G4VAU9_SCHMA Loading...

Protein TBATA

AlphaFold DB , UniProt , Accession G4VAU9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 484 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	37.8	Very low	229 Å²	229	156.3 Å²	156.3	100%	1.128	78%	0.781	S	S	*	*				0	97.4	0	-74	155.4	93.8	0	0	106.5	N3	M1-N3 PolarHBondContact O-N 3.44Å
2	S	38.9	Very low	37.8	Very low	106 Å²	106	156 Å²	156	74%	0.741	78%	0.783	S	S	*	*			trans	-81.6	99	-172	-48.4	0	0	0	0	108.8	Y4	S2-Y4 VanDerWaalsContact C-N 3.3Å; S2-Y4 PolarHBondContact O-N 2.9Å
3	N	38.4	Very low	38.2	Very low	146 Å²	146	155.5 Å²	155.5	78%	0.781	78%	0.776	S	S	*	*			trans	-77.9	89.9	170.7	-73.5	-16.1	0	0	0	107.9	M1 I5	M1-N3 PolarHBondContact O-N 3.44Å; N3-I5 VanDerWaalsContact C-N 3.27Å; N3-I5 PolarHBondContact O-N 3.12Å
4	Y	36.9	Very low	38.1	Very low	196 Å²	196	153.5 Å²	153.5	77%	0.769	77%	0.769	S	S	*	*			trans	-56.9	93.5	157.6	-89	-96.7	0	0	0	108	S2	S2-Y4 VanDerWaalsContact C-N 3.3Å; S2-Y4 PolarHBondContact O-N 2.9Å
5	I	39.2	Very low	38.7	Very low	143 Å²	143	158.6 Å²	158.6	73%	0.733	78%	0.778	S	S	*	*			trans	-97.3	91.4	158	-47.4	178	0	0	0	103.4	N3 E7	N3-I5 VanDerWaalsContact C-N 3.27Å; N3-I5 PolarHBondContact O-N 3.12Å; I5-E7 PolarHBondContact O-N 3.14Å
6	N	34.6	Very low	39	Very low	121 Å²	121	155.8 Å²	155.8	65%	0.647	78%	0.779	S	S	*	*			trans	-58.8	95.2	164.2	-64	-38	0	0	0	105.4	E8	N6-E8 PolarHBondContact O-N 3.32Å
7	E	36.7	Very low	39.3	Very low	171 Å²	171	148.7 Å²	148.7	80%	0.799	76%	0.755	S	S	*	*			trans	-60.8	97.6	159.2	-76.3	179.6	172.7	0	0	104.7	I5 I9	I5-E7 PolarHBondContact O-N 3.14Å; E7-I9 PolarHBondContact O-N 3.33Å
8	E	37.8	Very low	39.7	Very low	164 Å²	164	154.4 Å²	154.4	77%	0.766	77%	0.765	S	S	*	*			trans	-53.3	95.8	166.8	-77.1	-179.8	148.2	0	0	105.9	N6 N10	N6-E8 PolarHBondContact O-N 3.32Å; E8-N10 PolarHBondContact O-N 2.74Å
9	I	37.2	Very low	40.2	Very low	158 Å²	158	154.5 Å²	154.5	81%	0.81	76%	0.763	S	S	*	*			trans	-58.9	94	164.9	-65.1	170.6	0	0	0	103.5	E7 H11	E7-I9 PolarHBondContact O-N 3.33Å; I9-H11 PolarHBondContact O-N 2.72Å
10	N	37.2	Very low	41.3	Very low	137 Å²	137	153.3 Å²	153.3	73%	0.733	76%	0.76	S	S	*	*			trans	-44.4	110.8	176.8	-78.8	-52.8	0	0	0	106.2	E8 L12	E8-N10 PolarHBondContact O-N 2.74Å; N10-L12 PolarHBondContact O-N 3.05Å
11	H	40.4	Very low	42.4	Very low	148 Å²	148	147.4 Å²	147.4	69%	0.685	73%	0.733	S	S	*	*			trans	-59.8	91.7	-172.5	-144.1	-54.8	0	0	0	105.8	I9 H13	I9-H11 PolarHBondContact O-N 2.72Å; H11-H13 VanDerWaalsContact C-N 3.3Å; H11-H13 PolarHBondContact O-N 2.92Å; H11-H13 PolarHBondContact O-ND1 2.96Å
12	L	37.3	Very low	43.7	Very low	153 Å²	153	141.1 Å²	141.1	80%	0.801	70%	0.701	S	S	*	*			trans	-56.5	103.2	177.9	-148.6	79.8	0	0	0	104.1	N10 N14	N10-L12 PolarHBondContact O-N 3.05Å; L12-N14 PolarHBondContact O-N 3.23Å
13	H	42.7	Very low	45.2	Very low	149 Å²	149	141 Å²	141	69%	0.69	70%	0.697	S	S	*	*			trans	-63	107.5	-168.6	-87.3	15.4	0	0	0	106.6	H11 Y15	H11-H13 VanDerWaalsContact C-N 3.3Å; H11-H13 PolarHBondContact O-N 2.92Å; H11-H13 PolarHBondContact O-ND1 2.96Å; H13-Y15 VanDerWaalsContact O-CD2 3.24Å; H13-Y15 WeakPolarHBondContact O-CD2 3.08Å; H13-Y15 PolarHBondContact O-N 3.41Å
14	N	37.1	Very low	46.9	Very low	128 Å²	128	142.1 Å²	142.1	68%	0.684	70%	0.698	S	S	*	*			trans	-53.8	102.8	177.1	-80.8	-40.1	0	0	0	107.9	L12 S16 G17	L12-N14 PolarHBondContact O-N 3.23Å; N14-S16 PolarHBondContact O-N 3.49Å; N14-G17 PolarHBondContact O-N 3.29Å
15	Y	46.4	Very low	48.8	Very low	230 Å²	230	137.7 Å²	137.7	90%	0.902	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	4.7	176.8	-72.4	-86.5	0	0	0	114.1	H13	H13-Y15 VanDerWaalsContact O-CD2 3.24Å; H13-Y15 WeakPolarHBondContact O-CD2 3.08Å; H13-Y15 PolarHBondContact O-N 3.41Å
16	S	44.9	Very low	50.6	Low	114 Å²	114	131.8 Å²	131.8	80%	0.797	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	-3.7	178.6	-159.9	0	0	0	0	113.5	N14 R18	N14-S16 PolarHBondContact O-N 3.49Å; S16-R18 PolarHBondContact O-N 2.7Å
17	G	43.6	Very low	52.6	Low	35 Å²	35	128.8 Å²	128.8	36%	0.361	64%	0.636	S	S	.	*	S	Bend	trans	-66.5	128.8	169.1	0	0	0	0	0	108.9	N14 H19	N14-G17 PolarHBondContact O-N 3.29Å; G17-H19 PolarHBondContact O-N 2.82Å
18	R	45.4	Very low	54.8	Low	252 Å²	252	126.8 Å²	126.8	95%	0.951	62%	0.622	S	S	*	*			trans	-65.9	43.6	176.3	-60.1	175.2	171.4	-137.9	-1	112.4	S16 N20	S16-R18 PolarHBondContact O-N 2.7Å; R18-N20 PolarHBondContact O-N 3.48Å; R18-N20 VanDerWaalsContact O-N 3.09Å
19	H	49.5	Very low	56.8	Low	156 Å²	156	124.3 Å²	124.3	72%	0.722	61%	0.609	S	S	*	*			trans	-71.7	108.9	178.3	-67.6	-67.6	0	0	0	107	G17 P21	G17-H19 PolarHBondContact O-N 2.82Å; H19-P21 WeakPolarHBondContact O-CD 3.27Å; H19-P21 VanDerWaalsContact O-N 3.13Å
20	N	62	Low	58.8	Low	129 Å²	129	122.3 Å²	122.3	69%	0.69	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-53	121.1	166.7	-140.7	3.6	0	0	0	106	R18 H22	R18-N20 PolarHBondContact O-N 3.48Å; R18-N20 VanDerWaalsContact O-N 3.09Å; N20-H22 PolarHBondContact O-N 2.9Å
