 4.34Å; W50-W78 HydrophobicContact CB-CZ3 3.54Å; W50-W78 AromaticContact CD2-CE3 3.43Å; W50-W78 HydrophobicContact CD2-CE3 3.43Å; W50-W78 VanDerWaalsContact CD2-CE3 3.43Å; W50-W78 AromaticContact CD2-CZ3 3.84Å; W50-W78 HydrophobicContact CD2-CZ3 3.84Å; W50-W78 HydrophobicContact CE3-CB 4.15Å; W50-W78 HydrophobicContact CE3-CD2 4.17Å; W50-W78 AromaticContact CE3-CE3 3.49Å; W50-W78 HydrophobicContact CE3-CE3 3.49Å; W50-W78 VanDerWaalsContact CE3-CE3 3.49Å; W50-W78 HydrophobicContact CE3-CG 4.47Å; W50-W78 HydrophobicContact CE3-CZ3 4.24Å; W50-W78 AromaticContact CG-CE3 3.66Å; W50-W78 HydrophobicContact CG-CE3 3.66Å; W50-W78 AromaticContact CG-CZ3 3.51Å; W50-W78 HydrophobicContact CG-CZ3 3.51Å; W50-W78 HydrophobicContact CH2-CB 4.07Å; W50-W78 HydrophobicContact CZ3-CB 3.67Å; W50-W78 HydrophobicContact CZ3-CE3 4.15Å; W50-W78 HydrophobicContact CZ3-CG 4.45Å; W50-L81 HydrophobicContact CZ2-CD1 4.04Å; W50-L81 HydrophobicContact CZ2-CD2 4.21Å; W50-F89 HydrophobicContact CB-CB 4.25Å; W50-F89 HydrophobicContact CB-CD1 3.82Å; W50-F89 HydrophobicContact CB-CD2 4.13Å; W50-F89 HydrophobicContact CB-CE1 4.21Å; W50-F89 HydrophobicContact CB-CG 3.78Å; W50-F89 AromaticContact CD1-CD2 3.87Å; W50-F89 AromaticContact CD1-CE2 3.51Å; W50-F89 AromaticContact CD1-CZ 3.6Å; W50-F89 HydrophobicContact CG-CD2 4.33Å; W50-F89 HydrophobicContact CG-CE2 4.36Å; W50-F89 HydrophobicContact CG-CG 4.44Å; W50-F89 HydrophobicContact CG-CZ 4.48Å
51	S	97.5	Very high	96.3	Very high	2 Å²	2	70.6 Å²	70.6	1%	0.014	33%	0.327	C	S	.	.	H	α-helix	trans	-64.2	-23.7	-175.2	63.1	0	0	0	0	112.9	F47 M48 R55	F47-S51 WeakPolarHBondContact O-CB 3.34Å; F47-S51 PolarHBondContact O-N 3.27Å; F47-S51 PolarHBondContact O-OG 3.38Å; M48-S51 WeakPolarHBondContact CA-OG 3.42Å; M48-S51 PolarHBondContact O-OG 3.38Å; S51-R55 WeakPolarHBondContact O-CA 3.48Å; S51-R55 WeakPolarHBondContact O-CB 3.37Å; S51-R55 PolarHBondContact O-N 3.31Å
52	Q	96.3	Very high	96	Very high	63 Å²	63	73.4 Å²	73.4	29%	0.294	34%	0.335	S	S	.	.	H	α-helix	trans	-62.2	-42.6	174.4	-173.1	176.6	12.2	0	0	112.2	M48 W50 R56	M48-Q52 PolarHBondContact O-N 3.13Å; W50-Q52 PolarHBondContact O-N 3.11Å; W50-Q52 VanDerWaalsContact O-N 3.16Å; Q52-R56 PolarHBondContact O-N 3.38Å
53	H	95	Very high	95.8	Very high	99 Å²	99	71.2 Å²	71.2	46%	0.458	34%	0.339	S	S	.	.	H	α-helix	trans	-70.6	-47.4	178.5	-61.9	85.9	0	0	0	110.4	V49 W50 R56 K57	V49-H53 PolarHBondContact O-ND1 3.1Å; W50-H53 PolarHBondContact O-N 2.91Å; W50-H53 VanDerWaalsContact O-N 3.1Å; H53-R56 WeakPolarHBondContact O-CB 3.39Å; H53-R56 PolarHBondContact O-N 2.93Å; H53-K57 PolarHBondContact O-N 3.03Å
54	E	96.5	Very high	95.6	Very high	27 Å²	27	77 Å²	77	13%	0.126	37%	0.368	C	S	.	.	H	α-helix	trans	-71.8	-35.8	-174.8	-160	64.6	-170.5	0	0	112.5	W50 R56 K57 I58 L74 R77	W50-E54 HydrophobicContact CH2-CG 4.4Å; W50-E54 HydrophobicContact CZ2-CB 4.26Å; W50-E54 HydrophobicContact CZ2-CG 4.02Å; W50-E54 PolarHBondContact O-N 3.28Å; E54-R56 VanDerWaalsContact C-N 3.3Å; E54-R56 PolarHBondContact O-N 3.02Å; E54-K57 PolarHBondContact O-N 3.16Å; E54-K57 WeakPolarHBondContact OE2-CD 3.46Å; E54-K57 IonicContact OE2-NZ 2.84Å; E54-K57 PolarHBondContact OE2-NZ 3.49Å; E54-I58 WeakPolarHBondContact O-CG1 3.46Å; E54-I58 PolarHBondContact O-N 2.85Å; E54-I58 VanDerWaalsContact O-N 3.11Å; E54-L74 HydrophobicContact CB-CD2 3.6Å; E54-L74 HydrophobicContact CG-CD2 3.33Å; E54-R77 IonicContact OE1-CZ 3.22Å; E54-R77 IonicContact OE1-NH1 2.92Å; E54-R77 PolarHBondContact OE1-NH1 3.03Å
55	R	96.8	Very high	95.4	Very high	70 Å²	70	76.4 Å²	76.4	26%	0.264	37%	0.365	S	S	.	.	H	α-helix	trans	-59	-42	171.8	177.3	-177.7	-71.4	163.4	1.6	111.5	S51 I58 M59 N67 I70 S71 L74	S51-R55 WeakPolarHBondContact O-CA 3.48Å; S51-R55 WeakPolarHBondContact O-CB 3.37Å; S51-R55 PolarHBondContact O-N 3.31Å; R55-I58 PolarHBondContact O-N 3.47Å; R55-M59 HydrophobicContact CG-CG 4.32Å; R55-M59 HydrophobicContact CG-SD 3.89Å; R55-M59 WeakPolarHBondContact O-CG 3.22Å; R55-M59 PolarHBondContact O-N 3.02Å; R55-N67 WeakPolarHBondContact CD-ND2 3.2Å; R55-N67 PolarHBondContact NE-ND2 3.01Å; R55-I70 HydrophobicContact CB-CG2 4.35Å; R55-I70 HydrophobicContact CG-CG2 4.08Å; R55-S71 PolarHBondContact NH2-OG 2.87Å; R55-S71 VanDerWaalsContact NH2-OG 3.13Å; R55-L74 HydrophobicContact CB-CD1 3.84Å
56	R	96.1	Very high	95.3	Very high	143 Å²	143	78.7 Å²	78.7	54%	0.54	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-49.3	179.5	-170.2	-178	-61.8	160.4	2.5	110.5	Q52 H53 E54 I58 M59 D60	Q52-R56 PolarHBondContact O-N 3.38Å; H53-R56 WeakPolarHBondContact O-CB 3.39Å; H53-R56 PolarHBondContact O-N 2.93Å; E54-R56 VanDerWaalsContact C-N 3.3Å; E54-R56 PolarHBondContact O-N 3.02Å; R56-I58 VanDerWaalsContact C-N 3.26Å; R56-I58 PolarHBondContact O-N 2.94Å; R56-M59 PolarHBondContact O-N 2.98Å; R56-D60 PolarHBondContact O-N 2.81Å
57	K	96.4	Very high	95.1	Very high	107 Å²	107	80.9 Å²	80.9	47%	0.465	38%	0.382	S	S	.	.	H	α-helix	trans	-54.3	-42.8	175.8	-62.6	179.2	-167.8	162.2	0	112.5	H53 E54 D60 Q61	H53-K57 PolarHBondContact O-N 3.03Å; E54-K57 PolarHBondContact O-N 3.16Å; E54-K57 WeakPolarHBondContact OE2-CD 3.46Å; E54-K57 IonicContact OE2-NZ 2.84Å; E54-K57 PolarHBondContact OE2-NZ 3.49Å; K57-D60 PolarHBondContact O-N 3.49Å; K57-Q61 WeakPolarHBondContact O-CG 3.02Å; K57-Q61 PolarHBondContact O-N 2.97Å; K57-Q61 PolarHBondContact O-NE2 3.02Å
58	I	94.1	Very high	95.1	Very high	17 Å²	17	80.8 Å²	80.8	9%	0.087	39%	0.391	C	S	.	.	H	α-helix	trans	-68.5	-40.5	179.4	-69.1	172.9	0	0	0	111.5	E54 R55 R56 D60 Q61 W62 M65 I70 L74	E54-I58 WeakPolarHBondContact O-CG1 3.46Å; E54-I58 PolarHBondContact O-N 2.85Å; E54-I58 VanDerWaalsContact O-N 3.11Å; R55-I58 PolarHBondContact O-N 3.47Å; R56-I58 VanDerWaalsContact C-N 3.26Å; R56-I58 PolarHBondContact O-N 2.94Å; I58-D60 VanDerWaalsContact C-N 3.32Å; I58-Q61 PolarHBondContact O-N 3.31Å; I58-W62 PolarHBondContact O-N 3.28Å; I58-M65 HydrophobicContact CG2-CE 3.05Å; I58-I70 HydrophobicContact CB-CG2 4.24Å; I58-I70 HydrophobicContact CD1-CG2 3.98Å; I58-I70 HydrophobicContact CG2-CD1 3.97Å; I58-I70 HydrophobicContact CG2-CG1 3.9Å; I58-I70 HydrophobicContact CG2-CG2 3.98Å; I58-L74 HydrophobicContact CD1-CD2 3.71Å; I58-L74 HydrophobicContact CD1-CG 4.19Å
59	M	93.8	Very high	95	Very high	88 Å²	88	79.1 Å²	79.1	43%	0.433	38%	0.382	S	S	.	.	H	α-helix	trans	-67.8	-33.1	177.1	-72	179.4	65.1	0	0	112.2	R55 R56 Q61 W62 P63 I70	R55-M59 HydrophobicContact CG-CG 4.32Å; R55-M59 HydrophobicContact CG-SD 3.89Å; R55-M59 WeakPolarHBondContact O-CG 3.22Å; R55-M59 PolarHBondContact O-N 3.02Å; R56-M59 PolarHBondContact O-N 2.98Å; M59-Q61 VanDerWaalsContact C-N 3.34Å; M59-W62 CarbonylContact O-C 3.45Å; M59-P63 WeakPolarHBondContact O-CA 3.46Å; M59-P63 VanDerWaalsContact O-N 3.16Å; M59-I70 HydrophobicContact CG-CD1 3.66Å
60	D	94.8	Very high	95	Very high	122 Å²	122	78.9 Å²	78.9	65%	0.652	38%	0.38	S	S	*	.	H	α-helix	trans	-69.3	-34.8	176.6	-62.2	-23.2	0	0	0	111.3	R56 K57 I58	R56-D60 PolarHBondContact O-N 2.81Å; K57-D60 PolarHBondContact O-N 3.49Å; I58-D60 VanDerWaalsContact C-N 3.32Å
61	Q	94	Very high	94.9	Very high	133 Å²	133	80 Å²	80	62%	0.621	39%	0.391	S	S	*	.	H	α-helix	trans	-81.1	-36.8	176.6	-67.9	170.2	38.1	0	0	113	K57 I58 M59	K57-Q61 WeakPolarHBondContact O-CG 3.02Å; K57-Q61 PolarHBondContact O-N 2.97Å; K57-Q61 PolarHBondContact O-NE2 3.02Å; I58-Q61 PolarHBondContact O-N 3.31Å; M59-Q61 VanDerWaalsContact C-N 3.34Å
62	W	89.6	Confident	94.9	Very high	164 Å²	164	85.8 Å²	85.8	62%	0.621	42%	0.415	S	S	*	.			trans	-135.1	75.3	-174.1	-59.6	96.4	0	0	0	110.2	I58 M59 D64 M65	I58-W62 PolarHBondContact O-N 3.28Å; M59-W62 CarbonylContact O-C 3.45Å; W62-D64 PolarHBondContact O-N 3.43Å; W62-M65 HydrophobicContact CB-CB 3.97Å; W62-M65 HydrophobicContact CB-CE 3.84Å; W62-M65 HydrophobicContact CG-CE 4.2Å; W62-M65 WeakPolarHBondContact O-CB 3.03Å; W62-M65 PolarHBondContact O-N 3.1Å
63	P	91.2	Very high	95	Very high	97 Å²	97	88.4 Å²	88.4	63%	0.63	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-26.1	-174.1	24.4	-34.2	0	0	0	113.3	M59 M65	M59-P63 WeakPolarHBondContact O-CA 3.46Å; M59-P63 VanDerWaalsContact O-N 3.16Å; P63-M65 VanDerWaalsContact C-N 3.33Å
64	D	92.9	Very high	95.1	Very high	164 Å²	164	83.7 Å²	83.7	88%	0.877	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-7.3	179.1	-65.7	-24	0	0	0	113.4	W62 H66	W62-D64 PolarHBondContact O-N 3.43Å; D64-H66 PolarHBondContact O-N 3.28Å
65	M	92.9	Very high	95.2	Very high	35 Å²	35	83.5 Å²	83.5	17%	0.172	41%	0.406	C	S	.	.	S	Bend	trans	-73.5	124.8	-179.2	-174.7	165.5	34.4	0	0	111.1	I58 W62 P63 E69 I70 R73	I58-M65 HydrophobicContact CG2-CE 3.05Å; W62-M65 HydrophobicContact CB-CB 3.97Å; W62-M65 HydrophobicContact CB-CE 3.84Å; W62-M65 HydrophobicContact CG-CE 4.2Å; W62-M65 WeakPolarHBondContact O-CB 3.03Å; W62-M65 PolarHBondContact O-N 3.1Å; P63-M65 VanDerWaalsContact C-N 3.33Å; M65-E69 HydrophobicContact CG-CB 4.36Å; M65-E69 HydrophobicContact SD-CG 4.24Å; M65-I70 HydrophobicContact CB-CD1 4.46Å; M65-I70 HydrophobicContact CB-CG1 4.35Å; M65-I70 HydrophobicContact CE-CG1 3.94Å; M65-I70 HydrophobicContact CG-CD1 4.44Å; M65-I70 HydrophobicContact CG-CG1 3.81Å; M65-I70 HydrophobicContact SD-CG1 4.12Å; M65-R73 VanDerWaalsContact SD-CZ 3.53Å; M65-R73 PolarHBondContact SD-NH1 3.38Å
66	H	95.1	Very high	95.2	Very high	138 Å²	138	86.8 Å²	86.8	64%	0.639	42%	0.418	S	S	*	.			trans	-67	138.1	-178.5	-171.4	62.8	0	0	0	112.6	D64 A68 E69 I70	D64-H66 PolarHBondContact O-N 3.28Å; H66-A68 VanDerWaalsContact C-N 3.25Å; H66-A68 PolarHBondContact O-N 3.25Å; H66-A68 VanDerWaalsContact O-N 3.13Å; H66-E69 WeakPolarHBondContact O-CB 3.14Å; H66-E69 PolarHBondContact O-N 3.34Å; H66-I70 PolarHBondContact O-N 2.96Å; H66-I70 VanDerWaalsContact O-N 3.16Å
67	N	93.9	Very high	95.3	Very high	65 Å²	65	85.6 Å²	85.6	35%	0.348	41%	0.414	S	S	.	.	H	α-helix	trans	-57.9	-32.7	-174.2	-165.8	-77.7	0	0	0	114.1	R55 E69 I70 S71	R55-N67 WeakPolarHBondContact CD-ND2 3.2Å; R55-N67 PolarHBondContact NE-ND2 3.01Å; N67-E69 VanDerWaalsContact C-N 3.25Å; N67-E69 PolarHBondContact O-N 3.27Å; N67-I70 PolarHBondContact O-N 2.91Å; N67-S71 WeakPolarHBondContact O-CB 3.31Å; N67-S71 PolarHBondContact O-N 2.94Å; N67-S71 PolarHBondContact O-OG 3.22Å; N67-S71 PolarHBondContact OD1-OG 2.86Å
68	A	96.4	Very high	95.3	Very high	50 Å²	50	82.6 Å²	82.6	41%	0.413	40%	0.4	S	S	.	.	H	α-helix	trans	-61.4	-37.8	175.8	0	0	0	0	0	111.5	H66 K72	H66-A68 VanDerWaalsContact C-N 3.25Å; H66-A68 PolarHBondContact O-N 3.25Å; H66-A68 VanDerWaalsContact O-N 3.13Å; A68-K72 WeakPolarHBondContact O-CG 3.35Å; A68-K72 PolarHBondContact O-N 3.17Å
69	E	96.5	Very high	95.5	Very high	57 Å²	57	89 Å²	89	27%	0.266	43%	0.429	S	S	.	.	H	α-helix	trans	-73.7	-40.5	177.7	-170.3	53.2	-146.8	0	0	111.4	M65 H66 N67 S71 K72 R73	M65-E69 HydrophobicContact CG-CB 4.36Å; M65-E69 HydrophobicContact SD-CG 4.24Å; H66-E69 WeakPolarHBondContact O-CB 3.14Å; H66-E69 PolarHBondContact O-N 3.34Å; N67-E69 VanDerWaalsContact C-N 3.25Å; N67-E69 PolarHBondContact O-N 3.27Å; E69-S71 VanDerWaalsContact C-N 3.3Å; E69-S71 PolarHBondContact O-N 3.44Å; E69-K72 PolarHBondContact O-N 3.38Å; E69-K72 IonicContact OE2-NZ 2.84Å; E69-K72 PolarHBondContact OE2-NZ 3.41Å; E69-R73 PolarHBondContact O-N 3.26Å; E69-R73 VanDerWaalsContact O-N 3.11Å; E69-R73 IonicContact OE1-NE 3.98Å
70	I	96.4	Very high	95.7	Very high	1 Å²	1	91.9 Å²	91.9	1%	0.005	45%	0.446	C	S	.	.	H	α-helix	trans	-56.5	-47.6	172.8	-56.9	178.7	0	0	0	110.1	R55 I58 M59 M65 H66 N67 K72 R73 L74	R55-I70 HydrophobicContact CB-CG2 4.35Å; R55-I70 HydrophobicContact CG-CG2 4.08Å; I58-I70 HydrophobicContact CB-CG2 4.24Å; I58-I70 HydrophobicContact CD1-CG2 3.98Å; I58-I70 HydrophobicContact CG2-CD1 3.97Å; I58-I70 HydrophobicContact CG2-CG1 3.9Å; I58-I70 HydrophobicContact CG2-CG2 3.98Å; M59-I70 HydrophobicContact CG-CD1 3.66Å; M65-I70 HydrophobicContact CB-CD1 4.46Å; M65-I70 HydrophobicContact CB-CG1 4.35Å; M65-I70 HydrophobicContact CE-CG1 3.94Å; M65-I70 HydrophobicContact CG-CD1 4.44Å; M65-I70 HydrophobicContact CG-CG1 3.81Å; M65-I70 HydrophobicContact SD-CG1 4.12Å; H66-I70 PolarHBondContact O-N 2.96Å; H66-I70 VanDerWaalsContact O-N 3.16Å; N67-I70 PolarHBondContact O-N 2.91Å; I70-K72 VanDerWaalsContact C-N 3.34Å; I70-K72 PolarHBondContact O-N 3.33Å; I70-R73 PolarHBondContact O-N 3.13Å; I70-R73 VanDerWaalsContact O-N 3.17Å; I70-L74 HydrophobicContact CG2-CD1 3.76Å; I70-L74 HydrophobicContact CG2-CG 4.1Å; I70-L74 VanDerWaalsContact O-CG 3.29Å; I70-L74 WeakPolarHBondContact O-CG 3.41Å; I70-L74 PolarHBondContact O-N 3.2Å
71	S	97.3	Very high	95.7	Very high	39 Å²	39	87.3 Å²	87.3	27%	0.273	42%	0.421	S	S	.	.	H	α-helix	trans	-63.7	-36.7	-177.8	-61.1	0	0	0	0	112.5	R55 N67 E69 G75	R55-S71 PolarHBondContact NH2-OG 2.87Å; R55-S71 VanDerWaalsContact NH2-OG 3.13Å; N67-S71 WeakPolarHBondContact O-CB 3.31Å; N67-S71 PolarHBondContact O-N 2.94Å; N67-S71 PolarHBondContact O-OG 3.22Å; N67-S71 PolarHBondContact OD1-OG 2.86Å; E69-S71 VanDerWaalsContact C-N 3.3Å; E69-S71 PolarHBondContact O-N 3.44Å; S71-G75 PolarHBondContact O-N 3.39Å
72	K	97.8	Very high	95.9	Very high	122 Å²	122	87.4 Å²	87.4	53%	0.53	42%	0.422	S	S	.	.	H	α-helix	trans	-62.8	-45.5	172.5	-69.7	177.4	-153.1	157.9	0	112.1	A68 E69 I70 G75 R76	A68-K72 WeakPolarHBondContact O-CG 3.35Å; A68-K72 PolarHBondContact O-N 3.17Å; E69-K72 PolarHBondContact O-N 3.38Å; E69-K72 IonicContact OE2-NZ 2.84Å; E69-K72 PolarHBondContact OE2-NZ 3.41Å; I70-K72 VanDerWaalsContact C-N 3.34Å; I70-K72 PolarHBondContact O-N 3.33Å; K72-G75 PolarHBondContact O-N 3.36Å; K72-R76 PolarHBondContact O-N 3.39Å
73	R	96.9	Very high	96.2	Very high	118 Å²	118	84.1 Å²	84.1	45%	0.445	42%	0.416	S	S	.	.	H	α-helix	trans	-63.2	-43.6	178.6	-67.8	179.3	-174.9	-167.4	1.2	111.5	M65 E69 I70 R76 R77	M65-R73 VanDerWaalsContact SD-CZ 3.53Å; M65-R73 PolarHBondContact SD-NH1 3.38Å; E69-R73 PolarHBondContact O-N 3.26Å; E69-R73 VanDerWaalsContact O-N 3.11Å; E69-R73 IonicContact OE1-NE 3.98Å; I70-R73 PolarHBondContact O-N 3.13Å; I70-R73 VanDerWaalsContact O-N 3.17Å; R73-R76 PolarHBondContact O-N 3.13Å; R73-R77 PolarHBondContact O-N 3.34Å
74	L	97.6	Very high	96.5	Very high	1 Å²	1	83.3 Å²	83.3	1%	0.005	41%	0.413	C	S	.	.	H	α-helix	trans	-63.7	-41.1	177.1	-68.9	178.9	0	0	0	112.4	F47 W50 E54 R55 I58 I70 R76 R77 W78	F47-L74 HydrophobicContact CZ-CB 4.49Å; W50-L74 HydrophobicContact CH2-CB 4.25Å; W50-L74 HydrophobicContact CH2-CD2 3.86Å; W50-L74 WeakPolarHBondContact CH2-O 3.48Å; W50-L74 HydrophobicContact CZ3-CB 3.95Å; W50-L74 HydrophobicContact CZ3-CD2 4.15Å; W50-L74 VanDerWaalsContact CZ3-O 3.31Å; W50-L74 WeakPolarHBondContact CZ3-O 3.4Å; E54-L74 HydrophobicContact CB-CD2 3.6Å; E54-L74 HydrophobicContact CG-CD2 3.33Å; R55-L74 HydrophobicContact CB-CD1 3.84Å; I58-L74 HydrophobicContact CD1-CD2 3.71Å; I58-L74 HydrophobicContact CD1-CG 4.19Å; I70-L74 HydrophobicContact CG2-CD1 3.76Å; I70-L74 HydrophobicContact CG2-CG 4.1Å; I70-L74 VanDerWaalsContact O-CG 3.29Å; I70-L74 WeakPolarHBondContact O-CG 3.41Å; I70-L74 PolarHBondContact O-N 3.2Å; L74-R76 VanDerWaalsContact C-N 3.34Å; L74-R76 PolarHBondContact O-N 2.96Å; L74-R77 PolarHBondContact O-N 2.93Å; L74-W78 WeakPolarHBondContact O-CB 3.46Å; L74-W78 PolarHBondContact O-N 3.26Å
75	G	97.9	Very high	96.7	Very high	23 Å²	23	80.3 Å²	80.3	24%	0.237	39%	0.394	C	S	.	.	H	α-helix	trans	-57.8	-45.9	176	0	0	0	0	0	112.4	S71 K72 W78 Q79	S71-G75 PolarHBondContact O-N 3.39Å; K72-G75 PolarHBondContact O-N 3.36Å; G75-W78 PolarHBondContact O-N 2.91Å; G75-Q79 WeakPolarHBondContact O-CG 3.5Å; G75-Q79 PolarHBondContact O-N 2.63Å
76	R	97.9	Very high	96.9	Very high	139 Å²	139	80.4 Å²	80.4	53%	0.525	39%	0.393	S	S	.	.	H	α-helix	trans	-63.7	-45.8	175.4	-69.8	-174.1	-70.9	-131.3	-0.7	112.2	K72 R73 L74 W78 Q79 L80	K72-R76 PolarHBondContact O-N 3.39Å; R73-R76 PolarHBondContact O-N 3.13Å; L74-R76 VanDerWaalsContact C-N 3.34Å; L74-R76 PolarHBondContact O-N 2.96Å; R76-W78 PolarHBondContact O-N 2.87Å; R76-Q79 PolarHBondContact O-N 2.9Å; R76-L80 WeakPolarHBondContact O-CG 3.29Å; R76-L80 PolarHBondContact O-N 2.69Å
77	R	97.4	Very high	97	Very high	117 Å²	117	75.8 Å²	75.8	44%	0.442	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-44.4	179.1	179	175.4	-69	171.7	-0.7	111.2	W50 E54 R73 L74 Q79 L80 L81	W50-R77 HydrophobicContact CH2-CB 3.98Å; W50-R77 HydrophobicContact CH2-CG 3.93Å; W50-R77 HydrophobicContact CZ2-CB 4.45Å; W50-R77 HydrophobicContact CZ2-CG 3.88Å; E54-R77 IonicContact OE1-CZ 3.22Å; E54-R77 IonicContact OE1-NH1 2.92Å; E54-R77 PolarHBondContact OE1-NH1 3.03Å; R73-R77 PolarHBondContact O-N 3.34Å; L74-R77 PolarHBondContact O-N 2.93Å; R77-Q79 VanDerWaalsContact C-N 3.29Å; R77-Q79 PolarHBondContact O-N 3.03Å; R77-L80 CarbonylContact O-C 3.39Å; R77-L80 PolarHBondContact O-N 3.15Å; R77-L81 HydrophobicContact CG-CD1 3.63Å; R77-L81 WeakPolarHBondContact O-CD1 3.42Å; R77-L81 PolarHBondContact O-N 3.16Å
78	W	97.8	Very high	97.2	Very high	44 Å²	44	75.9 Å²	75.9	17%	0.167	38%	0.377	C	S	.	.	H	α-helix	trans	-57.3	-39.9	177	179.6	-105.8	0	0	0	113.4	A46 F47 W50 L74 G75 R76 L80 L81 K86 F89	A46-W78 HydrophobicContact CB-CH2 4.17Å; A46-W78 HydrophobicContact CB-CZ2 4.12Å; F47-W78 HydrophobicContact CD2-CB 3.77Å; F47-W78 AromaticContact CD2-CD1 3.86Å; F47-W78 AromaticContact CD2-CD2 3.93Å; F47-W78 HydrophobicContact CD2-CD2 3.93Å; F47-W78 AromaticContact CD2-CG 3.55Å; F47-W78 HydrophobicContact CD2-CG 3.55Å; F47-W78 HydrophobicContact CE2-CB 3.89Å; F47-W78 HydrophobicContact CE2-CG 4.19Å; W50-W78 HydrophobicContact CB-CE3 4.02Å; W50-W78 HydrophobicContact CB-CH2 4.34Å; W50-W78 HydrophobicContact CB-CZ3 3.54Å; W50-W78 AromaticContact CD2-CE3 3.43Å; W50-W78 HydrophobicContact CD2-CE3 3.43Å; W50-W78 VanDerWaalsContact CD2-CE3 3.43Å; W50-W78 AromaticContact CD2-CZ3 3.84Å; W50-W78 HydrophobicContact CD2-CZ3 3.84Å; W50-W78 HydrophobicContact CE3-CB 4.15Å; W50-W78 HydrophobicContact CE3-CD2 4.17Å; W50-W78 AromaticContact CE3-CE3 3.49Å; W50-W78 HydrophobicContact CE3-CE3 3.49Å; W50-W78 VanDerWaalsContact CE3-CE3 3.49Å; W50-W78 HydrophobicContact CE3-CG 4.47Å; W50-W78 HydrophobicContact CE3-CZ3 4.24Å; W50-W78 AromaticContact CG-CE3 3.66Å; W50-W78 HydrophobicContact CG-CE3 3.66Å; W50-W78 AromaticContact CG-CZ3 3.51Å; W50-W78 HydrophobicContact CG-CZ3 3.51Å; W50-W78 HydrophobicContact CH2-CB 4.07Å; W50-W78 HydrophobicContact CZ3-CB 3.67Å; W50-W78 HydrophobicContact CZ3-CE3 4.15Å; W50-W78 HydrophobicContact CZ3-CG 4.45Å; L74-W78 WeakPolarHBondContact O-CB 3.46Å; L74-W78 PolarHBondContact O-N 3.26Å; G75-W78 PolarHBondContact O-N 2.91Å; R76-W78 PolarHBondContact O-N 2.87Å; W78-L80 VanDerWaalsContact C-N 3.26Å; W78-L80 PolarHBondContact O-N 2.67Å; W78-L81 HydrophobicContact CE3-CD2 4.14Å; W78-L81 HydrophobicContact CZ3-CD2 4.32Å; W78-L81 PolarHBondContact O-N 2.86Å; W78-K86 HydrophobicContact CE3-CG 4.41Å; W78-K86 HydrophobicContact CH2-CB 3.88Å; W78-K86 HydrophobicContact CH2-CD 4.31Å; W78-K86 HydrophobicContact CH2-CG 3.7Å; W78-K86 HydrophobicContact CZ2-CB 4.27Å; W78-K86 HydrophobicContact CZ2-CD 4.02Å; W78-K86 HydrophobicContact CZ2-CG 3.93Å; W78-K86 HydrophobicContact CZ3-CB 4.45Å; W78-K86 HydrophobicContact CZ3-CG 3.95Å; W78-K86 WeakPolarHBondContact O-CE 3.4Å; W78-F89 HydrophobicContact CH2-CB 4.23Å; W78-F89 HydrophobicContact CZ3-CD2 4.27Å
79	Q	97.3	Very high	97.2	Very high	151 Å²	151	75.9 Å²	75.9	71%	0.706	37%	0.367	S	S	*	.	H	α-helix	trans	-65.9	-31.4	176.9	-71.2	174.9	-25.3	0	0	112.4	G75 R76 R77	G75-Q79 WeakPolarHBondContact O-CG 3.5Å; G75-Q79 PolarHBondContact O-N 2.63Å; R76-Q79 PolarHBondContact O-N 2.9Å; R77-Q79 VanDerWaalsContact C-N 3.29Å; R77-Q79 PolarHBondContact O-N 3.03Å
80	L	97.4	Very high	97.3	Very high	150 Å²	150	76.2 Å²	76.2	79%	0.785	37%	0.373	S	S	*	.	H	α-helix	trans	-85.8	-14.3	179.6	-64.9	171.9	0	0	0	113.8	R76 R77 W78	R76-L80 WeakPolarHBondContact O-CG 3.29Å; R76-L80 PolarHBondContact O-N 2.69Å; R77-L80 CarbonylContact O-C 3.39Å; R77-L80 PolarHBondContact O-N 3.15Å; W78-L80 VanDerWaalsContact C-N 3.26Å; W78-L80 PolarHBondContact O-N 2.67Å