21	P	65.4	Low	60.4	Low	31 Å²	31	116.6 Å²	116.6	20%	0.201	58%	0.578	C	S	.	*	P	Polyproline II helix	trans	-54.3	138.6	-176.8	20.8	-32.6	0	0	0	109.4	H19 V26 V40	H19-P21 WeakPolarHBondContact O-CD 3.27Å; H19-P21 VanDerWaalsContact O-N 3.13Å; P21-V26 HydrophobicContact CB-CG2 3.65Å; P21-V26 HydrophobicContact CG-CG2 3.52Å; P21-V40 HydrophobicContact CB-CB 4.47Å; P21-V40 HydrophobicContact CB-CG1 3.68Å; P21-V40 HydrophobicContact CB-CG2 3.89Å; P21-V40 HydrophobicContact CG-CG1 4.37Å; P21-V40 HydrophobicContact CG-CG2 3.62Å
22	H	65.7	Low	62.1	Low	97 Å²	97	118.2 Å²	118.2	45%	0.449	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-53.5	136.6	-178.4	-169.9	-94	0	0	0	109.2	N20 Q24 R25	N20-H22 PolarHBondContact O-N 2.9Å; H22-Q24 PolarHBondContact CE1-OE1 3.3Å; H22-Q24 PolarHBondContact ND1-N 3.5Å; H22-Q24 PolarHBondContact O-N 3.47Å; H22-R25 PolarHBondContact O-N 2.75Å
23	P	72	Confident	64.1	Low	104 Å²	104	118 Å²	118	68%	0.675	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-51.3	-32.2	-173.6	-29.9	34.9	0	0	0	114.5	V26	P23-V26 PolarHBondContact O-N 2.9Å
24	Q	74.1	Confident	65.7	Low	169 Å²	169	113.5 Å²	113.5	79%	0.79	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-71.8	-25	177.6	-66.8	171.3	-24	0	0	114.6	H22 V26	H22-Q24 PolarHBondContact CE1-OE1 3.3Å; H22-Q24 PolarHBondContact ND1-N 3.5Å; H22-Q24 PolarHBondContact O-N 3.47Å; Q24-V26 VanDerWaalsContact C-N 3.25Å
25	R	75.8	Confident	67.4	Low	103 Å²	103	112.9 Å²	112.9	39%	0.389	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-82	-9.1	174	-70.4	-169.1	-72	162.7	-8.1	112.1	H22 V40 H41 D42	H22-R25 PolarHBondContact O-N 2.75Å; R25-V40 HydrophobicContact CB-CG1 4.27Å; R25-V40 CarbonylContact O-C 3.56Å; R25-V40 WeakPolarHBondContact O-CA 2.86Å; R25-H41 PolarHBondContact O-N 3.19Å; R25-D42 IonicContact NH1-OD1 2.92Å; R25-D42 PolarHBondContact NH1-OD1 3.11Å
26	V	76.6	Confident	68.9	Low	18 Å²	18	106.4 Å²	106.4	11%	0.109	56%	0.559	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.5	123.4	-174.2	-179.2	0	0	0	0	110	P21 P23 Q24 Y28 R38 V39 V40	P21-V26 HydrophobicContact CB-CG2 3.65Å; P21-V26 HydrophobicContact CG-CG2 3.52Å; P23-V26 PolarHBondContact O-N 2.9Å; Q24-V26 VanDerWaalsContact C-N 3.25Å; V26-Y28 HydrophobicContact CG1-CE2 3.92Å; V26-R38 HydrophobicContact CG1-CG 3.28Å; V26-V39 WeakPolarHBondContact CA-O 3.08Å; V26-V40 HydrophobicContact CG2-CG2 4.42Å
27	T	77.9	Confident	70.4	Confident	58 Å²	58	103.9 Å²	103.9	36%	0.356	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	155.7	171.6	55.1	0	0	0	0	109.9	V39 H41	T27-V39 PolarHBondContact N-O 2.65Å; T27-V39 PolarHBondContact O-N 2.87Å; T27-H41 WeakPolarHBondContact CG2-NE2 3.21Å; T27-H41 PolarHBondContact OG1-CD2 3.3Å; T27-H41 PolarHBondContact OG1-NE2 3.02Å
28	Y	82	Confident	72	Confident	130 Å²	130	108.2 Å²	108.2	51%	0.51	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.6	176.9	-63.3	-87.6	0	0	0	109.3	V26 P36 V37 R38	V26-Y28 HydrophobicContact CG1-CE2 3.92Å; Y28-P36 HydrophobicContact CD1-CB 4.11Å; Y28-V37 WeakPolarHBondContact CA-O 3.34Å; Y28-R38 HydrophobicContact CD1-CB 4.13Å; Y28-R38 HydrophobicContact CD1-CG 4.46Å; Y28-R38 HydrophobicContact CE1-CB 3.82Å; Y28-R38 HydrophobicContact CE1-CG 3.93Å; Y28-R38 PolarHBondContact OH-NE 2.76Å; Y28-R38 VanDerWaalsContact OH-NE 3.08Å; Y28-R38 PolarHBondContact OH-NH2 2.98Å
29	F	79.6	Confident	73.6	Confident	111 Å²	111	98.6 Å²	98.6	49%	0.487	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150.8	165.7	70.9	-87.9	0	0	0	109.3	G31 V37 V39	F29-G31 PolarHBondContact O-N 3.23Å; F29-V37 HydrophobicContact CD1-CB 4.22Å; F29-V37 HydrophobicContact CD1-CG1 4.48Å; F29-V37 HydrophobicContact CD2-CB 4.46Å; F29-V37 HydrophobicContact CE1-CB 3.77Å; F29-V37 HydrophobicContact CE1-CG1 3.63Å; F29-V37 HydrophobicContact CE2-CB 4.04Å; F29-V37 HydrophobicContact CE2-CG1 4.41Å; F29-V37 HydrophobicContact CE2-CG2 4.33Å; F29-V37 HydrophobicContact CZ-CB 3.68Å; F29-V37 HydrophobicContact CZ-CG1 3.6Å; F29-V37 HydrophobicContact CZ-CG2 4.29Å; F29-V37 PolarHBondContact N-O 3.05Å; F29-V37 PolarHBondContact O-N 3.32Å; F29-V39 HydrophobicContact CD1-CG2 3.6Å; F29-V39 HydrophobicContact CE1-CG2 3.33Å
30	T	79	Confident	75.1	Confident	117 Å²	117	94 Å²	94	72%	0.718	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	117	177.9	46.7	0	0	0	0	109.4
31	G	71.9	Confident	75.6	Confident	17 Å²	17	93 Å²	93	18%	0.175	49%	0.486	C	S	.	.			trans	-69.8	170.7	170.9	0	0	0	0	0	111.7	F29 L33 G34 L35	F29-G31 PolarHBondContact O-N 3.23Å; G31-L33 PolarHBondContact O-N 3.5Å; G31-L33 VanDerWaalsContact O-N 3.16Å; G31-G34 WeakPolarHBondContact O-CA 3.31Å; G31-G34 PolarHBondContact O-N 3.45Å; G31-L35 WeakPolarHBondContact CA-O 3.44Å; G31-L35 PolarHBondContact N-O 3.02Å
32	F	74.7	Confident	76	Confident	182 Å²	182	96.4 Å²	96.4	80%	0.798	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.1	-176.5	-167.6	-101.3	0	0	0	114	G34	F32-G34 VanDerWaalsContact C-N 3.26Å; F32-G34 PolarHBondContact O-N 3.4Å