81	L	96.2	Very high	97.4	Very high	26 Å²	26	82.4 Å²	82.4	14%	0.136	40%	0.397	C	S	.	.	S	Bend	trans	-62.5	144	175.5	-99.9	69.8	0	0	0	110.3	W50 R77 W78 E85 K86	W50-L81 HydrophobicContact CZ2-CD1 4.04Å; W50-L81 HydrophobicContact CZ2-CD2 4.21Å; R77-L81 HydrophobicContact CG-CD1 3.63Å; R77-L81 WeakPolarHBondContact O-CD1 3.42Å; R77-L81 PolarHBondContact O-N 3.16Å; W78-L81 HydrophobicContact CE3-CD2 4.14Å; W78-L81 HydrophobicContact CZ3-CD2 4.32Å; W78-L81 PolarHBondContact O-N 2.86Å; L81-E85 HydrophobicContact CD2-CB 4.25Å; L81-E85 HydrophobicContact CG-CB 4.39Å; L81-K86 HydrophobicContact CB-CG 4.14Å; L81-K86 WeakPolarHBondContact O-CE 3.41Å; L81-K86 PolarHBondContact O-NZ 3.14Å
82	Q	97.8	Very high	97.4	Very high	135 Å²	135	83.3 Å²	83.3	63%	0.631	40%	0.396	S	S	*	.			trans	-70.5	152.3	172.3	-66.6	-116.1	-13.7	0	0	110.1	S84 E85 K86	Q82-S84 WeakPolarHBondContact CB-OG 3.45Å; Q82-S84 PolarHBondContact O-N 2.98Å; Q82-E85 HydrophobicContact CB-CG 4.25Å; Q82-E85 PolarHBondContact N-OE2 2.97Å; Q82-E85 WeakPolarHBondContact O-CB 3.44Å; Q82-E85 PolarHBondContact O-N 2.94Å; Q82-K86 WeakPolarHBondContact O-CG 3.46Å; Q82-K86 PolarHBondContact O-N 2.94Å; Q82-K86 VanDerWaalsContact O-N 3.1Å
83	D	95.8	Very high	97.4	Very high	94 Å²	94	78 Å²	78	50%	0.503	38%	0.376	S	S	.	.	H	α-helix	trans	-65	-31.5	179.7	-64.4	-23.5	0	0	0	111.5	E85 K86 I87	D83-E85 PolarHBondContact O-N 3.35Å; D83-K86 PolarHBondContact O-N 3.29Å; D83-K86 IonicContact OD1-NZ 3.36Å; D83-K86 PolarHBondContact OD1-NZ 3.35Å; D83-I87 VanDerWaalsContact O-CG1 3.25Å; D83-I87 WeakPolarHBondContact O-CG1 3.23Å; D83-I87 PolarHBondContact O-N 2.99Å
84	S	97.3	Very high	97.5	Very high	80 Å²	80	76.7 Å²	76.7	56%	0.559	37%	0.374	S	S	*	.	H	α-helix	trans	-54.1	-40.1	170.3	53.6	0	0	0	0	113	Q82 P88	Q82-S84 WeakPolarHBondContact CB-OG 3.45Å; Q82-S84 PolarHBondContact O-N 2.98Å; S84-P88 WeakPolarHBondContact O-CD 3.48Å
85	E	96.1	Very high	97.5	Very high	102 Å²	102	82 Å²	82	48%	0.477	39%	0.394	S	S	.	.	H	α-helix	trans	-77.2	-27.6	177.7	-58.8	177.8	110.2	0	0	112.2	L81 Q82 D83 P88 F89	L81-E85 HydrophobicContact CD2-CB 4.25Å; L81-E85 HydrophobicContact CG-CB 4.39Å; Q82-E85 HydrophobicContact CB-CG 4.25Å; Q82-E85 PolarHBondContact N-OE2 2.97Å; Q82-E85 WeakPolarHBondContact O-CB 3.44Å; Q82-E85 PolarHBondContact O-N 2.94Å; D83-E85 PolarHBondContact O-N 3.35Å; E85-P88 WeakPolarHBondContact O-CD 3.49Å; E85-P88 WeakPolarHBondContact O-CG 3.31Å; E85-F89 WeakPolarHBondContact O-CD2 3.36Å; E85-F89 WeakPolarHBondContact O-CE2 3.25Å
86	K	97.3	Very high	97.4	Very high	36 Å²	36	81.6 Å²	81.6	16%	0.157	39%	0.387	C	S	.	.	H	α-helix	trans	-77	-34.1	177.5	-64.4	175.6	-164.4	143.2	0	112.5	W78 L81 Q82 D83 P88 F89 V90	W78-K86 HydrophobicContact CE3-CG 4.41Å; W78-K86 HydrophobicContact CH2-CB 3.88Å; W78-K86 HydrophobicContact CH2-CD 4.31Å; W78-K86 HydrophobicContact CH2-CG 3.7Å; W78-K86 HydrophobicContact CZ2-CB 4.27Å; W78-K86 HydrophobicContact CZ2-CD 4.02Å; W78-K86 HydrophobicContact CZ2-CG 3.93Å; W78-K86 HydrophobicContact CZ3-CB 4.45Å; W78-K86 HydrophobicContact CZ3-CG 3.95Å; W78-K86 WeakPolarHBondContact O-CE 3.4Å; L81-K86 HydrophobicContact CB-CG 4.14Å; L81-K86 WeakPolarHBondContact O-CE 3.41Å; L81-K86 PolarHBondContact O-NZ 3.14Å; Q82-K86 WeakPolarHBondContact O-CG 3.46Å; Q82-K86 PolarHBondContact O-N 2.94Å; Q82-K86 VanDerWaalsContact O-N 3.1Å; D83-K86 PolarHBondContact O-N 3.29Å; D83-K86 IonicContact OD1-NZ 3.36Å; D83-K86 PolarHBondContact OD1-NZ 3.35Å; K86-P88 VanDerWaalsContact C-CD 3.5Å; K86-F89 WeakPolarHBondContact O-CA 3.47Å; K86-F89 WeakPolarHBondContact O-CB 3.13Å; K86-F89 PolarHBondContact O-N 2.74Å; K86-V90 WeakPolarHBondContact O-CG2 3.13Å; K86-V90 PolarHBondContact O-N 3.29Å
87	I	97.8	Very high	97.4	Very high	41 Å²	41	82.9 Å²	82.9	21%	0.21	39%	0.392	C	S	.	.	H	α-helix	trans	-44.1	-51.6	-177.9	-76.3	165.8	0	0	0	113.8	D83 F89 V90 R91 W187	D83-I87 VanDerWaalsContact O-CG1 3.25Å; D83-I87 WeakPolarHBondContact O-CG1 3.23Å; D83-I87 PolarHBondContact O-N 2.99Å; I87-F89 PolarHBondContact O-N 3.42Å; I87-V90 PolarHBondContact O-N 3.02Å; I87-V90 VanDerWaalsContact O-N 3.15Å; I87-R91 HydrophobicContact CG2-CG 4.39Å; I87-R91 VanDerWaalsContact CG2-CZ 3.44Å; I87-R91 WeakPolarHBondContact O-CG 3.47Å; I87-R91 PolarHBondContact O-N 3.35Å; I87-W187 HydrophobicContact CD1-CB 4.21Å; I87-W187 HydrophobicContact CD1-CG 3.99Å
88	P	97.9	Very high	97.3	Very high	68 Å²	68	82.2 Å²	82.2	44%	0.442	40%	0.397	S	S	.	.	H	α-helix	trans	-59.7	-35.9	-179.7	21.7	-34	0	0	0	112.7	S84 E85 K86 E92	S84-P88 WeakPolarHBondContact O-CD 3.48Å; E85-P88 WeakPolarHBondContact O-CD 3.49Å; E85-P88 WeakPolarHBondContact O-CG 3.31Å; K86-P88 VanDerWaalsContact C-CD 3.5Å; P88-E92 WeakPolarHBondContact O-CB 3.31Å; P88-E92 PolarHBondContact O-N 2.83Å
89	F	97.9	Very high	97.2	Very high	49 Å²	49	82.9 Å²	82.9	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-76.9	-30.1	178.6	-54.5	-72	0	0	0	112.7	V49 W50 W78 E85 K86 I87 A93	V49-F89 HydrophobicContact CG1-CD1 4.17Å; W50-F89 HydrophobicContact CB-CB 4.25Å; W50-F89 HydrophobicContact CB-CD1 3.82Å; W50-F89 HydrophobicContact CB-CD2 4.13Å; W50-F89 HydrophobicContact CB-CE1 4.21Å; W50-F89 HydrophobicContact CB-CG 3.78Å; W50-F89 AromaticContact CD1-CD2 3.87Å; W50-F89 AromaticContact CD1-CE2 3.51Å; W50-F89 AromaticContact CD1-CZ 3.6Å; W50-F89 HydrophobicContact CG-CD2 4.33Å; W50-F89 HydrophobicContact CG-CE2 4.36Å; W50-F89 HydrophobicContact CG-CG 4.44Å; W50-F89 HydrophobicContact CG-CZ 4.48Å; W78-F89 HydrophobicContact CH2-CB 4.23Å; W78-F89 HydrophobicContact CZ3-CD2 4.27Å; E85-F89 WeakPolarHBondContact O-CD2 3.36Å; E85-F89 WeakPolarHBondContact O-CE2 3.25Å; K86-F89 WeakPolarHBondContact O-CA 3.47Å; K86-F89 WeakPolarHBondContact O-CB 3.13Å; K86-F89 PolarHBondContact O-N 2.74Å; I87-F89 PolarHBondContact O-N 3.42Å; F89-A93 VanDerWaalsContact O-CB 3.31Å; F89-A93 WeakPolarHBondContact O-CB 3.43Å; F89-A93 PolarHBondContact O-N 3.01Å
90	V	97.8	Very high	97.2	Very high	65 Å²	65	76 Å²	76	39%	0.394	37%	0.369	S	S	.	.	H	α-helix	trans	-65.9	-51	171.8	176.3	0	0	0	0	109.9	A46 K86 I87 E92 A93 E94	A46-V90 HydrophobicContact CB-CB 4.48Å; A46-V90 HydrophobicContact CB-CG2 3.9Å; K86-V90 WeakPolarHBondContact O-CG2 3.13Å; K86-V90 PolarHBondContact O-N 3.29Å; I87-V90 PolarHBondContact O-N 3.02Å; I87-V90 VanDerWaalsContact O-N 3.15Å; V90-E92 VanDerWaalsContact C-N 3.3Å; V90-E92 PolarHBondContact O-N 2.64Å; V90-A93 PolarHBondContact O-N 3.2Å; V90-A93 VanDerWaalsContact O-N 3.14Å; V90-E94 PolarHBondContact O-N 3.17Å
91	R	98.2	Very high	97.1	Very high	130 Å²	130	74.5 Å²	74.5	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-57.1	-43.6	176.5	-69.6	179.1	-173.9	162.4	2.4	111.9	I87 E94 R95 W187	I87-R91 HydrophobicContact CG2-CG 4.39Å; I87-R91 VanDerWaalsContact CG2-CZ 3.44Å; I87-R91 WeakPolarHBondContact O-CG 3.47Å; I87-R91 PolarHBondContact O-N 3.35Å; R91-E94 PolarHBondContact O-N 3.27Å; R91-R95 WeakPolarHBondContact O-CB 3.42Å; R91-R95 PolarHBondContact O-N 3.27Å; R91-W187 VanDerWaalsContact NH2-CE2 3.29Å
92	E	97.6	Very high	97.1	Very high	58 Å²	58	76.9 Å²	76.9	27%	0.271	38%	0.382	S	S	.	.	H	α-helix	trans	-66.4	-39.2	178.3	-178.2	57.1	-160.9	0	0	112.3	V49 P88 V90 R95 L96	V49-E92 HydrophobicContact CG1-CB 4.35Å; V49-E92 HydrophobicContact CG1-CG 3.85Å; P88-E92 WeakPolarHBondContact O-CB 3.31Å; P88-E92 PolarHBondContact O-N 2.83Å; V90-E92 VanDerWaalsContact C-N 3.3Å; V90-E92 PolarHBondContact O-N 2.64Å; E92-R95 VanDerWaalsContact CD-NE 3.34Å; E92-R95 WeakPolarHBondContact O-CB 3.5Å; E92-R95 PolarHBondContact O-N 3.46Å; E92-R95 IonicContact OE1-CZ 2.69Å; E92-R95 IonicContact OE1-NE 2.63Å; E92-R95 PolarHBondContact OE1-NE 2.89Å; E92-R95 VanDerWaalsContact OE1-NE 3.16Å; E92-R95 IonicContact OE1-NH2 2.93Å; E92-R95 PolarHBondContact OE1-NH2 2.97Å; E92-R95 IonicContact OE2-CZ 3.68Å; E92-R95 IonicContact OE2-NE 2.69Å; E92-R95 PolarHBondContact OE2-NE 3.41Å; E92-R95 IonicContact OE2-NH2 2.87Å; E92-L96 VanDerWaalsContact O-CG 3.31Å; E92-L96 WeakPolarHBondContact O-CG 3.4Å; E92-L96 PolarHBondContact O-N 2.95Å
93	A	97.6	Very high	96.9	Very high	11 Å²	11	74.2 Å²	74.2	9%	0.091	37%	0.372	C	S	.	.	H	α-helix	trans	-64.6	-39	174.6	0	0	0	0	0	112.4	M44 A46 V49 F89 V90 L96 R97	M44-A93 WeakPolarHBondContact O-CB 3.43Å; A46-A93 HydrophobicContact CB-CB 4.13Å; V49-A93 HydrophobicContact CG2-CB 4.4Å; F89-A93 VanDerWaalsContact O-CB 3.31Å; F89-A93 WeakPolarHBondContact O-CB 3.43Å; F89-A93 PolarHBondContact O-N 3.01Å; V90-A93 PolarHBondContact O-N 3.2Å; V90-A93 VanDerWaalsContact O-N 3.14Å; A93-L96 PolarHBondContact O-N 3.06Å; A93-R97 PolarHBondContact O-N 3.31Å
94	E	98.2	Very high	96.8	Very high	90 Å²	90	71.6 Å²	71.6	42%	0.421	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-44.1	173.3	-71.8	-156.8	145.8	0	0	112	V90 R91 L96 R97 L98	V90-E94 PolarHBondContact O-N 3.17Å; R91-E94 PolarHBondContact O-N 3.27Å; E94-L96 VanDerWaalsContact C-N 3.25Å; E94-L96 PolarHBondContact O-N 2.89Å; E94-R97 WeakPolarHBondContact O-CB 3.28Å; E94-R97 PolarHBondContact O-N 3.34Å; E94-L98 WeakPolarHBondContact O-CG 3.16Å; E94-L98 PolarHBondContact O-N 3.25Å
95	R	98	Very high	96.7	Very high	112 Å²	112	72.6 Å²	72.6	42%	0.423	36%	0.36	S	S	.	.	H	α-helix	trans	-55.6	-43.8	174	-167.7	-163.7	69.1	73.8	-0.2	111.1	R91 E92 K99	R91-R95 WeakPolarHBondContact O-CB 3.42Å; R91-R95 PolarHBondContact O-N 3.27Å; E92-R95 VanDerWaalsContact CD-NE 3.34Å; E92-R95 WeakPolarHBondContact O-CB 3.5Å; E92-R95 PolarHBondContact O-N 3.46Å; E92-R95 IonicContact OE1-CZ 2.69Å; E92-R95 IonicContact OE1-NE 2.63Å; E92-R95 PolarHBondContact OE1-NE 2.89Å; E92-R95 VanDerWaalsContact OE1-NE 3.16Å; E92-R95 IonicContact OE1-NH2 2.93Å; E92-R95 PolarHBondContact OE1-NH2 2.97Å; E92-R95 IonicContact OE2-CZ 3.68Å; E92-R95 IonicContact OE2-NE 2.69Å; E92-R95 PolarHBondContact OE2-NE 3.41Å; E92-R95 IonicContact OE2-NH2 2.87Å; R95-K99 VanDerWaalsContact O-CB 3.28Å; R95-K99 WeakPolarHBondContact O-CB 3.36Å; R95-K99 PolarHBondContact O-N 2.74Å
96	L	96.6	Very high	96.6	Very high	16 Å²	16	75.3 Å²	75.3	8%	0.084	38%	0.378	C	S	.	.	H	α-helix	trans	-67	-37.9	176.2	-70.4	172.4	0	0	0	112.7	W32 M44 V49 E92 A93 E94 H100	W32-L96 HydrophobicContact CE3-CD1 4.49Å; W32-L96 HydrophobicContact CE3-CD2 3.93Å; W32-L96 HydrophobicContact CZ3-CD1 3.89Å; W32-L96 HydrophobicContact CZ3-CD2 3.74Å; W32-L96 HydrophobicContact CZ3-CG 4.47Å; M44-L96 HydrophobicContact CB-CD1 4.25Å; M44-L96 HydrophobicContact CE-CD1 4.14Å; V49-L96 HydrophobicContact CG2-CD1 3.8Å; E92-L96 VanDerWaalsContact O-CG 3.31Å; E92-L96 WeakPolarHBondContact O-CG 3.4Å; E92-L96 PolarHBondContact O-N 2.95Å; A93-L96 PolarHBondContact O-N 3.06Å; E94-L96 VanDerWaalsContact C-N 3.25Å; E94-L96 PolarHBondContact O-N 2.89Å; L96-H100 VanDerWaalsContact O-CB 3.23Å; L96-H100 WeakPolarHBondContact O-CB 3.44Å; L96-H100 PolarHBondContact O-N 2.96Å
97	R	96.5	Very high	96.5	Very high	165 Å²	165	76.7 Å²	76.7	62%	0.623	38%	0.383	S	S	*	.	H	α-helix	trans	-62.6	-49.4	174.7	179	-175.3	173.2	172.3	0.4	111.1	A93 E94 H100 M101	A93-R97 PolarHBondContact O-N 3.31Å; E94-R97 WeakPolarHBondContact O-CB 3.28Å; E94-R97 PolarHBondContact O-N 3.34Å; R97-H100 WeakPolarHBondContact O-CB 3.23Å; R97-H100 PolarHBondContact O-N 2.86Å; R97-M101 PolarHBondContact O-N 2.94Å
98	L	97.3	Very high	96.4	Very high	104 Å²	104	82.3 Å²	82.3	55%	0.545	41%	0.405	S	S	.	.	H	α-helix	trans	-63.5	-45.4	-179.8	-70.5	171.4	0	0	0	111.3	E94 H100 M101 A102	E94-L98 WeakPolarHBondContact O-CG 3.16Å; E94-L98 PolarHBondContact O-N 3.25Å; L98-H100 VanDerWaalsContact C-N 3.31Å; L98-H100 PolarHBondContact O-N 3.44Å; L98-M101 HydrophobicContact CD2-CE 4.11Å; L98-M101 PolarHBondContact O-N 2.94Å; L98-A102 PolarHBondContact O-N 3.31Å
99	K	95.5	Very high	96.3	Very high	58 Å²	58	84.3 Å²	84.3	25%	0.252	41%	0.405	S	S	.	.	H	α-helix	trans	-57.8	-45.7	174.4	-179	174	179.2	178	0	111.5	E29 R95 M101 A102 D103	E29-K99 IonicContact OE1-NZ 2.76Å; E29-K99 PolarHBondContact OE1-NZ 3.07Å; E29-K99 VanDerWaalsContact OE2-CE 3.23Å; E29-K99 WeakPolarHBondContact OE2-CE 3.37Å; E29-K99 IonicContact OE2-NZ 3.84Å; E29-K99 PolarHBondContact OE2-NZ 2.91Å; R95-K99 VanDerWaalsContact O-CB 3.28Å; R95-K99 WeakPolarHBondContact O-CB 3.36Å; R95-K99 PolarHBondContact O-N 2.74Å; K99-M101 VanDerWaalsContact C-N 3.31Å; K99-M101 PolarHBondContact O-N 3.03Å; K99-A102 PolarHBondContact O-N 2.88Å; K99-D103 WeakPolarHBondContact CE-OD2 3.47Å; K99-D103 WeakPolarHBondContact CG-OD2 3.14Å; K99-D103 WeakPolarHBondContact O-CB 3.39Å; K99-D103 VanDerWaalsContact O-CG 3.26Å; K99-D103 PolarHBondContact O-N 3Å
100	H	96.1	Very high	96	Very high	7 Å²	7	91.3 Å²	91.3	3%	0.032	43%	0.43	C	S	.	.	H	α-helix	trans	-61	-41.3	178.2	-169.8	82.4	0	0	0	112.6	C33 I40 K41 P43 L96 R97 L98 Y104 Y107	C33-H100 PolarHBondContact SG-ND1 3.47Å; C33-H100 VanDerWaalsContact SG-ND1 3.44Å; I40-H100 WeakPolarHBondContact CG2-CE1 3.2Å; K41-H100 PolarHBondContact O-CE1 3.25Å; P43-H100 HydrophobicContact CB-CB 4.03Å; P43-H100 HydrophobicContact CG-CB 4.19Å; L96-H100 VanDerWaalsContact O-CB 3.23Å; L96-H100 WeakPolarHBondContact O-CB 3.44Å; L96-H100 PolarHBondContact O-N 2.96Å; R97-H100 WeakPolarHBondContact O-CB 3.23Å; R97-H100 PolarHBondContact O-N 2.86Å; L98-H100 VanDerWaalsContact C-N 3.31Å; L98-H100 PolarHBondContact O-N 3.44Å; H100-Y104 AromaticContact CE1-CD2 3.61Å; H100-Y104 AromaticContact ND1-CD2 3.58Å; H100-Y104 AromaticContact ND1-CE2 3.98Å; H100-Y104 WeakPolarHBondContact O-CA 3.33Å; H100-Y104 WeakPolarHBondContact O-CB 3.47Å; H100-Y104 WeakPolarHBondContact O-CD2 3.31Å; H100-Y104 PolarHBondContact O-N 3.13Å; H100-Y107 AromaticContact CD2-CD1 3.89Å; H100-Y107 AromaticContact NE2-CD1 3.44Å; H100-Y107 WeakPolarHBondContact NE2-CD1 3.44Å; H100-Y107 AromaticContact NE2-CD2 3.59Å; H100-Y107 AromaticContact NE2-CE1 3.67Å; H100-Y107 AromaticContact NE2-CE2 3.81Å; H100-Y107 AromaticContact NE2-CG 3.39Å; H100-Y107 AromaticContact NE2-CZ 3.83Å
101	M	96.1	Very high	95.8	Very high	117 Å²	117	92.5 Å²	92.5	58%	0.576	44%	0.439	S	S	*	.	H	α-helix	trans	-66.5	-38.3	177.7	-170.6	175.3	73.6	0	0	111.9	R97 L98 K99 Y104 P105	R97-M101 PolarHBondContact O-N 2.94Å; L98-M101 HydrophobicContact CD2-CE 4.11Å; L98-M101 PolarHBondContact O-N 2.94Å; K99-M101 VanDerWaalsContact C-N 3.31Å; K99-M101 PolarHBondContact O-N 3.03Å; M101-Y104 CarbonylContact O-C 3.36Å; M101-P105 WeakPolarHBondContact O-CA 3.39Å
102	A	96.1	Very high	95.4	Very high	76 Å²	76	97.6 Å²	97.6	63%	0.628	46%	0.458	S	S	*	.	H	α-helix	trans	-69.3	-44.6	176.2	0	0	0	0	0	112.5	L98 K99 Y104	L98-A102 PolarHBondContact O-N 3.31Å; K99-A102 PolarHBondContact O-N 2.88Å; A102-Y104 VanDerWaalsContact C-N 3.32Å
103	D	93.9	Very high	95.1	Very high	79 Å²	79	104.7 Å²	104.7	42%	0.422	49%	0.488	S	S	.	.	H	α-helix	trans	-72.9	-27.1	-179.8	-66	-20.2	0	0	0	112.3	K99	K99-D103 WeakPolarHBondContact CE-OD2 3.47Å; K99-D103 WeakPolarHBondContact CG-OD2 3.14Å; K99-D103 WeakPolarHBondContact O-CB 3.39Å; K99-D103 VanDerWaalsContact O-CG 3.26Å; K99-D103 PolarHBondContact O-N 3Å
104	Y	93.8	Very high	94.4	Very high	40 Å²	40	113.3 Å²	113.3	16%	0.157	52%	0.524	C	S	.	.			trans	-134.9	70.6	-176.2	-51.4	-70.7	0	0	0	111.5	C33 K34 I40 H100 M101 A102 D106 Y107	C33-Y104 HydrophobicContact CB-CE2 3.6Å; K34-Y104 HydrophobicContact CD-CE1 4.16Å; K34-Y104 WeakPolarHBondContact CD-OH 3.33Å; K34-Y104 VanDerWaalsContact CE-CE1 3.42Å; K34-Y104 HydrophobicContact CG-CE1 4.4Å; I40-Y104 HydrophobicContact CD1-CD1 3.42Å; I40-Y104 VanDerWaalsContact CD1-CD1 3.42Å; I40-Y104 HydrophobicContact CD1-CE1 3.82Å; I40-Y104 HydrophobicContact CD1-CG 4.04Å; I40-Y104 HydrophobicContact CG1-CD1 4.09Å; I40-Y104 HydrophobicContact CG1-CE1 4.05Å; I40-Y104 HydrophobicContact CG2-CD1 4.36Å; I40-Y104 HydrophobicContact CG2-CD2 4.05Å; I40-Y104 HydrophobicContact CG2-CE2 4.27Å; I40-Y104 HydrophobicContact CG2-CG 4.11Å; H100-Y104 AromaticContact CE1-CD2 3.61Å; H100-Y104 AromaticContact ND1-CD2 3.58Å; H100-Y104 AromaticContact ND1-CE2 3.98Å; H100-Y104 WeakPolarHBondContact O-CA 3.33Å; H100-Y104 WeakPolarHBondContact O-CB 3.47Å; H100-Y104 WeakPolarHBondContact O-CD2 3.31Å; H100-Y104 PolarHBondContact O-N 3.13Å; M101-Y104 CarbonylContact O-C 3.36Å; A102-Y104 VanDerWaalsContact C-N 3.32Å; Y104-D106 PolarHBondContact O-N 3.21Å; Y104-Y107 WeakPolarHBondContact O-CB 3.37Å; Y104-Y107 PolarHBondContact O-N 2.87Å
105	P	94.6	Very high	93.5	Very high	101 Å²	101	113.8 Å²	113.8	66%	0.656	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-32.2	-178.4	24.6	-34.3	0	0	0	112.8	M101 Y107	M101-P105 WeakPolarHBondContact O-CA 3.39Å; P105-Y107 VanDerWaalsContact C-N 3.28Å; P105-Y107 PolarHBondContact O-N 3.06Å
106	D	94.1	Very high	92.1	Very high	159 Å²	159	118.9 Å²	118.9	85%	0.85	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	9.1	177.8	-56.5	-48.3	0	0	0	113.6	Y104 K108	Y104-D106 PolarHBondContact O-N 3.21Å; D106-K108 PolarHBondContact O-N 3.1Å; D106-K108 VanDerWaalsContact O-N 3.1Å
107	Y	95.6	Very high	90.3	Very high	65 Å²	65	121.6 Å²	121.6	26%	0.255	59%	0.594	S	S	.	*			trans	-65.8	114.2	-179.3	-179.8	-101.4	0	0	0	111.3	I40 R42 H100 Y104 P105	I40-Y107 HydrophobicContact CB-CD2 3.99Å; I40-Y107 HydrophobicContact CB-CE2 3.99Å; I40-Y107 HydrophobicContact CG2-CD2 3.58Å; I40-Y107 HydrophobicContact CG2-CE2 3.68Å; R42-Y107 WeakPolarHBondContact CG-OH 3.45Å; H100-Y107 AromaticContact CD2-CD1 3.89Å; H100-Y107 AromaticContact NE2-CD1 3.44Å; H100-Y107 WeakPolarHBondContact NE2-CD1 3.44Å; H100-Y107 AromaticContact NE2-CD2 3.59Å; H100-Y107 AromaticContact NE2-CE1 3.67Å; H100-Y107 AromaticContact NE2-CE2 3.81Å; H100-Y107 AromaticContact NE2-CG 3.39Å; H100-Y107 AromaticContact NE2-CZ 3.83Å; Y104-Y107 WeakPolarHBondContact O-CB 3.37Å; Y104-Y107 PolarHBondContact O-N 2.87Å; P105-Y107 VanDerWaalsContact C-N 3.28Å; P105-Y107 PolarHBondContact O-N 3.06Å
108	K	94.7	Very high	88.1	Confident	158 Å²	158	117.3 Å²	117.3	69%	0.687	59%	0.594	S	S	*	*			trans	-115.8	125.7	171.5	-170.9	162.7	-176	166.1	0	111.1	D106 R110	D106-K108 PolarHBondContact O-N 3.1Å; D106-K108 VanDerWaalsContact O-N 3.1Å; K108-R110 PolarHBondContact O-N 3.23Å
109	Y	95.3	Very high	86.1	Confident	111 Å²	111	118 Å²	118	44%	0.435	60%	0.604	S	S	.	*			trans	-69	120	174.5	173.3	-129.1	0	0	0	110.6	R42 P111	R42-Y109 PolarHBondContact NH1-OH 3.25Å; R42-Y109 PolarHBondContact NH2-OH 3.28Å; Y109-P111 HydrophobicContact CD1-CG 4.33Å; Y109-P111 HydrophobicContact CE1-CB 4.43Å; Y109-P111 HydrophobicContact CE1-CG 3.59Å; Y109-P111 HydrophobicContact CE2-CB 4.3Å; Y109-P111 HydrophobicContact CE2-CG 4.12Å; Y109-P111 VanDerWaalsContact CZ-CG 3.45Å; Y109-P111 WeakPolarHBondContact OH-CB 3.39Å; Y109-P111 WeakPolarHBondContact OH-CG 3.39Å
110	R	92.8	Very high	84.2	Confident	195 Å²	195	119.8 Å²	119.8	74%	0.736	63%	0.63	S	S	*	*			trans	-124.6	93.4	178.5	-64.2	-176.1	-177	-145.5	1.9	110.1	K108 R112	K108-R110 PolarHBondContact O-N 3.23Å; R110-R112 PolarHBondContact O-N 3.46Å
111	P	92.8	Very high	82.1	Confident	90 Å²	90	129 Å²	129	58%	0.584	67%	0.67	S	S	*	*			trans	-56.1	127.6	175.8	-7.9	10.1	0	0	0	111.2	Y109	Y109-P111 HydrophobicContact CD1-CG 4.33Å; Y109-P111 HydrophobicContact CE1-CB 4.43Å; Y109-P111 HydrophobicContact CE1-CG 3.59Å; Y109-P111 HydrophobicContact CE2-CB 4.3Å; Y109-P111 HydrophobicContact CE2-CG 4.12Å; Y109-P111 VanDerWaalsContact CZ-CG 3.45Å; Y109-P111 WeakPolarHBondContact OH-CB 3.39Å; Y109-P111 WeakPolarHBondContact OH-CG 3.39Å
112	R	90.4	Very high	79.7	Confident	238 Å²	238	127.9 Å²	127.9	90%	0.898	68%	0.679	S	S	*	*			trans	-90.3	114.8	174.6	-79.6	178.7	153.8	-103.3	0	110.3	R110 K114	R110-R112 PolarHBondContact O-N 3.46Å; R112-K114 PolarHBondContact O-N 2.94Å
113	K	91.4	Very high	77.6	Confident	207 Å²	207	135 Å²	135	90%	0.9	69%	0.69	S	S	*	*			trans	-71.5	113.4	168.9	-168.1	172.9	-178.1	176.9	0	108.9	S115	K113-S115 PolarHBondContact O-N 3.22Å
114	K	83.8	Confident	75.3	Confident	191 Å²	191	137.1 Å²	137.1	83%	0.83	71%	0.708	S	S	*	*			trans	-70	124.8	169.7	-69.7	178	-178.2	176.1	0	107.9	R112 K116	R112-K114 PolarHBondContact O-N 2.94Å; K114-K116 PolarHBondContact O-N 2.95Å; K114-K116 VanDerWaalsContact O-N 3.15Å
115	S	78.3	Confident	73.3	Confident	100 Å²	100	146.4 Å²	146.4	70%	0.699	74%	0.743	S	S	*	*			trans	-64.1	115	172.2	48.4	0	0	0	0	109.1	K113 G117	K113-S115 PolarHBondContact O-N 3.22Å; S115-G117 PolarHBondContact O-N 3.41Å
116	K	68.3	Low	71.2	Confident	220 Å²	220	147 Å²	147	96%	0.957	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	98.7	165.6	-85.1	-177.9	174.4	175.3	0	106.7	K114	K114-K116 PolarHBondContact O-N 2.95Å; K114-K116 VanDerWaalsContact O-N 3.15Å