33	L	80.2	Confident	75.9	Confident	147 Å²	147	96.8 Å²	96.8	77%	0.77	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	11	176.1	-58.9	177.5	0	0	0	113.4	G31 L35	G31-L33 PolarHBondContact O-N 3.5Å; G31-L33 VanDerWaalsContact O-N 3.16Å; L33-L35 HydrophobicContact CB-CD1 4.44Å; L33-L35 HydrophobicContact CB-CG 4.38Å; L33-L35 PolarHBondContact O-N 3.27Å
34	G	76.3	Confident	75.2	Confident	56 Å²	56	99 Å²	99	58%	0.577	52%	0.519	S	S	*	.	S	Bend	trans	71.8	2.5	-172.7	0	0	0	0	0	114.4	G31 F32	G31-G34 WeakPolarHBondContact O-CA 3.31Å; G31-G34 PolarHBondContact O-N 3.45Å; F32-G34 VanDerWaalsContact C-N 3.26Å; F32-G34 PolarHBondContact O-N 3.4Å
35	L	73.3	Confident	74.1	Confident	115 Å²	115	98.3 Å²	98.3	60%	0.602	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-83.2	138.2	177.9	-64.2	174.8	0	0	0	111	G31 L33 V37	G31-L35 WeakPolarHBondContact CA-O 3.44Å; G31-L35 PolarHBondContact N-O 3.02Å; L33-L35 HydrophobicContact CB-CD1 4.44Å; L33-L35 HydrophobicContact CB-CG 4.38Å; L33-L35 PolarHBondContact O-N 3.27Å; L35-V37 PolarHBondContact O-N 3.46Å
36	P	76.3	Confident	72.6	Confident	93 Å²	93	98.2 Å²	98.2	60%	0.604	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	121.9	179.8	27.6	-33.4	0	0	0	111	Y28	Y28-P36 HydrophobicContact CD1-CB 4.11Å
37	V	77.1	Confident	71.2	Confident	61 Å²	61	103.9 Å²	103.9	37%	0.37	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97	128.2	173.8	-178.2	0	0	0	0	108.7	Y28 F29 L35	Y28-V37 WeakPolarHBondContact CA-O 3.34Å; F29-V37 HydrophobicContact CD1-CB 4.22Å; F29-V37 HydrophobicContact CD1-CG1 4.48Å; F29-V37 HydrophobicContact CD2-CB 4.46Å; F29-V37 HydrophobicContact CE1-CB 3.77Å; F29-V37 HydrophobicContact CE1-CG1 3.63Å; F29-V37 HydrophobicContact CE2-CB 4.04Å; F29-V37 HydrophobicContact CE2-CG1 4.41Å; F29-V37 HydrophobicContact CE2-CG2 4.33Å; F29-V37 HydrophobicContact CZ-CB 3.68Å; F29-V37 HydrophobicContact CZ-CG1 3.6Å; F29-V37 HydrophobicContact CZ-CG2 4.29Å; F29-V37 PolarHBondContact N-O 3.05Å; F29-V37 PolarHBondContact O-N 3.32Å; L35-V37 PolarHBondContact O-N 3.46Å
38	R	77.5	Confident	69.4	Low	127 Å²	127	107.1 Å²	107.1	48%	0.479	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.3	129.7	-178.1	-172.2	-175.7	-81	174.4	-2.9	111	V26 Y28	V26-R38 HydrophobicContact CG1-CG 3.28Å; Y28-R38 HydrophobicContact CD1-CB 4.13Å; Y28-R38 HydrophobicContact CD1-CG 4.46Å; Y28-R38 HydrophobicContact CE1-CB 3.82Å; Y28-R38 HydrophobicContact CE1-CG 3.93Å; Y28-R38 PolarHBondContact OH-NE 2.76Å; Y28-R38 VanDerWaalsContact OH-NE 3.08Å; Y28-R38 PolarHBondContact OH-NH2 2.98Å
39	V	79.5	Confident	67.4	Low	50 Å²	50	107.9 Å²	107.9	30%	0.303	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.5	142.7	171.3	-177.6	0	0	0	0	109.2	V26 T27 F29	V26-V39 WeakPolarHBondContact CA-O 3.08Å; T27-V39 PolarHBondContact N-O 2.65Å; T27-V39 PolarHBondContact O-N 2.87Å; F29-V39 HydrophobicContact CD1-CG2 3.6Å; F29-V39 HydrophobicContact CE1-CG2 3.33Å
40	V	80.3	Confident	65.4	Low	59 Å²	59	109.1 Å²	109.1	36%	0.358	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112	125.1	176.5	-173.3	0	0	0	0	108.2	P21 R25 V26	P21-V40 HydrophobicContact CB-CB 4.47Å; P21-V40 HydrophobicContact CB-CG1 3.68Å; P21-V40 HydrophobicContact CB-CG2 3.89Å; P21-V40 HydrophobicContact CG-CG1 4.37Å; P21-V40 HydrophobicContact CG-CG2 3.62Å; R25-V40 HydrophobicContact CB-CG1 4.27Å; R25-V40 CarbonylContact O-C 3.56Å; R25-V40 WeakPolarHBondContact O-CA 2.86Å; V26-V40 HydrophobicContact CG2-CG2 4.42Å
41	H	72.6	Confident	63.1	Low	107 Å²	107	108.6 Å²	108.6	50%	0.495	60%	0.597	S	S	.	*			trans	-95.4	110.8	173.8	-61.1	-65.7	0	0	0	109.2	R25 T27	R25-H41 PolarHBondContact O-N 3.19Å; T27-H41 WeakPolarHBondContact CG2-NE2 3.21Å; T27-H41 PolarHBondContact OG1-CD2 3.3Å; T27-H41 PolarHBondContact OG1-NE2 3.02Å
42	D	73.5	Confident	61.1	Low	104 Å²	104	113.7 Å²	113.7	56%	0.556	63%	0.63	S	S	*	*			trans	-95.9	132.3	168.8	-70.5	-42	0	0	0	109.3	R25 I44	R25-D42 IonicContact NH1-OD1 2.92Å; R25-D42 PolarHBondContact NH1-OD1 3.11Å; D42-I44 PolarHBondContact O-N 2.69Å
43	P	63.9	Low	59.1	Low	104 Å²	104	110.9 Å²	110.9	68%	0.675	63%	0.628	S	S	*	*			trans	-64	127.7	174.9	26.6	-32.2	0	0	0	109.1	L45	P43-L45 PolarHBondContact O-N 3.27Å
44	I	56.8	Low	56.7	Low	152 Å²	152	112.5 Å²	112.5	78%	0.779	63%	0.632	S	S	*	*			trans	-70.4	112.6	168.5	-55.7	168.4	0	0	0	105.2	D42 T46	D42-I44 PolarHBondContact O-N 2.69Å; I44-T46 PolarHBondContact O-N 3.26Å
45	L	51	Low	54.3	Low	154 Å²	154	121 Å²	121	81%	0.806	65%	0.647	S	S	*	*			trans	-63.9	101.9	170.8	-67.8	171.7	0	0	0	107.1	P43 D47	P43-L45 PolarHBondContact O-N 3.27Å; L45-D47 PolarHBondContact O-N 3.01Å
46	T	44.4	Very low	52.1	Low	100 Å²	100	121.7 Å²	121.7	61%	0.613	65%	0.651	S	S	*	*			trans	-74.4	109.8	167.7	54	0	0	0	0	106.7	I44 D48	I44-T46 PolarHBondContact O-N 3.26Å; T46-D48 WeakPolarHBondContact CB-OD2 3.45Å; T46-D48 PolarHBondContact O-N 3.36Å; T46-D48 PolarHBondContact OG1-OD2 3.19Å