117	G	59.4	Low	69	Low	72 Å²	72	146 Å²	146	74%	0.742	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	137.3	18.6	167.3	0	0	0	0	0	118.8	S115 P119	S115-G117 PolarHBondContact O-N 3.41Å; G117-P119 WeakPolarHBondContact O-CD 3.18Å
118	A	50.8	Low	66.5	Low	76 Å²	76	146.8 Å²	146.8	63%	0.628	78%	0.777	S	S	*	*			trans	-93.9	109.9	162.2	0	0	0	0	0	108.8	A120	A118-A120 PolarHBondContact O-N 3.25Å; A118-A120 VanDerWaalsContact O-N 3.11Å
119	P	54.5	Low	63.7	Low	118 Å²	118	143 Å²	143	77%	0.766	78%	0.783	S	S	*	*			trans	-55.7	122.6	165	24.2	-31.4	0	0	0	106.8	G117 K121	G117-P119 WeakPolarHBondContact O-CD 3.18Å; P119-K121 PolarHBondContact O-N 2.91Å
120	A	54.8	Low	60.9	Low	96 Å²	96	142 Å²	142	79%	0.793	81%	0.806	S	S	*	*			trans	-45.1	121.9	177.1	0	0	0	0	0	108.2	A118 A122	A118-A120 PolarHBondContact O-N 3.25Å; A118-A120 VanDerWaalsContact O-N 3.11Å; A120-A122 PolarHBondContact O-N 2.76Å
121	K	51.6	Low	58.1	Low	201 Å²	201	136.5 Å²	136.5	87%	0.874	81%	0.81	S	S	*	*			trans	-46.3	111.7	-178.3	-73.5	-144.1	178.6	-172.3	0	108.6	P119 R123	P119-K121 PolarHBondContact O-N 2.91Å; K121-R123 PolarHBondContact O-N 3.39Å
122	A	47	Very low	55.5	Low	93 Å²	93	136.4 Å²	136.4	77%	0.769	83%	0.825	S	S	*	*			trans	-50.3	111.1	164.9	0	0	0	0	0	106.5	A120	A120-A122 PolarHBondContact O-N 2.76Å
123	R	51.8	Low	52.8	Low	224 Å²	224	128.5 Å²	128.5	85%	0.845	82%	0.818	S	S	*	*			trans	-55.3	127.4	163	-65.1	174.8	86.3	-127.7	7.8	105.2	K121 R125	K121-R123 PolarHBondContact O-N 3.39Å; R123-R125 PolarHBondContact O-N 3.28Å
124	P	44.9	Very low	50.3	Low	125 Å²	125	124.4 Å²	124.4	81%	0.812	82%	0.816	S	S	*	*			trans	-62.6	114.7	176.2	25.2	-30.3	0	0	0	107.3
125	R	52.2	Low	48.1	Very low	234 Å²	234	127.4 Å²	127.4	88%	0.883	82%	0.822	S	S	*	*			trans	-70.2	133.7	168.4	-65.5	178.1	87.2	-158.7	6.5	106.9	R123	R123-R125 PolarHBondContact O-N 3.28Å
126	P	51.4	Low	46.6	Very low	115 Å²	115	130.5 Å²	130.5	75%	0.747	83%	0.829	S	S	*	*			trans	-64.7	145.3	173.9	26.8	-32.9	0	0	0	110.3	G128	P126-G128 PolarHBondContact O-N 3.03Å
127	P	47	Very low	45.6	Very low	137 Å²	137	129.6 Å²	129.6	89%	0.89	83%	0.826	S	S	*	*	S	Bend	trans	-77.5	115.8	179.4	30.7	-31.3	0	0	0	109.9
128	G	43.4	Very low	44.7	Very low	81 Å²	81	132.2 Å²	132.2	84%	0.835	83%	0.83	S	S	*	*			trans	167.8	113.6	169.3	0	0	0	0	0	113.2	P126	P126-G128 PolarHBondContact O-N 3.03Å
129	G	34.9	Very low	44.1	Very low	80 Å²	80	132 Å²	132	83%	0.825	84%	0.835	S	S	*	*			trans	128.9	96.9	167.7	0	0	0	0	0	113.1
130	G	37.9	Very low	43.8	Very low	89 Å²	89	132.8 Å²	132.8	92%	0.918	84%	0.84	S	S	*	*			trans	-69.2	165.1	176.2	0	0	0	0	0	113.9
131	G	33.8	Very low	42.9	Very low	79 Å²	79	137.5 Å²	137.5	81%	0.814	85%	0.845	S	S	*	*			trans	164.2	110	171.5	0	0	0	0	0	110.4
132	G	36.7	Very low	42.3	Very low	88 Å²	88	136.1 Å²	136.1	91%	0.907	85%	0.846	S	S	*	*			trans	-68.4	164.9	-174.8	0	0	0	0	0	114.7
133	G	34.7	Very low	42.4	Very low	73 Å²	73	137.8 Å²	137.8	75%	0.753	85%	0.849	S	S	*	*			trans	171.7	87	173.9	0	0	0	0	0	113
134	S	39.1	Very low	41.5	Very low	120 Å²	120	130.3 Å²	130.3	84%	0.839	84%	0.843	S	S	*	*			trans	43.3	98.7	148.5	-52.8	0	0	0	0	119.8	L136	S134-L136 PolarHBondContact O-N 3.11Å
135	R	38.2	Very low	41.3	Very low	254 Å²	254	136.3 Å²	136.3	96%	0.958	85%	0.849	S	S	*	*			trans	-73.7	107.4	160.3	-116	179.7	-94.9	-127.7	-2.6	109.6
136	L	46.6	Very low	40.3	Very low	165 Å²	165	129 Å²	129	86%	0.864	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-87.8	130.5	160.7	-69	170.2	0	0	0	108.8	S134	S134-L136 PolarHBondContact O-N 3.11Å
137	K	46.3	Very low	39.6	Very low	202 Å²	202	127.2 Å²	127.2	88%	0.878	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-70.2	144.7	-179	-59.7	175.1	173.3	179.4	0	111.2
138	P	41.3	Very low	39.6	Very low	127 Å²	127	132.1 Å²	132.1	83%	0.825	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-95.5	132.6	154.1	24.4	-11.8	0	0	0	111.1
139	G	37	Very low	39.5	Very low	71 Å²	71	140.4 Å²	140.4	73%	0.732	86%	0.855	S	S	*	*			trans	-79.3	-176.7	171.9	0	0	0	0	0	113.7
140	P	50	Low	39.7	Very low	134 Å²	134	141.2 Å²	141.2	87%	0.87	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-91.6	157.8	-134.5	34.4	-35.9	0	0	0	116.3
141	Q	35.1	Very low	39.8	Very low	195 Å²	195	142.2 Å²	142.2	91%	0.911	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-71.1	141.2	177.8	-59	-173.5	93.3	0	0	112.8
142	L	38.2	Very low	39.8	Very low	172 Å²	172	142.2 Å²	142.2	90%	0.901	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-91.7	141.5	162.4	-78.3	162.3	0	0	0	110
143	P	48.7	Very low	39.6	Very low	128 Å²	128	141.6 Å²	141.6	83%	0.831	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-94.7	146.1	-178.8	35.6	-30.8	0	0	0	112.8
144	G	34	Very low	40.2	Very low	68 Å²	68	143.6 Å²	143.6	70%	0.701	85%	0.847	S	S	*	*			trans	112.8	100.9	142.3	0	0	0	0	0	117.9
145	R	40.2	Very low	40.4	Very low	251 Å²	251	146.2 Å²	146.2	95%	0.947	85%	0.851	S	S	*	*				-173.9	92.4	111.6	-112.1	142	73.1	-137.3	9.1	110.3	G147	R145-G147 PolarHBondContact O-N 2.92Å
146	G	32.7	Very low	40.1	Very low	81 Å²	81	138 Å²	138	84%	0.835	85%	0.845	S	S	*	*			trans	-81.2	100.1	164.3	0	0	0	0	0	109.6
147	G	36.6	Very low	39.8	Very low	76 Å²	76	136.7 Å²	136.7	78%	0.784	85%	0.85	S	S	*	*			trans	-82.1	113.7	167.5	0	0	0	0	0	110.1	R145	R145-G147 PolarHBondContact O-N 2.92Å
148	R	46.3	Very low	39.2	Very low	240 Å²	240	130.6 Å²	130.6	91%	0.906	84%	0.844	S	S	*	*			trans	-62.4	133.7	169.4	-63.4	167.8	158.4	-122.3	-3.4	110.2
149	R	40.4	Very low	39.2	Very low	255 Å²	255	129.6 Å²	129.6	96%	0.962	85%	0.847	S	S	*	*			trans	-146.8	135.5	135.7	-71.5	-161.9	176.2	-106.6	-2.2	109.6
150	A	40.4	Very low	39	Very low	97 Å²	97	130.7 Å²	130.7	80%	0.802	85%	0.849	S	S	*	*			trans	-104.6	157.2	-174.4	0	0	0	0	0	111.1
151	A	38.8	Very low	38.6	Very low	111 Å²	111	128.6 Å²	128.6	92%	0.917	84%	0.843	S	S	*	*			trans	70.9	128.1	145.4	0	0	0	0	0	120.4
152	G	33.4	Very low	38.9	Very low	79 Å²	79	124 Å²	124	81%	0.814	83%	0.83	S	S	*	*			trans	141.5	96.7	153.2	0	0	0	0	0	114.6
153	G	32.6	Very low	39.4	Very low	74 Å²	74	124.6 Å²	124.6	76%	0.763	83%	0.828	S	S	*	*			trans	-80.6	-163	155.1	0	0	0	0	0	110.9
154	P	49.2	Very low	38.9	Very low	116 Å²	116	124.4 Å²	124.4	75%	0.753	82%	0.82	S	S	*	*			cis	-135.4	172.6	3.4	39.2	-19.8	0	0	0	115.5
155	L	42.1	Very low	39.4	Very low	174 Å²	174	127.9 Å²	127.9	91%	0.911	82%	0.823	S	S	*	*			trans	28.4	119.5	139.8	-54	168.9	0	0	0	119.5
156	G	31.2	Very low	39.3	Very low	81 Å²	81	123.2 Å²	123.2	84%	0.835	82%	0.817	S	S	*	*			trans	-155.7	100.2	163.4	0	0	0	0	0	110.9
157	S	41.1	Very low	40.1	Very low	138 Å²	138	126.9 Å²	126.9	97%	0.965	81%	0.812	S	S	*	*			trans	-75	130.4	164.9	-169.6	0	0	0	0	108
158	G	33.7	Very low	40.3	Very low	74 Å²	74	129.3 Å²	129.3	76%	0.763	81%	0.807	S	S	*	*			trans	-176.3	91	-178.8	0	0	0	0	0	111
159	A	40.8	Very low	39.9	Very low	106 Å²	106	125.1 Å²	125.1	88%	0.876	80%	0.803	S	S	*	*			trans	-66.9	132.3	168	0	0	0	0	0	110.4
160	A	34	Very low	39.9	Very low	94 Å²	94	119.3 Å²	119.3	78%	0.777	79%	0.791	S	S	*	*			trans	-170.8	110.4	145.6	0	0	0	0	0	106.8
161	A	41	Very low	40.4	Very low	91 Å²	91	122.9 Å²	122.9	75%	0.752	79%	0.791	S	S	*	*			trans	-69.1	136.1	166.5	0	0	0	0	0	108.3
162	P	41.4	Very low	40.8	Very low	99 Å²	99	125.2 Å²	125.2	64%	0.643	78%	0.783	S	S	*	*			trans	-72.4	122.4	155.8	28.5	-27.9	0	0	0	108.1	D164	P162-D164 VanDerWaalsContact C-N 3.32Å; P162-D164 PolarHBondContact O-N 2.84Å
163	E	48.3	Very low	41.5	Very low	184 Å²	184	128.6 Å²	128.6	86%	0.86	78%	0.781	S	S	*	*			trans	-74	92.3	161.8	-58.6	-176.3	131	0	0	105.6	D165	E163-D165 PolarHBondContact O-N 3.36Å
164	D	39	Very low	42.1	Very low	123 Å²	123	131.6 Å²	131.6	66%	0.658	78%	0.779	S	S	*	*			trans	-84	94.7	167.8	-65.8	-50.5	0	0	0	106.8	P162 D166	P162-D164 VanDerWaalsContact C-N 3.32Å; P162-D164 PolarHBondContact O-N 2.84Å; D164-D166 VanDerWaalsContact C-N 3.28Å; D164-D166 PolarHBondContact O-N 2.76Å; D164-D166 VanDerWaalsContact O-N 3.13Å
165	D	44.9	Very low	42.1	Very low	141 Å²	141	131.5 Å²	131.5	75%	0.754	77%	0.769	S	S	*	*			trans	-62.4	92.1	154.4	-105.6	-67.9	0	0	0	107	E163 E167	E163-D165 PolarHBondContact O-N 3.36Å; D165-E167 PolarHBondContact O-N 3.11Å
166	D	37.9	Very low	42.2	Very low	154 Å²	154	128 Å²	128	82%	0.824	75%	0.754	S	S	*	*			trans	-85	88.2	164.5	-74.2	-55.6	0	0	0	107.7	D164	D164-D166 VanDerWaalsContact C-N 3.28Å; D164-D166 PolarHBondContact O-N 2.76Å; D164-D166 VanDerWaalsContact O-N 3.13Å
167	E	48	Very low	42.9	Very low	157 Å²	157	132.7 Å²	132.7	73%	0.734	75%	0.747	S	S	*	*			trans	-57.4	132.7	162	-82.2	164	109.8	0	0	110.5	D165	D165-E167 PolarHBondContact O-N 3.11Å
168	D	41.6	Very low	42.7	Very low	128 Å²	128	131.7 Å²	131.7	68%	0.684	73%	0.73	S	S	*	*			trans	52.6	83.7	147	-61.9	-48.7	0	0	0	118.8
169	D	37.1	Very low	43	Very low	152 Å²	152	133.7 Å²	133.7	81%	0.813	73%	0.727	S	S	*	*			trans	-101.7	73	148.9	-93.3	-59.9	0	0	0	108.7	E171	D169-E171 PolarHBondContact O-N 2.93Å
170	D	41.8	Very low	42.8	Very low	133 Å²	133	136.9 Å²	136.9	71%	0.711	72%	0.724	S	S	*	*			trans	-68.3	79	158.2	39.8	-77.1	0	0	0	109.8	E172	D170-E172 VanDerWaalsContact C-N 3.34Å; D170-E172 PolarHBondContact O-N 3.18Å
171	E	50.1	Low	43.3	Very low	172 Å²	172	136.8 Å²	136.8	80%	0.804	71%	0.714	S	S	*	*			trans	-64.1	95.8	171.1	-62.5	-153.5	123.7	0	0	110.2	D169 L173	D169-E171 PolarHBondContact O-N 2.93Å; E171-L173 PolarHBondContact O-N 3.28Å
172	E	47.4	Very low	43.4	Very low	159 Å²	159	139.1 Å²	139.1	74%	0.743	72%	0.722	S	S	*	*			trans	21.1	86.4	155.2	-150.7	-176.2	174.6	0	0	114.7	D170 L174	D170-E172 VanDerWaalsContact C-N 3.34Å; D170-E172 PolarHBondContact O-N 3.18Å; E172-L174 PolarHBondContact O-N 3.27Å
173	L	47.9	Very low	43.8	Very low	150 Å²	150	138.2 Å²	138.2	79%	0.785	73%	0.73	S	S	*	*			trans	-68	107.2	176.6	-152.5	117.7	0	0	0	109.8	E171 E175	E171-L173 PolarHBondContact O-N 3.28Å; L173-E175 VanDerWaalsContact C-N 3.32Å; L173-E175 HydrophobicContact CD2-CB 4.44Å; L173-E175 PolarHBondContact O-N 3.42Å
174	L	45.2	Very low	43.7	Very low	137 Å²	137	138.7 Å²	138.7	72%	0.717	72%	0.724	S	S	*	*			trans	-71.6	88.4	169.6	-64.4	177.4	0	0	0	109.6	E172 V176	E172-L174 PolarHBondContact O-N 3.27Å; L174-V176 PolarHBondContact O-N 3.03Å