47	D	48.3	Very low	49.8	Very low	138 Å²	138	124.8 Å²	124.8	74%	0.738	66%	0.657	S	S	*	*			trans	-77.4	65.5	-178.4	-138.5	7.1	0	0	0	108.6	L45 N49	L45-D47 PolarHBondContact O-N 3.01Å; D47-N49 PolarHBondContact O-N 2.96Å
48	D	39.6	Very low	47.5	Very low	126 Å²	126	128.9 Å²	128.9	67%	0.674	68%	0.677	S	S	*	*			trans	-77.6	15.9	-172.6	-71.4	-41.4	0	0	0	113.6	T46	T46-D48 WeakPolarHBondContact CB-OD2 3.45Å; T46-D48 PolarHBondContact O-N 3.36Å; T46-D48 PolarHBondContact OG1-OD2 3.19Å
49	N	39	Very low	45.2	Very low	146 Å²	146	128.9 Å²	128.9	78%	0.781	70%	0.696	S	S	*	*			trans	-141.5	59.6	-172.9	-68.6	-55.2	0	0	0	114.5	D47	D47-N49 PolarHBondContact O-N 2.96Å
50	I	37.6	Very low	42.7	Very low	136 Å²	136	131.6 Å²	131.6	70%	0.697	72%	0.717	S	S	*	*			trans	-135.1	111	159	-52.8	179.2	0	0	0	111.1
51	P	31.1	Very low	40.4	Very low	107 Å²	107	136.3 Å²	136.3	70%	0.695	74%	0.739	S	S	*	*			trans	-69.3	140.6	175.6	17	-13.7	0	0	0	111.8	T53	P51-T53 PolarHBondContact O-N 3.45Å
52	S	30.9	Very low	38.2	Very low	124 Å²	124	136.7 Å²	136.7	87%	0.867	75%	0.745	S	S	*	*	S	Bend	trans	-50.8	76.1	-175.8	-37.4	0	0	0	0	115.1
53	T	32	Very low	36.1	Very low	122 Å²	122	139 Å²	139	75%	0.748	76%	0.757	S	S	*	*			trans	-148.6	108.7	165.5	37.5	0	0	0	0	112.3	P51	P51-T53 PolarHBondContact O-N 3.45Å
54	Q	30.9	Very low	34.4	Very low	181 Å²	181	138 Å²	138	85%	0.846	75%	0.753	S	S	*	*			trans	61.1	88.5	137.1	-159.9	178.4	47.8	0	0	118.3
55	R	25.1	Very low	33.1	Very low	236 Å²	236	139.2 Å²	139.2	89%	0.891	75%	0.752	S	S	*	*			trans	-172.8	106	139	-108	164	-171.6	172.7	3.5	109.4
56	N	26.4	Very low	31.9	Very low	129 Å²	129	142.5 Å²	142.5	69%	0.69	75%	0.754	S	S	*	*				49.5	96.3	92.6	-75	-17.9	0	0	0	113.7
57	H	29.2	Very low	31	Very low	157 Å²	157	142.9 Å²	142.9	73%	0.727	76%	0.756	S	S	*	*			trans	49.3	126.8	139.7	-55.3	-64.1	0	0	0	119.5
58	N	28.4	Very low	30.3	Very low	148 Å²	148	144 Å²	144	79%	0.791	76%	0.762	S	S	*	*			trans	91.1	85.9	151.1	-46	-31.8	0	0	0	115.9
59	S	29.7	Very low	29.7	Very low	126 Å²	126	146.2 Å²	146.2	88%	0.881	77%	0.766	S	S	*	*				147.4	82.7	127.7	69.1	0	0	0	0	110
60	S	26.5	Very low	29.2	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	77%	0.765	S	S	*	*			trans	-138.7	108.1	158.3	178	0	0	0	0	106.4	D62	S60-D62 PolarHBondContact O-N 2.97Å
61	L	30.7	Very low	29	Very low	157 Å²	157	145.3 Å²	145.3	82%	0.822	77%	0.774	S	S	*	*			trans	-62.3	92.5	166.5	-79	122.3	0	0	0	106.2	L63	L61-L63 VanDerWaalsContact C-N 3.27Å; L61-L63 HydrophobicContact CB-CD1 4.07Å; L61-L63 WeakPolarHBondContact O-CD1 3.39Å; L61-L63 PolarHBondContact O-N 3.29Å
62	D	27.8	Very low	28.8	Very low	115 Å²	115	143.5 Å²	143.5	62%	0.615	78%	0.775	S	S	*	*			trans	-71.1	88.7	174.1	-169.3	5.5	0	0	0	108.2	S60 S64	S60-D62 PolarHBondContact O-N 2.97Å; D62-S64 VanDerWaalsContact CG-OG 3.31Å; D62-S64 PolarHBondContact O-N 2.57Å; D62-S64 WeakPolarHBondContact OD1-CB 3.49Å; D62-S64 PolarHBondContact OD1-N 3.24Å; D62-S64 PolarHBondContact OD1-OG 2.91Å; D62-S64 PolarHBondContact OD2-OG 3.39Å
63	L	29.1	Very low	28.6	Very low	152 Å²	152	145.3 Å²	145.3	80%	0.796	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-72.5	0.4	180	-83.3	120	0	0	0	112.9	L61 K65	L61-L63 VanDerWaalsContact C-N 3.27Å; L61-L63 HydrophobicContact CB-CD1 4.07Å; L61-L63 WeakPolarHBondContact O-CD1 3.39Å; L61-L63 PolarHBondContact O-N 3.29Å; L63-K65 PolarHBondContact O-N 2.8Å
64	S	27.7	Very low	28.5	Very low	85 Å²	85	143.1 Å²	143.1	59%	0.594	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-68	-6.7	-174.1	65.3	0	0	0	0	115.2	D62	D62-S64 VanDerWaalsContact CG-OG 3.31Å; D62-S64 PolarHBondContact O-N 2.57Å; D62-S64 WeakPolarHBondContact OD1-CB 3.49Å; D62-S64 PolarHBondContact OD1-N 3.24Å; D62-S64 PolarHBondContact OD1-OG 2.91Å; D62-S64 PolarHBondContact OD2-OG 3.39Å
65	K	30.4	Very low	28.8	Very low	176 Å²	176	140.3 Å²	140.3	77%	0.765	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-127.8	10.4	-171	-67.6	-175.7	-176.3	173.6	0	117.3	L63	L63-K65 PolarHBondContact O-N 2.8Å
66	R	24.3	Very low	29.1	Very low	223 Å²	223	132.6 Å²	132.6	84%	0.842	74%	0.744	S	S	*	*			trans	-119.9	85.8	171.4	-76.3	-169	174.2	-178.9	-0.3	111.4	N68	R66-N68 PolarHBondContact O-N 3.15Å
67	T	26.2	Very low	29.4	Very low	109 Å²	109	134.8 Å²	134.8	67%	0.669	74%	0.743	S	S	*	*			trans	-49.8	125.3	148.7	52.6	0	0	0	0	107.7	F69	T67-F69 VanDerWaalsContact C-N 3.34Å; T67-F69 PolarHBondContact O-N 3.21Å
68	N	33.5	Very low	29.4	Very low	162 Å²	162	136.1 Å²	136.1	87%	0.866	74%	0.743	S	S	*	*			trans	-64.4	91.2	-177.1	-64.2	-65.4	0	0	0	109.8	R66	R66-N68 PolarHBondContact O-N 3.15Å
69	F	27.2	Very low	29.7	Very low	171 Å²	171	133.5 Å²	133.5	75%	0.75	73%	0.733	S	S	*	*			trans	-81.4	127	160.1	-78.8	-77.8	0	0	0	108.5	T67 V71	T67-F69 VanDerWaalsContact C-N 3.34Å; T67-F69 PolarHBondContact O-N 3.21Å; F69-V71 PolarHBondContact O-N 2.93Å
70	P	28.8	Very low	29.8	Very low	118 Å²	118	133 Å²	133	77%	0.766	72%	0.72	S	S	*	*			trans	-62.4	122.2	174.1	25.8	-31.5	0	0	0	108.9	G72	P70-G72 VanDerWaalsContact C-N 3.27Å; P70-G72 PolarHBondContact O-N 2.66Å
71	V	33.5	Very low	29.9	Very low	145 Å²	145	136.9 Å²	136.9	88%	0.879	72%	0.72	S	S	*	*			trans	-69	86.9	176.5	178.1	0	0	0	0	108.3	F69	F69-V71 PolarHBondContact O-N 2.93Å
72	G	26.3	Very low	29.9	Very low	70 Å²	70	135.4 Å²	135.4	72%	0.722	71%	0.712	S	S	*	*			trans	-116	24.8	171.1	0	0	0	0	0	112.4	P70 S74	P70-G72 VanDerWaalsContact C-N 3.27Å; P70-G72 PolarHBondContact O-N 2.66Å; G72-S74 PolarHBondContact O-N 3.08Å
73	L	27	Very low	30.1	Very low	161 Å²	161	135.1 Å²	135.1	84%	0.843	71%	0.714	S	S	*	*			trans	-84.8	107.6	-179.1	-63.5	-179.4	0	0	0	111.1
74	S	30.5	Very low	30.2	Very low	77 Å²	77	134.8 Å²	134.8	54%	0.538	71%	0.713	S	S	.	*			trans	36.9	123.6	154.7	-162.8	0	0	0	0	119.8	G72 S76	G72-S74 PolarHBondContact O-N 3.08Å; S74-S76 PolarHBondContact O-N 3.09Å
75	P	36.1	Very low	30.2	Very low	122 Å²	122	136.8 Å²	136.8	79%	0.792	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-56.5	-6.1	177.4	-28.4	36.1	0	0	0	118.6	Y77	P75-Y77 VanDerWaalsContact C-N 3.32Å; P75-Y77 PolarHBondContact O-N 2.85Å
76	S	32.8	Very low	30.2	Very low	73 Å²	73	133.6 Å²	133.6	51%	0.51	72%	0.717	S	S	.	*	G	3₁₀ helix	trans	-74	-10.5	-167.8	58.2	0	0	0	0	116.2	S74	S74-S76 PolarHBondContact O-N 3.09Å
77	Y	31.2	Very low	30.5	Very low	175 Å²	175	130.1 Å²	130.1	69%	0.686	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-105.9	2.5	-179.6	-59.5	-76.5	0	0	0	114.2	P75 T79	P75-Y77 VanDerWaalsContact C-N 3.32Å; P75-Y77 PolarHBondContact O-N 2.85Å; Y77-T79 VanDerWaalsContact C-N 3.33Å; Y77-T79 PolarHBondContact O-N 2.82Å
78	Y	29	Very low	30.6	Very low	186 Å²	186	134.6 Å²	134.6	73%	0.729	73%	0.725	S	S	*	*	S	Bend	trans	-77.5	-18.2	-176.3	-152.3	-91.4	0	0	0	113.2
79	T	34.7	Very low	30.5	Very low	93 Å²	93	134.6 Å²	134.6	57%	0.571	72%	0.724	S	S	*	*	S	Bend	trans	-78.1	-27.4	-173.8	49.4	0	0	0	0	113.9	Y77 L82	Y77-T79 VanDerWaalsContact C-N 3.33Å; Y77-T79 PolarHBondContact O-N 2.82Å; T79-L82 PolarHBondContact O-N 2.69Å
80	D	31.7	Very low	30.5	Very low	114 Å²	114	133.4 Å²	133.4	61%	0.61	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-79.4	-27.1	-168.1	-61.8	-8.3	0	0	0	112.5	L82	D80-L82 VanDerWaalsContact C-N 3.29Å; D80-L82 PolarHBondContact O-N 3.44Å
81	Y	28.7	Very low	30.7	Very low	190 Å²	190	135.6 Å²	135.6	75%	0.745	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-75.7	-14.3	179.1	-75.8	-80.8	0	0	0	114.1
82	L	31.7	Very low	30.7	Very low	126 Å²	126	137.1 Å²	137.1	66%	0.66	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-80.4	-18	178.8	-72.5	178.1	0	0	0	113.5	T79 D80	T79-L82 PolarHBondContact O-N 2.69Å; D80-L82 VanDerWaalsContact C-N 3.29Å; D80-L82 PolarHBondContact O-N 3.44Å
83	V	32.6	Very low	30.9	Very low	109 Å²	109	140.1 Å²	140.1	66%	0.661	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-28.8	-172.8	-177.1	0	0	0	0	112.9
84	N	30.2	Very low	31.1	Very low	146 Å²	146	139 Å²	139	78%	0.781	72%	0.719	S	S	*	*	S	Bend	trans	-99.3	-4	-168	-85.1	1.1	0	0	0	117.2
85	N	28.9	Very low	31.2	Very low	126 Å²	126	141.1 Å²	141.1	67%	0.674	72%	0.724	S	S	*	*			trans	-102.2	35.7	-177.8	-73.6	-26.8	0	0	0	114.3	L87	N85-L87 PolarHBondContact O-N 2.97Å
86	S	28.5	Very low	31.2	Very low	110 Å²	110	142 Å²	142	77%	0.769	72%	0.722	S	S	*	*			trans	-75	70.2	165.8	-67.6	0	0	0	0	110.3	K88	S86-K88 VanDerWaalsContact C-N 3.35Å; S86-K88 PolarHBondContact O-N 2.86Å
87	L	31.8	Very low	31.2	Very low	150 Å²	150	145.4 Å²	145.4	79%	0.785	73%	0.734	S	S	*	*			trans	-69.3	93.7	170	-71.2	178.2	0	0	0	108.9	N85 L89	N85-L87 PolarHBondContact O-N 2.97Å; L87-L89 VanDerWaalsContact C-N 3.31Å; L87-L89 PolarHBondContact O-N 2.77Å
88	K	28.2	Very low	31.1	Very low	203 Å²	203	144.3 Å²	144.3	88%	0.883	74%	0.741	S	S	*	*			trans	-69.8	83.6	175.7	-161	172.5	-173.7	177.3	0	109.2	S86 N90	S86-K88 VanDerWaalsContact C-N 3.35Å; S86-K88 PolarHBondContact O-N 2.86Å; K88-N90 PolarHBondContact O-N 2.87Å; K88-N90 VanDerWaalsContact O-N 3.08Å
89	L	31.8	Very low	31.4	Very low	161 Å²	161	142.5 Å²	142.5	84%	0.843	74%	0.744	S	S	*	*			trans	-71.4	100.7	172.3	-72.6	170.4	0	0	0	109	L87 L91	L87-L89 VanDerWaalsContact C-N 3.31Å; L87-L89 PolarHBondContact O-N 2.77Å; L89-L91 PolarHBondContact O-N 2.83Å
90	N	26.6	Very low	31.4	Very low	146 Å²	146	143.7 Å²	143.7	78%	0.781	76%	0.756	S	S	*	*			trans	-75.3	88.4	178.1	-163.5	-24.8	0	0	0	108.8	K88 K92	K88-N90 PolarHBondContact O-N 2.87Å; K88-N90 VanDerWaalsContact O-N 3.08Å; N90-K92 VanDerWaalsContact C-N 3.32Å; N90-K92 PolarHBondContact O-N 3.03Å
91	L	33.5	Very low	31.3	Very low	164 Å²	164	145.7 Å²	145.7	86%	0.859	77%	0.766	S	S	*	*			trans	-74.3	91.8	172.7	-150.1	78.4	0	0	0	107.8	L89 N93	L89-L91 PolarHBondContact O-N 2.83Å; L91-N93 VanDerWaalsContact C-N 3.33Å; L91-N93 PolarHBondContact O-N 2.82Å