175	E	48.8	Very low	43.5	Very low	115 Å²	115	141.5 Å²	141.5	54%	0.537	73%	0.733	S	S	.	*			trans	-75.8	104.1	173.7	-160.4	-175.7	170.9	0	0	109.7	L173 R177	L173-E175 VanDerWaalsContact C-N 3.32Å; L173-E175 HydrophobicContact CD2-CB 4.44Å; L173-E175 PolarHBondContact O-N 3.42Å; E175-R177 VanDerWaalsContact CD-NH2 3.28Å; E175-R177 HydrophobicContact CG-CG 4.07Å; E175-R177 PolarHBondContact O-N 3.1Å; E175-R177 VanDerWaalsContact O-N 3.1Å; E175-R177 IonicContact OE1-CZ 3.79Å; E175-R177 IonicContact OE1-NE 2.86Å; E175-R177 PolarHBondContact OE1-NE 3.29Å; E175-R177 IonicContact OE1-NH2 3.86Å; E175-R177 PolarHBondContact OE1-NH2 3.42Å; E175-R177 IonicContact OE2-CZ 3.32Å; E175-R177 IonicContact OE2-NE 3.16Å; E175-R177 PolarHBondContact OE2-NE 3.3Å; E175-R177 IonicContact OE2-NH2 2.67Å; E175-R177 PolarHBondContact OE2-NH2 3.15Å
176	V	44.4	Very low	43.5	Very low	100 Å²	100	140.3 Å²	140.3	61%	0.606	73%	0.726	S	S	*	*			trans	-76.8	93.7	171.8	-177.9	0	0	0	0	108.4	L174 W187	L174-V176 PolarHBondContact O-N 3.03Å; V176-W187 HydrophobicContact CG1-CE3 3.95Å; V176-W187 HydrophobicContact CG1-CH2 4.41Å; V176-W187 HydrophobicContact CG1-CZ3 3.45Å; V176-W187 VanDerWaalsContact CG1-CZ3 3.45Å
177	R	45.9	Very low	44	Very low	179 Å²	179	138.6 Å²	138.6	68%	0.675	71%	0.708	S	S	*	*			trans	-87.4	126.4	170.7	-69.6	-169.8	173.3	159.6	6.9	110.9	E175 V179	E175-R177 VanDerWaalsContact CD-NH2 3.28Å; E175-R177 HydrophobicContact CG-CG 4.07Å; E175-R177 PolarHBondContact O-N 3.1Å; E175-R177 VanDerWaalsContact O-N 3.1Å; E175-R177 IonicContact OE1-CZ 3.79Å; E175-R177 IonicContact OE1-NE 2.86Å; E175-R177 PolarHBondContact OE1-NE 3.29Å; E175-R177 IonicContact OE1-NH2 3.86Å; E175-R177 PolarHBondContact OE1-NH2 3.42Å; E175-R177 IonicContact OE2-CZ 3.32Å; E175-R177 IonicContact OE2-NE 3.16Å; E175-R177 PolarHBondContact OE2-NE 3.3Å; E175-R177 IonicContact OE2-NH2 2.67Å; E175-R177 PolarHBondContact OE2-NH2 3.15Å; R177-V179 PolarHBondContact O-N 2.71Å
178	L	36.6	Very low	44.4	Very low	117 Å²	117	140.6 Å²	140.6	61%	0.613	71%	0.709	S	S	*	*			trans	-68.5	106.7	168.6	-174.3	77.1	0	0	0	108.2	E180 W187	L178-E180 HydrophobicContact CD2-CG 4.13Å; L178-E180 HydrophobicContact CG-CG 4.33Å; L178-W187 HydrophobicContact CD1-CH2 3.88Å; L178-W187 HydrophobicContact CD1-CZ2 4.4Å
179	V	41.3	Very low	44.6	Very low	117 Å²	117	142.5 Å²	142.5	71%	0.709	72%	0.716	S	S	*	*			trans	-95.3	101.2	164.6	178.9	0	0	0	0	106.7	R177 T181	R177-V179 PolarHBondContact O-N 2.71Å; V179-T181 HydrophobicContact CG1-CG2 4.16Å; V179-T181 PolarHBondContact O-N 3.16Å
180	E	36.5	Very low	45.7	Very low	172 Å²	172	140.6 Å²	140.6	80%	0.804	71%	0.709	S	S	*	*			trans	-64.9	114.2	167.3	-80.3	174.8	101.6	0	0	108.6	L178	L178-E180 HydrophobicContact CD2-CG 4.13Å; L178-E180 HydrophobicContact CG-CG 4.33Å
181	T	43.7	Very low	46.2	Very low	93 Å²	93	139.7 Å²	139.7	57%	0.571	71%	0.711	S	S	*	*			trans	-114.8	138.2	159	52.9	0	0	0	0	107.6	V179 G183	V179-T181 HydrophobicContact CG1-CG2 4.16Å; V179-T181 PolarHBondContact O-N 3.16Å; T181-G183 PolarHBondContact O-N 3.44Å; T181-G183 VanDerWaalsContact O-N 3.13Å
182	P	44	Very low	46.1	Very low	140 Å²	140	136.1 Å²	136.1	91%	0.909	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	117.7	-175.8	25.8	-31.2	0	0	0	109.5
183	G	49.1	Very low	45.9	Very low	80 Å²	80	132.1 Å²	132.1	83%	0.825	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	112.2	0.8	161.2	0	0	0	0	0	118.9	T181	T181-G183 PolarHBondContact O-N 3.44Å; T181-G183 VanDerWaalsContact O-N 3.13Å
184	R	45.6	Very low	45.4	Very low	194 Å²	194	136.3 Å²	136.3	73%	0.732	72%	0.718	S	S	*	*			trans	-165	117	167.5	-138.5	165.7	170.7	-117.2	0.6	112.5	L186	R184-L186 PolarHBondContact O-N 2.99Å
185	E	36.3	Very low	45.2	Very low	181 Å²	181	134.5 Å²	134.5	85%	0.846	72%	0.722	S	S	*	*			trans	-69.2	94.4	170.7	-64.7	-174.3	123.8	0	0	109.6
186	L	45	Very low	44.7	Very low	117 Å²	117	134.1 Å²	134.1	61%	0.613	74%	0.739	S	S	*	*			trans	-121.4	105.6	174	-168.1	73.7	0	0	0	109.7	R184 R188	R184-L186 PolarHBondContact O-N 2.99Å; L186-R188 PolarHBondContact O-N 2.83Å; L186-R188 VanDerWaalsContact O-N 3.17Å
187	W	46.6	Very low	44.3	Very low	118 Å²	118	141.1 Å²	141.1	45%	0.447	75%	0.754	S	S	.	*			trans	-66.7	110.5	170.6	-61.5	94.2	0	0	0	109.2	I87 R91 V176 L178	I87-W187 HydrophobicContact CD1-CB 4.21Å; I87-W187 HydrophobicContact CD1-CG 3.99Å; R91-W187 VanDerWaalsContact NH2-CE2 3.29Å; V176-W187 HydrophobicContact CG1-CE3 3.95Å; V176-W187 HydrophobicContact CG1-CH2 4.41Å; V176-W187 HydrophobicContact CG1-CZ3 3.45Å; V176-W187 VanDerWaalsContact CG1-CZ3 3.45Å; L178-W187 HydrophobicContact CD1-CH2 3.88Å; L178-W187 HydrophobicContact CD1-CZ2 4.4Å
188	R	56.6	Low	43.8	Very low	199 Å²	199	136.2 Å²	136.2	75%	0.751	76%	0.759	S	S	*	*			trans	-107.6	119.9	172.8	-175.3	-171.7	-73.2	-108.7	3.9	108.8	L186 V190	L186-R188 PolarHBondContact O-N 2.83Å; L186-R188 VanDerWaalsContact O-N 3.17Å; R188-V190 HydrophobicContact CG-CG2 3.97Å; R188-V190 PolarHBondContact O-N 2.96Å
189	M	47.6	Very low	43.6	Very low	167 Å²	167	139.9 Å²	139.9	82%	0.823	77%	0.773	S	S	*	*			trans	-72.3	120.9	164.1	-73.9	156.6	70.5	0	0	108.2
190	V	58.3	Low	43.2	Very low	112 Å²	112	138.5 Å²	138.5	68%	0.679	77%	0.774	S	S	*	*			trans	-113.2	121.5	179.2	-179.6	0	0	0	0	108.2	R188	R188-V190 HydrophobicContact CG-CG2 3.97Å; R188-V190 PolarHBondContact O-N 2.96Å
191	P	53.8	Low	43.2	Very low	115 Å²	115	139.4 Å²	139.4	75%	0.747	78%	0.778	S	S	*	*			trans	-67.8	140.1	173.1	25.1	-29.9	0	0	0	110.4	G193	P191-G193 PolarHBondContact O-N 3.4Å; P191-G193 VanDerWaalsContact O-N 3.11Å
192	A	46.7	Very low	42.7	Very low	96 Å²	96	145 Å²	145	79%	0.793	79%	0.789	S	S	*	*	S	Bend	trans	-62	114.2	175.7	0	0	0	0	0	109.8
193	G	44	Very low	42.3	Very low	75 Å²	75	142.5 Å²	142.5	77%	0.773	78%	0.78	S	S	*	*			trans	77.4	98.1	160.7	0	0	0	0	0	116.6	P191	P191-G193 PolarHBondContact O-N 3.4Å; P191-G193 VanDerWaalsContact O-N 3.11Å
194	R	37.3	Very low	41.6	Very low	239 Å²	239	146.8 Å²	146.8	90%	0.902	78%	0.778	S	S	*	*				-149.3	109.8	124.4	-156.3	167.2	-176.6	-115.9	1.6	109.5	A196	R194-A196 PolarHBondContact O-N 3.31Å
195	A	40.4	Very low	41.1	Very low	98 Å²	98	140.9 Å²	140.9	81%	0.81	78%	0.778	S	S	*	*			trans	-55.6	106.5	165.8	0	0	0	0	0	108.6	R197	A195-R197 PolarHBondContact O-N 3.13Å
196	A	39.2	Very low	41.7	Very low	107 Å²	107	138 Å²	138	88%	0.884	78%	0.775	S	S	*	*			trans	-86.4	97.9	165.7	0	0	0	0	0	107.7	R194	R194-A196 PolarHBondContact O-N 3.31Å
197	R	36.5	Very low	41.2	Very low	248 Å²	248	138.2 Å²	138.2	94%	0.936	79%	0.786	S	S	*	*			trans	-138.2	121	163.1	-157.6	-175	-173.2	-174.7	2.2	103.6	A195	A195-R197 PolarHBondContact O-N 3.13Å
198	G	34.9	Very low	40.6	Very low	75 Å²	75	135.9 Å²	135.9	77%	0.773	80%	0.799	S	S	*	*			cis	160.7	124.6	8.9	0	0	0	0	0	102.6
199	Q	32	Very low	39.6	Very low	195 Å²	195	136 Å²	136	91%	0.911	81%	0.808	S	S	*	*			trans	-85	151.1	173.1	-74.7	-170.2	26.7	0	0	110.4
200	A	32.9	Very low	38.9	Very low	88 Å²	88	131.8 Å²	131.8	73%	0.727	81%	0.807	S	S	*	*			trans	71.3	145.9	160.3	0	0	0	0	0	115.8
201	E	36.2	Very low	37.7	Very low	191 Å²	191	131.3 Å²	131.3	89%	0.893	82%	0.816	S	S	*	*			cis	-163.4	171.7	0.4	-126.7	-172.5	117.4	0	0	108.9
202	R	34.4	Very low	36.8	Very low	211 Å²	211	130.5 Å²	130.5	80%	0.796	82%	0.819	S	S	*	*			trans	-85.7	134.7	-175.6	160.7	-169.3	167.6	-116.3	1.6	112.2
203	A	35.3	Very low	36.2	Very low	87 Å²	87	130.7 Å²	130.7	72%	0.719	82%	0.82	S	S	*	*			trans	-179.6	115.6	146.4	0	0	0	0	0	109.9
204	Q	34.9	Very low	35.7	Very low	169 Å²	169	131.6 Å²	131.6	79%	0.79	82%	0.82	S	S	*	*				59.1	111.9	100.8	-73.7	172.6	30.4	0	0	115.3
205	G	33.9	Very low	35.6	Very low	71 Å²	71	125 Å²	125	73%	0.732	82%	0.817	S	S	*	*			trans	-68.8	173	159.4	0	0	0	0	0	111.7
206	P	50.1	Low	35.4	Very low	121 Å²	121	125.1 Å²	125.1	79%	0.786	82%	0.818	S	S	*	*				-151.4	172.2	67.2	37.7	-16.8	0	0	0	117.3
207	S	33.1	Very low	35.6	Very low	120 Å²	120	125.4 Å²	125.4	84%	0.839	81%	0.813	S	S	*	*			trans	57.5	136.4	141.3	56.3	0	0	0	0	123
208	G	33.6	Very low	36.3	Very low	70 Å²	70	119.5 Å²	119.5	72%	0.722	81%	0.807	S	S	*	*			trans	127.5	94.8	136.7	0	0	0	0	0	118.2
209	E	35.8	Very low	36.5	Very low	201 Å²	201	122.2 Å²	122.2	94%	0.939	81%	0.809	S	S	*	*			trans	32.3	125.4	130.1	-50.1	-173.6	123.7	0	0	121.7
210	G	33.3	Very low	37.4	Very low	78 Å²	78	118.3 Å²	118.3	80%	0.804	80%	0.801	S	S	*	*				87.9	116.2	118.4	0	0	0	0	0	121.6
211	A	33.6	Very low	37.5	Very low	103 Å²	103	119.4 Å²	119.4	85%	0.851	80%	0.803	S	S	*	*			trans	83.7	115.6	137.5	0	0	0	0	0	122.6
212	A	33.8	Very low	37.7	Very low	98 Å²	98	118.7 Å²	118.7	81%	0.81	80%	0.799	S	S	*	*				81.3	126	122.9	0	0	0	0	0	123.1
213	A	34.8	Very low	38.1	Very low	100 Å²	100	115.9 Å²	115.9	83%	0.826	80%	0.8	S	S	*	*				100.2	136.3	127	0	0	0	0	0	121.8
214	A	34.2	Very low	38.8	Very low	94 Å²	94	121.2 Å²	121.2	78%	0.777	81%	0.81	S	S	*	*			trans	70.9	108.4	149.7	0	0	0	0	0	117.7
215	A	34.6	Very low	39.2	Very low	101 Å²	101	121.1 Å²	121.1	84%	0.835	81%	0.81	S	S	*	*				76.5	114.9	74.6	0	0	0	0	0	113.3
216	A	36.1	Very low	39.3	Very low	100 Å²	100	124.6 Å²	124.6	83%	0.826	81%	0.811	S	S	*	*				156.5	117.3	124.1	0	0	0	0	0	110.3
217	S	44.1	Very low	38.9	Very low	113 Å²	113	127.3 Å²	127.3	79%	0.79	81%	0.813	S	S	*	*			trans	-61	162.2	155.4	-54.2	0	0	0	0	110.2
218	P	49.9	Very low	39.6	Very low	123 Å²	123	130.5 Å²	130.5	80%	0.799	82%	0.815	S	S	*	*				-143.3	136.4	113.7	31.7	-15.5	0	0	0	114.4
219	T	40.9	Very low	40.2	Very low	133 Å²	133	136.1 Å²	136.1	82%	0.816	82%	0.822	S	S	*	*			trans	-99.9	144.1	146.1	49.8	0	0	0	0	107.4
220	P	50.8	Low	40.7	Very low	113 Å²	113	135.6 Å²	135.6	73%	0.734	82%	0.82	S	S	*	*				-142.2	144	105.1	17.7	5.8	0	0	0	112
221	S	34.7	Very low	41.6	Very low	110 Å²	110	140.5 Å²	140.5	77%	0.769	82%	0.821	S	S	*	*				80.5	148.9	75.6	-71.1	0	0	0	0	115.6
222	E	40.2	Very low	41.8	Very low	176 Å²	176	143.7 Å²	143.7	82%	0.822	82%	0.819	S	S	*	*			trans	93.4	99.4	167.7	-49.9	-173.5	135.2	0	0	113.9
223	D	42.8	Very low	42	Very low	153 Å²	153	144 Å²	144	82%	0.818	82%	0.822	S	S	*	*				67.2	122.1	73.9	-70.7	-64.3	0	0	0	112.5
224	E	49.5	Very low	41.8	Very low	199 Å²	199	144.3 Å²	144.3	93%	0.93	81%	0.813	S	S	*	*			trans	173.9	135.7	140.1	-83.5	-98.4	110.3	0	0	109.7
225	E	44	Very low	41.8	Very low	167 Å²	167	144.6 Å²	144.6	78%	0.78	82%	0.815	S	S	*	*			trans	-89.8	177.8	-175.5	-50.1	-169.8	112.5	0	0	113.2