92	K	33.8	Very low	31.5	Very low	178 Å²	178	143.4 Å²	143.4	77%	0.774	77%	0.766	S	S	*	*			trans	-66.7	94.5	176.3	-164.1	165.1	-176.4	178	0	108.1	N90 N94	N90-K92 VanDerWaalsContact C-N 3.32Å; N90-K92 PolarHBondContact O-N 3.03Å; K92-N94 VanDerWaalsContact C-N 3.29Å; K92-N94 PolarHBondContact O-N 2.97Å
93	N	30.4	Very low	31.5	Very low	132 Å²	132	146.8 Å²	146.8	71%	0.706	78%	0.775	S	S	*	*			trans	-68.6	87.6	177.3	-165	25.8	0	0	0	108.3	L91 N95	L91-N93 VanDerWaalsContact C-N 3.33Å; L91-N93 PolarHBondContact O-N 2.82Å; N93-N95 PolarHBondContact O-N 3.34Å
94	N	30	Very low	31.3	Very low	139 Å²	139	149.5 Å²	149.5	74%	0.743	79%	0.785	S	S	*	*			trans	-71.8	93.3	165.1	-94.3	-1.2	0	0	0	106.8	K92 N96	K92-N94 VanDerWaalsContact C-N 3.29Å; K92-N94 PolarHBondContact O-N 2.97Å; N94-N96 PolarHBondContact O-N 3.44Å
95	N	32.6	Very low	31.1	Very low	121 Å²	121	153.7 Å²	153.7	65%	0.647	79%	0.79	S	S	*	*			trans	-38.7	123.1	151.5	-66.5	-26.8	0	0	0	107.8	N93	N93-N95 PolarHBondContact O-N 3.34Å
96	N	35.8	Very low	31	Very low	139 Å²	139	156.1 Å²	156.1	74%	0.743	80%	0.795	S	S	*	*			trans	-174.9	117.5	139.8	-84.8	-18.4	0	0	0	108.6	N94	N94-N96 PolarHBondContact O-N 3.44Å
97	N	32.9	Very low	31	Very low	145 Å²	145	154 Å²	154	78%	0.775	78%	0.78	S	S	*	*			trans	81	92	146.2	-50.1	-13.6	0	0	0	116.2	D99	N97-D99 PolarHBondContact O-N 3.03Å
98	N	28.9	Very low	30.9	Very low	152 Å²	152	153.4 Å²	153.4	81%	0.813	78%	0.778	S	S	*	*			trans	-18.4	115.6	131	-53.8	-27.9	0	0	0	111.8
99	D	35.7	Very low	31.1	Very low	149 Å²	149	152.7 Å²	152.7	80%	0.797	77%	0.771	S	S	*	*			trans	166.2	140	130.6	-80.9	-24.1	0	0	0	109.8	N97	N97-D99 PolarHBondContact O-N 3.03Å
100	S	34.9	Very low	31.3	Very low	117 Å²	117	149.3 Å²	149.3	82%	0.818	76%	0.76	S	S	*	*			trans	89.6	51.3	170.3	-39.4	0	0	0	0	117.5	N102	S100-N102 PolarHBondContact O-N 2.74Å; S100-N102 VanDerWaalsContact O-N 3.12Å
101	L	30.2	Very low	31.4	Very low	157 Å²	157	149.1 Å²	149.1	82%	0.822	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	2.9	170.3	-112.4	167.5	0	0	0	115.9
102	N	32.1	Very low	31.1	Very low	142 Å²	142	148.8 Å²	148.8	76%	0.759	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	13.8	-161.1	-79.9	-23.8	0	0	0	119.1	S100	S100-N102 PolarHBondContact O-N 2.74Å; S100-N102 VanDerWaalsContact O-N 3.12Å
103	K	32.9	Very low	30.8	Very low	196 Å²	196	147.9 Å²	147.9	85%	0.852	75%	0.75	S	S	*	*	S	Bend	trans	-133.3	8	-176.5	-81.8	-173.1	179.8	175.5	0	119.9
104	L	27.3	Very low	30.8	Very low	166 Å²	166	146.7 Å²	146.7	87%	0.869	75%	0.747	S	S	*	*			trans	-122.9	45.3	176.3	-130.3	80.4	0	0	0	114.2	K106	L104-K106 PolarHBondContact O-N 3.34Å
105	W	26.1	Very low	30.8	Very low	234 Å²	234	144.7 Å²	144.7	89%	0.886	74%	0.742	S	S	*	*			trans	-86.3	24	160	-65.1	84.3	0	0	0	112	S107	W105-S107 PolarHBondContact O-N 2.89Å
106	K	27.6	Very low	31	Very low	178 Å²	178	144.8 Å²	144.8	77%	0.774	75%	0.746	S	S	*	*			trans	-75.3	85.9	160.4	-80.2	-171.6	177.3	-177	0	107.2	L104 N108	L104-K106 PolarHBondContact O-N 3.34Å; K106-N108 PolarHBondContact O-N 2.75Å
107	S	28	Very low	30.8	Very low	64 Å²	64	141.6 Å²	141.6	45%	0.448	75%	0.746	S	S	.	*			trans	-45.2	78	160.7	-177.5	0	0	0	0	110.5	W105 Y109	W105-S107 PolarHBondContact O-N 2.89Å; S107-Y109 VanDerWaalsContact C-N 3.29Å; S107-Y109 VanDerWaalsContact O-CD2 3.27Å; S107-Y109 WeakPolarHBondContact O-CD2 3.07Å; S107-Y109 WeakPolarHBondContact O-CE2 3.32Å; S107-Y109 PolarHBondContact O-N 2.94Å; S107-Y109 VanDerWaalsContact O-N 3.14Å; S107-Y109 WeakPolarHBondContact OG-CD1 3.43Å; S107-Y109 WeakPolarHBondContact OG-CE1 3.48Å
108	N	29.8	Very low	30.8	Very low	138 Å²	138	141.8 Å²	141.8	74%	0.738	75%	0.746	S	S	*	*			trans	-71.3	101.9	152.8	-73.9	-27.7	0	0	0	104.4	K106 C110	K106-N108 PolarHBondContact O-N 2.75Å; N108-C110 PolarHBondContact O-N 2.88Å
109	Y	33	Very low	30.7	Very low	189 Å²	189	140.6 Å²	140.6	74%	0.741	74%	0.738	S	S	*	*			trans	-63.9	62.8	170	-31.4	-93	0	0	0	108.8	S107 L111	S107-Y109 VanDerWaalsContact C-N 3.29Å; S107-Y109 VanDerWaalsContact O-CD2 3.27Å; S107-Y109 WeakPolarHBondContact O-CD2 3.07Å; S107-Y109 WeakPolarHBondContact O-CE2 3.32Å; S107-Y109 PolarHBondContact O-N 2.94Å; S107-Y109 VanDerWaalsContact O-N 3.14Å; S107-Y109 WeakPolarHBondContact OG-CD1 3.43Å; S107-Y109 WeakPolarHBondContact OG-CE1 3.48Å; Y109-L111 PolarHBondContact O-N 2.95Å
110	C	35.4	Very low	30.6	Very low	90 Å²	90	137.4 Å²	137.4	61%	0.608	73%	0.726	S	S	*	*			trans	-72.5	86.2	157.3	-66.3	0	0	0	0	104.1	N108 H112	N108-C110 PolarHBondContact O-N 2.88Å; C110-H112 PolarHBondContact O-CD2 3.35Å; C110-H112 PolarHBondContact O-N 3.48Å
111	L	28.3	Very low	30.6	Very low	141 Å²	141	140.5 Å²	140.5	74%	0.738	73%	0.733	S	S	*	*			trans	-55	84	158.9	-94.3	73.8	0	0	0	105.9	Y109 H113	Y109-L111 PolarHBondContact O-N 2.95Å; L111-H113 PolarHBondContact O-N 2.96Å
112	H	27.4	Very low	30.8	Very low	158 Å²	158	137.1 Å²	137.1	73%	0.731	72%	0.722	S	S	*	*			trans	-65.4	91.5	155.5	-74.7	-82.5	0	0	0	103.9	C110 V114	C110-H112 PolarHBondContact O-CD2 3.35Å; C110-H112 PolarHBondContact O-N 3.48Å; H112-V114 PolarHBondContact O-N 3.26Å
113	H	27.7	Very low	30.8	Very low	159 Å²	159	136.7 Å²	136.7	74%	0.736	72%	0.719	S	S	*	*			trans	-66.8	80.5	172.5	-152.7	-81.8	0	0	0	105.4	L111 P115	L111-H113 PolarHBondContact O-N 2.96Å; H113-P115 WeakPolarHBondContact O-CD 3.37Å; H113-P115 VanDerWaalsContact O-N 3.07Å
114	V	31.1	Very low	30.8	Very low	107 Å²	107	132.8 Å²	132.8	65%	0.648	71%	0.712	S	S	*	*			trans	-61.2	114.9	175.8	178.6	0	0	0	0	105	H112 V116	H112-V114 PolarHBondContact O-N 3.26Å; V114-V116 PolarHBondContact O-N 3.08Å
115	P	29.1	Very low	31.2	Very low	97 Å²	97	129.7 Å²	129.7	63%	0.63	70%	0.703	S	S	*	*			trans	-60.3	117.2	-177.3	22.5	-30.7	0	0	0	108	H113 G117	H113-P115 WeakPolarHBondContact O-CD 3.37Å; H113-P115 VanDerWaalsContact O-N 3.07Å; P115-G117 PolarHBondContact O-N 2.95Å
116	V	37.4	Very low	31.4	Very low	122 Å²	122	128.3 Å²	128.3	74%	0.739	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-63.4	-1.8	178.4	-171.5	0	0	0	0	111.6	V114 I118	V114-V116 PolarHBondContact O-N 3.08Å; V116-I118 VanDerWaalsContact C-N 3.34Å; V116-I118 PolarHBondContact O-N 2.82Å
117	G	31.9	Very low	32	Very low	72 Å²	72	129.4 Å²	129.4	74%	0.742	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-72.4	-13.8	-174.9	0	0	0	0	0	116.3	P115	P115-G117 PolarHBondContact O-N 2.95Å
118	I	31.2	Very low	32.8	Very low	150 Å²	150	132.5 Å²	132.5	77%	0.769	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-142.8	39.4	-177	-32.9	173.1	0	0	0	111.7	V116 P120	V116-I118 VanDerWaalsContact C-N 3.34Å; V116-I118 PolarHBondContact O-N 2.82Å; I118-P120 WeakPolarHBondContact O-CD 3.5Å
119	L	27.8	Very low	33.3	Very low	126 Å²	126	130.2 Å²	130.2	66%	0.66	71%	0.705	S	S	*	*			trans	-72.8	111.8	153.4	-91.5	149.3	0	0	0	105.4	L121	L119-L121 PolarHBondContact O-N 3.38Å
120	P	32.4	Very low	34.1	Very low	83 Å²	83	133.1 Å²	133.1	54%	0.539	72%	0.715	S	S	.	*			trans	-56.3	117	171.6	-13.5	28.4	0	0	0	105.2	I118 S122	I118-P120 WeakPolarHBondContact O-CD 3.5Å; P120-S122 PolarHBondContact O-N 2.92Å
121	L	35.9	Very low	34.6	Very low	182 Å²	182	132.5 Å²	132.5	95%	0.953	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	7.8	179.1	-70.8	167.9	0	0	0	112.7	L119	L119-L121 PolarHBondContact O-N 3.38Å
122	S	34.1	Very low	35.5	Very low	85 Å²	85	131 Å²	131	59%	0.594	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-2	-177.7	56.6	0	0	0	0	115.6	P120	P120-S122 PolarHBondContact O-N 2.92Å
123	L	32.1	Very low	36.8	Very low	134 Å²	134	129 Å²	129	70%	0.702	70%	0.697	S	S	*	*			trans	-130.3	19.5	-169.5	-73.8	175.6	0	0	0	119.2	C125	L123-C125 PolarHBondContact O-N 2.84Å
124	T	33.8	Very low	38.1	Very low	114 Å²	114	127.7 Å²	127.7	70%	0.699	69%	0.694	S	S	*	*			trans	-88.5	69.6	151.8	66.3	0	0	0	0	109.6	R126	T124-R126 PolarHBondContact O-N 2.77Å
125	C	35.8	Very low	39.1	Very low	100 Å²	100	126.2 Å²	126.2	68%	0.676	68%	0.682	S	S	*	*			trans	-66.3	50.7	154.4	-67.5	0	0	0	0	109.5	L123 K127	L123-C125 PolarHBondContact O-N 2.84Å; C125-K127 PolarHBondContact O-N 2.72Å; C125-K127 VanDerWaalsContact O-N 3.15Å
126	R	30.7	Very low	40.2	Very low	205 Å²	205	122.4 Å²	122.4	77%	0.774	66%	0.66	S	S	*	*			trans	-63.6	115.9	151.5	-74.9	-176.4	177.3	155	0.8	102.6	T124 I128	T124-R126 PolarHBondContact O-N 2.77Å; R126-I128 WeakPolarHBondContact O-CD1 3.19Å; R126-I128 PolarHBondContact O-N 2.69Å
127	K	38.9	Very low	40.8	Very low	201 Å²	201	121.8 Å²	121.8	87%	0.874	65%	0.652	S	S	*	*			trans	-38.5	100.5	169.7	-82.7	178	174.3	176.8	0	106.2	C125 P129	C125-K127 PolarHBondContact O-N 2.72Å; C125-K127 VanDerWaalsContact O-N 3.15Å; K127-P129 WeakPolarHBondContact O-CD 3.44Å
128	I	44.5	Very low	41.9	Very low	130 Å²	130	123.2 Å²	123.2	67%	0.667	64%	0.638	S	S	*	*			trans	-63.3	111	174.2	-71.1	103.3	0	0	0	100.9	R126 R130 L131	R126-I128 WeakPolarHBondContact O-CD1 3.19Å; R126-I128 PolarHBondContact O-N 2.69Å; I128-R130 PolarHBondContact O-N 2.86Å; I128-L131 HydrophobicContact CG2-CD1 4.17Å
129	P	41.6	Very low	42.8	Very low	89 Å²	89	125.5 Å²	125.5	58%	0.578	64%	0.638	S	S	*	*			trans	-52	145.5	173.3	20.8	-27.2	0	0	0	105.9	K127 L131	K127-P129 WeakPolarHBondContact O-CD 3.44Å; P129-L131 HydrophobicContact CG-CD1 4.25Å; P129-L131 HydrophobicContact CG-CG 4.11Å; P129-L131 WeakPolarHBondContact O-CG 3.36Å; P129-L131 PolarHBondContact O-N 2.84Å
130	R	48.5	Very low	43.8	Very low	251 Å²	251	128.6 Å²	128.6	95%	0.947	65%	0.647	S	S	*	*			trans	-58.9	85.4	176.8	-75.2	-169	176.3	160.1	-1.1	108.1	I128 D132	I128-R130 PolarHBondContact O-N 2.86Å; R130-D132 PolarHBondContact O-N 3.29Å
131	L	46.9	Very low	45	Very low	76 Å²	76	128.1 Å²	128.1	40%	0.398	64%	0.642	S	S	.	*			trans	-83.7	98.1	176.3	-74.7	161.3	0	0	0	101.5	I128 P129 T133 N135	I128-L131 HydrophobicContact CG2-CD1 4.17Å; P129-L131 HydrophobicContact CG-CD1 4.25Å; P129-L131 HydrophobicContact CG-CG 4.11Å; P129-L131 WeakPolarHBondContact O-CG 3.36Å; P129-L131 PolarHBondContact O-N 2.84Å; L131-T133 PolarHBondContact O-N 2.77Å; L131-N135 HydrophobicContact CD2-CB 3.96Å