226	L	36.1	Very low	41.9	Very low	144 Å²	144	143.7 Å²	143.7	75%	0.754	81%	0.808	S	S	*	*			trans	74.6	140.6	150.1	-67.3	165.5	0	0	0	116
227	E	40.4	Very low	42.2	Very low	177 Å²	177	146.9 Å²	146.9	83%	0.827	81%	0.806	S	S	*	*			cis	-148.2	171.6	14.9	-64.5	-171.9	138.4	0	0	110.8
228	E	48.4	Very low	42	Very low	188 Å²	188	150 Å²	150	88%	0.879	81%	0.808	S	S	*	*			trans	-65.8	143.5	170.6	-55.7	172.4	149.5	0	0	112
229	E	45.2	Very low	41.3	Very low	188 Å²	188	147.4 Å²	147.4	88%	0.879	80%	0.804	S	S	*	*			trans	-137.4	120	147.9	-74.8	-150.4	139.3	0	0	109.9
230	E	48.2	Very low	41.4	Very low	189 Å²	189	150.4 Å²	150.4	88%	0.883	81%	0.809	S	S	*	*			trans	-74.3	132.2	159.1	-66.9	-174.5	126.4	0	0	108.5
231	E	51	Low	41.1	Very low	181 Å²	181	153.8 Å²	153.8	85%	0.846	82%	0.815	S	S	*	*			trans	-133.1	111.4	157.6	-83.9	-85.8	138.1	0	0	108.8
232	E	37.9	Very low	41.4	Very low	170 Å²	170	157.2 Å²	157.2	79%	0.794	82%	0.819	S	S	*	*			trans	-66.6	132.6	165.4	175.3	-173.6	142.6	0	0	110.2	T234	E232-T234 HydrophobicContact CG-CG2 4.36Å
233	A	38.7	Very low	41.1	Very low	105 Å²	105	154.7 Å²	154.7	87%	0.868	82%	0.816	S	S	*	*			trans	-144.6	126.7	160.7	0	0	0	0	0	111.7
234	T	29.6	Very low	40.8	Very low	107 Å²	107	153.7 Å²	153.7	66%	0.656	82%	0.815	S	S	*	*			trans	-96.3	158	-166.9	55.7	0	0	0	0	113.4	E232	E232-T234 HydrophobicContact CG-CG2 4.36Å
235	A	34.3	Very low	40.1	Very low	99 Å²	99	148.5 Å²	148.5	82%	0.818	81%	0.806	S	S	*	*			trans	65.4	153.6	146.2	0	0	0	0	0	118.5
236	A	36.3	Very low	39.8	Very low	83 Å²	83	147 Å²	147	69%	0.686	81%	0.813	S	S	*	*			cis	-178.1	168.6	-15.4	0	0	0	0	0	106.9
237	E	43.6	Very low	39.6	Very low	167 Å²	167	143.1 Å²	143.1	78%	0.78	81%	0.809	S	S	*	*			trans	70.3	141.4	157.6	-74.8	-70.1	144.5	0	0	116.6
238	E	38.8	Very low	40	Very low	177 Å²	177	143.7 Å²	143.7	83%	0.827	81%	0.811	S	S	*	*			cis	-148.3	156.3	24.2	-60.5	-177	153.1	0	0	106.8
239	G	35	Very low	39.7	Very low	70 Å²	70	144 Å²	144	72%	0.722	81%	0.813	S	S	*	*			cis	99.5	72.8	23.9	0	0	0	0	0	111.4
240	E	42.8	Very low	39.5	Very low	196 Å²	196	140.6 Å²	140.6	92%	0.916	81%	0.81	S	S	*	*			trans	-153.8	133.5	154.1	51.2	-168.3	145	0	0	114.4
241	E	45.3	Very low	39.3	Very low	183 Å²	183	140 Å²	140	86%	0.855	81%	0.812	S	S	*	*			trans	-94.8	144	179.7	57.9	-160.5	113.7	0	0	109.7
242	E	41.1	Very low	38.5	Very low	183 Å²	183	134.9 Å²	134.9	86%	0.855	81%	0.808	S	S	*	*			trans	-155.5	123.3	145.8	-148.6	-176	107.3	0	0	112.2
243	T	34.8	Very low	38.7	Very low	123 Å²	123	136.9 Å²	136.9	76%	0.755	81%	0.814	S	S	*	*			trans	-101.2	140.6	169.8	57	0	0	0	0	109
244	V	35.2	Very low	38.8	Very low	132 Å²	132	138.7 Å²	138.7	80%	0.8	81%	0.808	S	S	*	*			trans	162	158.5	146.4	-80.8	0	0	0	0	107.4
245	A	36.3	Very low	39.2	Very low	90 Å²	90	138.5 Å²	138.5	74%	0.744	81%	0.811	S	S	*	*			cis	-169.6	153	-25	0	0	0	0	0	104.4
246	S	36.6	Very low	39.3	Very low	134 Å²	134	145 Å²	145	94%	0.937	82%	0.815	S	S	*	*			trans	-57.8	140.8	169.9	-169.5	0	0	0	0	111.8
247	G	32	Very low	39.6	Very low	64 Å²	64	148 Å²	148	66%	0.66	82%	0.818	S	S	*	*			trans	-171.9	109.7	174.6	0	0	0	0	0	113
248	E	48.9	Very low	40.1	Very low	188 Å²	188	145.5 Å²	145.5	88%	0.879	82%	0.817	S	S	*	*			trans	-60.1	140.8	169.9	61	-153.1	93.8	0	0	113.9
249	E	41.6	Very low	41	Very low	195 Å²	195	142.6 Å²	142.6	91%	0.911	81%	0.813	S	S	*	*			trans	-146.4	103.9	151.1	52.4	-165.3	99.2	0	0	111.1
250	S	41.4	Very low	41.2	Very low	117 Å²	117	142.8 Å²	142.8	82%	0.818	82%	0.815	S	S	*	*			trans	-74.6	142.2	159.3	-161.9	0	0	0	0	108.5
251	L	44.4	Very low	41.7	Very low	177 Å²	177	139.5 Å²	139.5	93%	0.927	81%	0.811	S	S	*	*			trans	158	109.5	153.8	-81.9	-168.1	0	0	0	105
252	G	33.5	Very low	41.5	Very low	73 Å²	73	135.6 Å²	135.6	75%	0.753	81%	0.81	S	S	*	*			cis	125.7	79	49.3	0	0	0	0	0	107.9
253	F	41.5	Very low	41.5	Very low	212 Å²	212	130.3 Å²	130.3	93%	0.93	81%	0.805	S	S	*	*			trans	-106.3	114.1	164.7	-168.5	-101	0	0	0	109.2
254	L	41	Very low	42.1	Very low	143 Å²	143	132.4 Å²	132.4	75%	0.749	81%	0.81	S	S	*	*			trans	-75.5	136.7	-165.2	-73.9	155.9	0	0	0	113
255	S	39.5	Very low	42.4	Very low	102 Å²	102	132.5 Å²	132.5	71%	0.713	81%	0.806	S	S	*	*			trans	77.2	112.1	130.6	-70.1	0	0	0	0	121.4
256	R	35.9	Very low	42.6	Very low	237 Å²	237	134.8 Å²	134.8	89%	0.894	82%	0.816	S	S	*	*				103.5	109.1	108.3	-166.5	171.6	-175.3	-123	2.6	118.3
257	L	43.3	Very low	43.1	Very low	145 Å²	145	132.3 Å²	132.3	76%	0.759	80%	0.798	S	S	*	*			trans	-74.1	159.4	161.9	-157.8	73.9	0	0	0	111.3
258	P	52.4	Low	43.9	Very low	115 Å²	115	133.8 Å²	133.8	75%	0.747	80%	0.804	S	S	*	*				-145.7	177.7	100.4	32.5	-11.2	0	0	0	115.1
259	P	59.7	Low	43.6	Very low	115 Å²	115	132.8 Å²	132.8	75%	0.747	80%	0.804	S	S	*	*			trans	-116.8	166	-146.9	41.8	-32.9	0	0	0	118.4
260	G	37.6	Very low	43.8	Very low	75 Å²	75	129.8 Å²	129.8	77%	0.773	79%	0.794	S	S	*	*			trans	95.4	168.8	149.1	0	0	0	0	0	118.2
261	P	52.9	Low	44.2	Very low	126 Å²	126	135.7 Å²	135.7	82%	0.818	80%	0.798	S	S	*	*			cis	-135.8	168.9	-20	39.9	-22.2	0	0	0	115.5
262	A	41.7	Very low	44.2	Very low	101 Å²	101	134.5 Å²	134.5	84%	0.835	79%	0.793	S	S	*	*			trans	47.6	120.9	144.1	0	0	0	0	0	122.8
263	G	41.8	Very low	45.4	Very low	73 Å²	73	136.2 Å²	136.2	75%	0.753	79%	0.791	S	S	*	*				97.4	157.2	129.9	0	0	0	0	0	117.6
264	L	47	Very low	45.7	Very low	166 Å²	166	131.8 Å²	131.8	87%	0.869	78%	0.777	S	S	*	*			trans	104.7	81.2	168.4	-49.3	179.3	0	0	0	116.3
265	D	41.1	Very low	46.2	Very low	134 Å²	134	133.7 Å²	133.7	72%	0.717	79%	0.787	S	S	*	*				12.7	115.5	125.7	-151.1	-25.6	0	0	0	117	S267	D265-S267 WeakPolarHBondContact OD1-CB 3.5Å; D265-S267 PolarHBondContact OD1-N 3.33Å; D265-S267 VanDerWaalsContact OD1-N 3.16Å; D265-S267 PolarHBondContact OD1-OG 3.17Å
266	C	40.7	Very low	46.5	Very low	139 Å²	139	136.6 Å²	136.6	94%	0.939	79%	0.789	S	S	*	*			trans	-105	70.4	164.5	-64.4	0	0	0	0	109
267	S	48.1	Very low	47.4	Very low	82 Å²	82	130.8 Å²	130.8	57%	0.573	78%	0.782	S	S	*	*			trans	-122.2	137.3	158.2	55.6	0	0	0	0	108.9	D265	D265-S267 WeakPolarHBondContact OD1-CB 3.5Å; D265-S267 PolarHBondContact OD1-N 3.33Å; D265-S267 VanDerWaalsContact OD1-N 3.16Å; D265-S267 PolarHBondContact OD1-OG 3.17Å
268	A	48.2	Very low	48	Very low	94 Å²	94	129.2 Å²	129.2	78%	0.777	78%	0.78	S	S	*	*			trans	74.1	99.6	175.4	0	0	0	0	0	116.7
269	L	42.7	Very low	47.3	Very low	167 Å²	167	130 Å²	130	87%	0.874	79%	0.789	S	S	*	*				-168.6	129.9	121.4	-69.9	-166.8	0	0	0	103.8
270	D	45.3	Very low	46.4	Very low	132 Å²	132	127.7 Å²	127.7	71%	0.706	79%	0.786	S	S	*	*			cis	-162.4	135.6	33.4	-165.8	-123	0	0	0	108.1
271	R	49.9	Very low	46.7	Very low	241 Å²	241	129.8 Å²	129.8	91%	0.909	78%	0.783	S	S	*	*			trans	-94.8	109.6	173.5	-109.4	175.5	143.2	177.5	-5.9	105.7	P273	R271-P273 WeakPolarHBondContact O-CD 3.47Å
272	D	44.3	Very low	46.8	Very low	153 Å²	153	129.5 Å²	129.5	82%	0.818	79%	0.785	S	S	*	*			trans	-83.4	124.8	165	-119.4	-38.4	0	0	0	109.6
273	P	58.3	Low	47.9	Very low	108 Å²	108	130.7 Å²	130.7	70%	0.701	77%	0.773	S	S	*	*			trans	-97.3	138.6	178.2	35.1	-28.7	0	0	0	112.9	R271	R271-P273 WeakPolarHBondContact O-CD 3.47Å
274	D	47.8	Very low	48.1	Very low	120 Å²	120	134.9 Å²	134.9	64%	0.642	77%	0.771	S	S	*	*			trans	91.1	89.7	144.8	-127.5	-17	0	0	0	119.6	Q276	D274-Q276 WeakPolarHBondContact OD1-CG 3.47Å
275	L	51.5	Low	48.5	Very low	183 Å²	183	133 Å²	133	96%	0.958	76%	0.757	S	S	*	*				-132.1	134.1	122.8	-72	-179.7	0	0	0	108.9
276	Q	46.6	Very low	48.9	Very low	163 Å²	163	134 Å²	134	76%	0.762	76%	0.756	S	S	*	*			trans	-77.3	168.9	-155.9	-73.4	-171.5	-10.9	0	0	117.6	D274	D274-Q276 WeakPolarHBondContact OD1-CG 3.47Å
277	P	53.7	Low	49.9	Very low	115 Å²	115	131.6 Å²	131.6	75%	0.747	74%	0.738	S	S	*	*			trans	-111	-151.4	-159.1	42	-28	0	0	0	112.8
278	P	55.9	Low	50.3	Low	111 Å²	111	134.8 Å²	134.8	72%	0.721	75%	0.749	S	S	*	*				-125.8	144.3	-52.4	26.8	-7.8	0	0	0	112.1
279	S	38	Very low	50.6	Low	132 Å²	132	139.2 Å²	139.2	92%	0.923	75%	0.747	S	S	*	*			trans	-170.9	140.2	149.3	37.7	0	0	0	0	111.8
280	G	40.4	Very low	51.4	Low	66 Å²	66	135.8 Å²	135.8	68%	0.68	74%	0.736	S	S	*	*			trans	103.3	90.6	164.5	0	0	0	0	0	113.9
281	T	45.4	Very low	52.3	Low	119 Å²	119	132 Å²	132	73%	0.73	72%	0.717	S	S	*	*			trans	26.1	123.1	135.6	132.7	0	0	0	0	116.3	H283	T281-H283 PolarHBondContact O-N 3.45Å
282	S	53.6	Low	53	Low	121 Å²	121	125.6 Å²	125.6	85%	0.846	71%	0.707	S	S	*	*			trans	-50.6	88.9	163.5	56	0	0	0	0	110.2	F284	S282-F284 PolarHBondContact O-N 3.26Å
283	H	65.5	Low	53.8	Low	125 Å²	125	124.9 Å²	124.9	58%	0.579	70%	0.699	S	S	*	*			trans	-78	79.9	176	-163.6	42.7	0	0	0	106.3	T281 E285	T281-H283 PolarHBondContact O-N 3.45Å; H283-E285 IonicContact CD2-OE1 3.69Å; H283-E285 IonicContact CD2-OE2 2.96Å; H283-E285 PolarHBondContact CD2-OE2 3.13Å; H283-E285 IonicContact CE1-OE1 3.56Å; H283-E285 VanDerWaalsContact NE2-CG 3.29Å; H283-E285 WeakPolarHBondContact NE2-CG 3.32Å; H283-E285 IonicContact NE2-OE1 2.74Å; H283-E285 PolarHBondContact NE2-OE1 2.66Å; H283-E285 IonicContact NE2-OE2 2.9Å; H283-E285 PolarHBondContact NE2-OE2 3.21Å; H283-E285 PolarHBondContact O-N 3.2Å
284	F	46.6	Very low	54.1	Low	162 Å²	162	122.5 Å²	122.5	71%	0.711	68%	0.682	S	S	*	*			trans	-71.5	74.9	159.2	-165.7	-90.3	0	0	0	106.1	S282 F286	S282-F284 PolarHBondContact O-N 3.26Å; F284-F286 AromaticContact CD1-CD2 3.77Å; F284-F286 HydrophobicContact CD1-CD2 3.77Å; F284-F286 AromaticContact CD1-CE2 3.83Å; F284-F286 HydrophobicContact CD1-CE2 3.83Å; F284-F286 AromaticContact CE1-CD2 3.57Å; F284-F286 HydrophobicContact CE1-CD2 3.57Å; F284-F286 HydrophobicContact CE1-CE1 4.33Å; F284-F286 AromaticContact CE1-CE2 3.33Å; F284-F286 HydrophobicContact CE1-CE2 3.33Å; F284-F286 HydrophobicContact CE1-CG 4.21Å; F284-F286 AromaticContact CE1-CZ 3.74Å; F284-F286 HydrophobicContact CE1-CZ 3.74Å; F284-F286 HydrophobicContact CZ-CE2 4.48Å; F284-F286 PolarHBondContact O-N 3.33Å; F284-F286 VanDerWaalsContact O-N 3.13Å
285	E	54.5	Low	55.1	Low	126 Å²	126	120.4 Å²	120.4	59%	0.589	67%	0.674	S	S	*	*			trans	-73.9	99.5	173.3	-156.4	164.6	-149.8	0	0	104.9	H283 P287	H283-E285 IonicContact CD2-OE1 3.69Å; H283-E285 IonicContact CD2-OE2 2.96Å; H283-E285 PolarHBondContact CD2-OE2 3.13Å; H283-E285 IonicContact CE1-OE1 3.56Å; H283-E285 VanDerWaalsContact NE2-CG 3.29Å; H283-E285 WeakPolarHBondContact NE2-CG 3.32Å; H283-E285 IonicContact NE2-OE1 2.74Å; H283-E285 PolarHBondContact NE2-OE1 2.66Å; H283-E285 IonicContact NE2-OE2 2.9Å; H283-E285 PolarHBondContact NE2-OE2 3.21Å; H283-E285 PolarHBondContact O-N 3.2Å; E285-P287 WeakPolarHBondContact O-CD 3.36Å; E285-P287 VanDerWaalsContact O-N 3.12Å
286	F	50.2	Low	55.9	Low	156 Å²	156	118.8 Å²	118.8	68%	0.684	66%	0.661	S	S	*	*			trans	-55.3	118.5	157.7	-93.2	-85.2	0	0	0	104.9	F284 D288	F284-F286 AromaticContact CD1-CD2 3.77Å; F284-F286 HydrophobicContact CD1-CD2 3.77Å; F284-F286 AromaticContact CD1-CE2 3.83Å; F284-F286 HydrophobicContact CD1-CE2 3.83Å; F284-F286 AromaticContact CE1-CD2 3.57Å; F284-F286 HydrophobicContact CE1-CD2 3.57Å; F284-F286 HydrophobicContact CE1-CE1 4.33Å; F284-F286 AromaticContact CE1-CE2 3.33Å; F284-F286 HydrophobicContact CE1-CE2 3.33Å; F284-F286 HydrophobicContact CE1-CG 4.21Å; F284-F286 AromaticContact CE1-CZ 3.74Å; F284-F286 HydrophobicContact CE1-CZ 3.74Å; F284-F286 HydrophobicContact CZ-CE2 4.48Å; F284-F286 PolarHBondContact O-N 3.33Å; F284-F286 VanDerWaalsContact O-N 3.13Å; F286-D288 PolarHBondContact O-N 3.49Å
287	P	62.2	Low	56.8	Low	88 Å²	88	117.1 Å²	117.1	57%	0.571	66%	0.655	S	S	*	*			trans	-53.6	122.2	170.8	-19.9	31.7	0	0	0	105.5	E285 Y289	E285-P287 WeakPolarHBondContact O-CD 3.36Å; E285-P287 VanDerWaalsContact O-N 3.12Å; P287-Y289 HydrophobicContact CB-CD2 4.38Å; P287-Y289 HydrophobicContact CB-CE2 4.29Å; P287-Y289 WeakPolarHBondContact O-CD2 3.21Å; P287-Y289 PolarHBondContact O-N 3.05Å
288	D	55.2	Low	57.4	Low	148 Å²	148	118.3 Å²	118.3	79%	0.791	65%	0.653	S	S	*	*			trans	-55	90.5	176.9	-73	-47.8	0	0	0	108.6	F286 C290	F286-D288 PolarHBondContact O-N 3.49Å; D288-C290 PolarHBondContact O-N 3.48Å; D288-C290 VanDerWaalsContact O-N 3.17Å
289	Y	55.3	Low	57.8	Low	188 Å²	188	116.9 Å²	116.9	74%	0.737	65%	0.651	S	S	*	*			trans	-77.2	21	164.5	-83.7	-80.3	0	0	0	110.4	P287 T291	P287-Y289 HydrophobicContact CB-CD2 4.38Å; P287-Y289 HydrophobicContact CB-CE2 4.29Å; P287-Y289 WeakPolarHBondContact O-CD2 3.21Å; P287-Y289 PolarHBondContact O-N 3.05Å; Y289-T291 PolarHBondContact O-N 3.42Å
290	C	59.4	Low	58.7	Low	95 Å²	95	112.2 Å²	112.2	64%	0.642	62%	0.624	S	S	*	*			trans	-79.8	69.2	160.3	-93.9	0	0	0	0	108.8	D288	D288-C290 PolarHBondContact O-N 3.48Å; D288-C290 VanDerWaalsContact O-N 3.17Å
291	T	64	Low	60	Low	53 Å²	53	115.1 Å²	115.1	33%	0.325	62%	0.624	S	S	.	*			trans	-66.5	146.8	161.6	56.7	0	0	0	0	108.4	Y289 E293 V294 T295	Y289-T291 PolarHBondContact O-N 3.42Å; T291-E293 PolarHBondContact O-N 2.97Å; T291-E293 VanDerWaalsContact O-N 3.09Å; T291-V294 PolarHBondContact O-N 3.07Å; T291-V294 VanDerWaalsContact OG1-CG2 3.32Å; T291-V294 WeakPolarHBondContact OG1-CG2 3.35Å; T291-T295 PolarHBondContact O-N 3.11Å
292	P	65.3	Low	60.7	Low	105 Å²	105	119.8 Å²	119.8	68%	0.682	63%	0.628	S	S	*	*	H	α-helix	trans	-56.8	-27.1	178	21	-31.5	0	0	0	112.2	T295 E296	P292-T295 PolarHBondContact O-N 2.9Å; P292-E296 PolarHBondContact O-N 3.43Å
293	E	59.6	Low	60.9	Low	139 Å²	139	123.8 Å²	123.8	65%	0.65	63%	0.625	S	S	*	*	H	α-helix	trans	-66.6	-37.8	176	-64.3	164.2	150.8	0	0	112.9	T291 E296 M297	T291-E293 PolarHBondContact O-N 2.97Å; T291-E293 VanDerWaalsContact O-N 3.09Å; E293-E296 PolarHBondContact O-N 2.94Å; E293-M297 WeakPolarHBondContact O-CG 3.29Å; E293-M297 PolarHBondContact O-N 3.12Å
294	V	65.9	Low	60.5	Low	58 Å²	58	123 Å²	123	35%	0.352	63%	0.63	S	S	.	*	H	α-helix	trans	-73.9	-37.9	177.1	172.2	0	0	0	0	110.5	T291 E296 M297 I298	T291-V294 PolarHBondContact O-N 3.07Å; T291-V294 VanDerWaalsContact OG1-CG2 3.32Å; T291-V294 WeakPolarHBondContact OG1-CG2 3.35Å; V294-E296 VanDerWaalsContact C-N 3.33Å; V294-E296 PolarHBondContact O-N 3.4Å; V294-M297 PolarHBondContact O-N 3.27Å; V294-I298 HydrophobicContact CG1-CD1 3.71Å; V294-I298 HydrophobicContact CG1-CG1 4.48Å; V294-I298 WeakPolarHBondContact O-CD1 3.17Å; V294-I298 WeakPolarHBondContact O-CG1 3.44Å; V294-I298 PolarHBondContact O-N 3.01Å; V294-I298 VanDerWaalsContact O-N 3.12Å
295	T	68.9	Low	61.3	Low	76 Å²	76	120.3 Å²	120.3	47%	0.466	63%	0.632	S	S	.	*	H	α-helix	trans	-62.1	-40.4	173.1	-56.5	0	0	0	0	111.4	T291 P292 I298 A299	T291-T295 PolarHBondContact O-N 3.11Å; P292-T295 PolarHBondContact O-N 2.9Å; T295-I298 PolarHBondContact O-N 3.48Å; T295-A299 WeakPolarHBondContact O-CB 3.21Å; T295-A299 PolarHBondContact O-N 3.49Å
296	E	67.1	Low	61.7	Low	149 Å²	149	117.4 Å²	117.4	70%	0.696	63%	0.625	S	S	*	*	H	α-helix	trans	-66.6	-37.9	174.2	-105.3	-174.4	153.9	0	0	112.9	P292 E293 V294 I298 A299 G300	P292-E296 PolarHBondContact O-N 3.43Å; E293-E296 PolarHBondContact O-N 2.94Å; V294-E296 VanDerWaalsContact C-N 3.33Å; V294-E296 PolarHBondContact O-N 3.4Å; E296-I298 VanDerWaalsContact C-N 3.31Å; E296-I298 PolarHBondContact O-N 3.42Å; E296-A299 PolarHBondContact O-N 2.96Å; E296-G300 PolarHBondContact O-N 3.47Å
297	M	65.5	Low	62.1	Low	127 Å²	127	117.6 Å²	117.6	63%	0.626	63%	0.632	S	S	*	*	H	α-helix	trans	-64.4	-35.3	177.2	-84.9	-178	54.3	0	0	113.3	E293 V294 W302	E293-M297 WeakPolarHBondContact O-CG 3.29Å; E293-M297 PolarHBondContact O-N 3.12Å; V294-M297 PolarHBondContact O-N 3.27Å; M297-W302 PolarHBondContact O-NE1 3.23Å
298	I	67.1	Low	62	Low	140 Å²	140	116.4 Å²	116.4	72%	0.718	63%	0.629	S	S	*	*	H	α-helix	trans	-84.3	-29	-179.8	-54.6	159.7	0	0	0	110.8	V294 T295 E296	V294-I298 HydrophobicContact CG1-CD1 3.71Å; V294-I298 HydrophobicContact CG1-CG1 4.48Å; V294-I298 WeakPolarHBondContact O-CD1 3.17Å; V294-I298 WeakPolarHBondContact O-CG1 3.44Å; V294-I298 PolarHBondContact O-N 3.01Å; V294-I298 VanDerWaalsContact O-N 3.12Å; T295-I298 PolarHBondContact O-N 3.48Å; E296-I298 VanDerWaalsContact C-N 3.31Å; E296-I298 PolarHBondContact O-N 3.42Å
299	A	64.6	Low	62.3	Low	82 Å²	82	116.1 Å²	116.1	68%	0.678	63%	0.628	S	S	*	*	H	α-helix	trans	-83.9	-13.4	177.1	0	0	0	0	0	114.1	T295 E296 D301	T295-A299 WeakPolarHBondContact O-CB 3.21Å; T295-A299 PolarHBondContact O-N 3.49Å; E296-A299 PolarHBondContact O-N 2.96Å; A299-D301 PolarHBondContact O-N 2.97Å
300	G	56.3	Low	62.5	Low	34 Å²	34	113.3 Å²	113.3	35%	0.351	63%	0.625	S	S	.	*	S	Bend	trans	-68	122.8	174.5	0	0	0	0	0	111.6	E296 W302	E296-G300 PolarHBondContact O-N 3.47Å; G300-W302 PolarHBondContact O-N 3.44Å
301	D	67.1	Low	62.5	Low	126 Å²	126	114.1 Å²	114.1	67%	0.674	63%	0.627	S	S	*	*			trans	-68.1	86.1	177	-161.5	11	0	0	0	110	A299 R303 S305	A299-D301 PolarHBondContact O-N 2.97Å; D301-R303 PolarHBondContact O-N 3.01Å; D301-R303 VanDerWaalsContact O-N 3.11Å; D301-S305 PolarHBondContact OD2-OG 3.06Å; D301-S305 VanDerWaalsContact OD2-OG 3.13Å
302	W	61.9	Low	62.1	Low	217 Å²	217	120.3 Å²	120.3	82%	0.822	65%	0.649	S	S	*	*			trans	-72.5	6.7	-178.7	-76	89.8	0	0	0	114	M297 G300	M297-W302 PolarHBondContact O-NE1 3.23Å; G300-W302 PolarHBondContact O-N 3.44Å
303	R	55.9	Low	61.7	Low	205 Å²	205	121.7 Å²	121.7	77%	0.774	66%	0.656	S	S	*	*	S	Bend	trans	-115.9	125.3	175.6	-70.8	-171.5	162.7	-119.8	-1.5	109.2	D301 S305	D301-R303 PolarHBondContact O-N 3.01Å; D301-R303 VanDerWaalsContact O-N 3.11Å; R303-S305 PolarHBondContact O-N 3.09Å
304	P	58.8	Low	61.4	Low	108 Å²	108	129.3 Å²	129.3	70%	0.701	68%	0.681	S	S	*	*			trans	-57.5	119.6	169	23.9	-31.2	0	0	0	108.1	S306	P304-S306 PolarHBondContact O-N 3.17Å
305	S	63.5	Low	61.1	Low	107 Å²	107	132.9 Å²	132.9	75%	0.748	70%	0.698	S	S	*	*	S	Bend	trans	-70.9	3.8	-168.6	-31.3	0	0	0	0	113.8	D301 R303	D301-S305 PolarHBondContact OD2-OG 3.06Å; D301-S305 VanDerWaalsContact OD2-OG 3.13Å; R303-S305 PolarHBondContact O-N 3.09Å
306	S	61.5	Low	60.7	Low	64 Å²	64	135.8 Å²	135.8	45%	0.448	71%	0.71	S	S	.	*			trans	-156.5	130.9	176.5	-173.8	0	0	0	0	112.6	P304 A308 D309	P304-S306 PolarHBondContact O-N 3.17Å; S306-A308 PolarHBondContact O-N 2.96Å; S306-A308 WeakPolarHBondContact OG-CB 3.19Å; S306-A308 PolarHBondContact OG-N 2.74Å; S306-D309 PolarHBondContact O-N 2.9Å
307	I	59.3	Low	60.4	Low	161 Å²	161	135.1 Å²	135.1	83%	0.826	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-63.3	-8.5	173.3	-149.5	157.8	0	0	0	112.8	D309 L310	I307-D309 VanDerWaalsContact C-N 3.32Å; I307-D309 PolarHBondContact O-N 3.01Å; I307-L310 PolarHBondContact O-N 2.9Å
308	A	60.9	Low	60.1	Low	62 Å²	62	135.6 Å²	135.6	51%	0.512	72%	0.715	S	S	.	*	G	3₁₀ helix	trans	-75.3	-13.3	-179.5	0	0	0	0	0	114.3	S306 L310 V311	S306-A308 PolarHBondContact O-N 2.96Å; S306-A308 WeakPolarHBondContact OG-CB 3.19Å; S306-A308 PolarHBondContact OG-N 2.74Å; A308-L310 VanDerWaalsContact C-N 3.3Å; A308-V311 WeakPolarHBondContact O-CG2 3.35Å
309	D	59.7	Low	59.6	Low	142 Å²	142	135.3 Å²	135.3	76%	0.759	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-85.8	-2.2	175.6	-77.5	-17.6	0	0	0	113.1	S306 I307 V311	S306-D309 PolarHBondContact O-N 2.9Å; I307-D309 VanDerWaalsContact C-N 3.32Å; I307-D309 PolarHBondContact O-N 3.01Å; D309-V311 VanDerWaalsContact C-N 3.28Å; D309-V311 PolarHBondContact O-N 2.93Å
310	L	60.1	Low	59.3	Low	129 Å²	129	138.9 Å²	138.9	68%	0.675	72%	0.718	S	S	*	*			trans	-90	53.4	171.7	-114.8	78.3	0	0	0	111.4	I307 A308 F312	I307-L310 PolarHBondContact O-N 2.9Å; A308-L310 VanDerWaalsContact C-N 3.3Å; L310-F312 PolarHBondContact O-N 2.68Å
311	V	60.4	Low	59.5	Low	113 Å²	113	146.4 Å²	146.4	69%	0.685	74%	0.744	S	S	*	*			trans	-90.6	101.2	171.2	-177.2	0	0	0	0	109.2	A308 D309 T313	A308-V311 WeakPolarHBondContact O-CG2 3.35Å; D309-V311 VanDerWaalsContact C-N 3.28Å; D309-V311 PolarHBondContact O-N 2.93Å; V311-T313 PolarHBondContact O-N 3.13Å; V311-T313 VanDerWaalsContact O-N 3.17Å
312	F	55.8	Low	58.9	Low	182 Å²	182	147.9 Å²	147.9	80%	0.798	75%	0.749	S	S	*	*			trans	-66	108.3	165.4	-75.4	-90.5	0	0	0	108.8	L310	L310-F312 PolarHBondContact O-N 2.68Å
313	T	56.8	Low	58.7	Low	134 Å²	134	142.2 Å²	142.2	82%	0.822	74%	0.743	S	S	*	*			trans	-79.8	128.5	164.8	38.9	0	0	0	0	108.1	V311	V311-T313 PolarHBondContact O-N 3.13Å; V311-T313 VanDerWaalsContact O-N 3.17Å
314	Y	51.8	Low	59	Low	299 Å²	299	136.5 Å²	136.5	100%	1.173	74%	0.741	S	S	*	*			trans	-85.7	0	-177.7	-138.7	-89.2	0	0	0	111.1

Retrieved 314 of 314 residues in 452.5 ms (Link to these results)

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