132	D	47.3	Very low	45.6	Very low	110 Å²	110	122 Å²	122	59%	0.588	62%	0.624	S	S	*	*			trans	-44.1	138.2	159.2	-69.9	-28.6	0	0	0	107.2	R130 I134 N135 G136	R130-D132 PolarHBondContact O-N 3.29Å; D132-I134 CarbonylContact O-C 3.57Å; D132-I134 PolarHBondContact O-N 3.4Å; D132-N135 WeakPolarHBondContact O-CA 3.24Å; D132-N135 WeakPolarHBondContact O-CB 3.14Å; D132-N135 PolarHBondContact O-N 3.41Å; D132-G136 PolarHBondContact O-N 2.67Å
133	T	54.2	Low	46.4	Very low	117 Å²	117	121.7 Å²	121.7	72%	0.718	62%	0.615	S	S	*	*	H	α-helix	trans	-45.3	-34.8	-175.7	43.5	0	0	0	0	112.3	L131 G136 L137	L131-T133 PolarHBondContact O-N 2.77Å; T133-G136 PolarHBondContact O-N 3.47Å; T133-L137 WeakPolarHBondContact O-CB 3.12Å; T133-L137 WeakPolarHBondContact O-CD1 3.5Å; T133-L137 PolarHBondContact O-N 3.32Å
134	I	55.5	Low	47.3	Very low	131 Å²	131	125.9 Å²	125.9	67%	0.672	62%	0.621	S	S	*	*	H	α-helix	trans	-61.2	-47.1	175	-53.8	175.2	0	0	0	112.5	D132 K138	D132-I134 CarbonylContact O-C 3.57Å; D132-I134 PolarHBondContact O-N 3.4Å; I134-K138 WeakPolarHBondContact O-CB 3.31Å; I134-K138 PolarHBondContact O-N 2.74Å
135	N	50.8	Low	47.7	Very low	75 Å²	75	126.7 Å²	126.7	40%	0.401	62%	0.621	S	S	.	*	H	α-helix	trans	-72.2	-34.7	178.6	-73.1	-29.3	0	0	0	112.1	L131 D132 K138 Y139	L131-N135 HydrophobicContact CD2-CB 3.96Å; D132-N135 WeakPolarHBondContact O-CA 3.24Å; D132-N135 WeakPolarHBondContact O-CB 3.14Å; D132-N135 PolarHBondContact O-N 3.41Å; N135-K138 WeakPolarHBondContact O-CB 3.01Å; N135-K138 PolarHBondContact O-N 3.38Å; N135-Y139 PolarHBondContact O-N 3.44Å
136	G	53	Low	47.8	Very low	17 Å²	17	130.4 Å²	130.4	18%	0.175	62%	0.622	C	S	.	*	H	α-helix	trans	-61.2	-47.8	173.1	0	0	0	0	0	111.4	D132 T133 K138 Y139 F140	D132-G136 PolarHBondContact O-N 2.67Å; T133-G136 PolarHBondContact O-N 3.47Å; G136-K138 VanDerWaalsContact C-N 3.33Å; G136-K138 PolarHBondContact O-N 3.38Å; G136-Y139 PolarHBondContact O-N 2.75Å; G136-F140 PolarHBondContact O-N 2.82Å
137	L	50.4	Low	48.3	Very low	110 Å²	110	124.5 Å²	124.5	58%	0.576	61%	0.613	S	S	*	*	H	α-helix	trans	-61	-40.9	173.4	-98.4	121.6	0	0	0	111.9	T133 Y139 F140 T141	T133-L137 WeakPolarHBondContact O-CB 3.12Å; T133-L137 WeakPolarHBondContact O-CD1 3.5Å; T133-L137 PolarHBondContact O-N 3.32Å; L137-Y139 VanDerWaalsContact C-N 3.28Å; L137-Y139 PolarHBondContact O-N 3.09Å; L137-F140 PolarHBondContact O-N 3.4Å; L137-T141 HydrophobicContact CD2-CG2 4.35Å; L137-T141 WeakPolarHBondContact O-CB 3.4Å; L137-T141 WeakPolarHBondContact O-CG2 3.12Å; L137-T141 PolarHBondContact O-N 3.12Å; L137-T141 PolarHBondContact O-OG1 2.76Å
138	K	55.2	Low	48.6	Very low	102 Å²	102	121 Å²	121	44%	0.443	61%	0.608	S	S	.	*	H	α-helix	trans	-59.5	-38.4	175.8	-168.1	175.5	-172.5	175.1	0	112.4	I134 N135 G136 G142	I134-K138 WeakPolarHBondContact O-CB 3.31Å; I134-K138 PolarHBondContact O-N 2.74Å; N135-K138 WeakPolarHBondContact O-CB 3.01Å; N135-K138 PolarHBondContact O-N 3.38Å; G136-K138 VanDerWaalsContact C-N 3.33Å; G136-K138 PolarHBondContact O-N 3.38Å; K138-G142 PolarHBondContact O-N 3.42Å
139	Y	50.6	Low	48.5	Very low	197 Å²	197	125.2 Å²	125.2	77%	0.773	62%	0.615	S	S	*	*	H	α-helix	trans	-70.5	-41.1	177.2	-152	-84.8	0	0	0	112.1	N135 G136 L137	N135-Y139 PolarHBondContact O-N 3.44Å; G136-Y139 PolarHBondContact O-N 2.75Å; L137-Y139 VanDerWaalsContact C-N 3.28Å; L137-Y139 PolarHBondContact O-N 3.09Å
140	F	48.1	Very low	48.5	Very low	192 Å²	192	129.6 Å²	129.6	84%	0.842	63%	0.628	S	S	*	*	H	α-helix	trans	-76.4	-34.6	-178.4	-96.2	-82.2	0	0	0	114.2	G136 L137	G136-F140 PolarHBondContact O-N 2.82Å; L137-F140 PolarHBondContact O-N 3.4Å
141	T	58.1	Low	48	Very low	72 Å²	72	125.3 Å²	125.3	44%	0.442	61%	0.612	S	S	.	*	H	α-helix	trans	-89.5	-7.8	-174.5	57.6	0	0	0	0	113.2	L137 L143	L137-T141 HydrophobicContact CD2-CG2 4.35Å; L137-T141 WeakPolarHBondContact O-CB 3.4Å; L137-T141 WeakPolarHBondContact O-CG2 3.12Å; L137-T141 PolarHBondContact O-N 3.12Å; L137-T141 PolarHBondContact O-OG1 2.76Å; T141-L143 PolarHBondContact O-N 3.49Å; T141-L143 VanDerWaalsContact O-N 3.11Å; T141-L143 VanDerWaalsContact OG1-CG 3.31Å; T141-L143 WeakPolarHBondContact OG1-CG 3.18Å
142	G	48	Very low	47.7	Very low	54 Å²	54	125.6 Å²	125.6	56%	0.557	62%	0.618	S	S	*	*			trans	63.4	14.8	-178.2	0	0	0	0	0	113.6	K138 R144	K138-G142 PolarHBondContact O-N 3.42Å; G142-R144 PolarHBondContact O-N 3.06Å
143	L	51.4	Low	47.7	Very low	78 Å²	78	125.8 Å²	125.8	41%	0.408	63%	0.626	S	S	.	*			trans	-71	80.4	179.7	-63.5	-178.5	0	0	0	109.6	T141 N145 Y146	T141-L143 PolarHBondContact O-N 3.49Å; T141-L143 VanDerWaalsContact O-N 3.11Å; T141-L143 VanDerWaalsContact OG1-CG 3.31Å; T141-L143 WeakPolarHBondContact OG1-CG 3.18Å; L143-N145 PolarHBondContact O-N 3.33Å; L143-Y146 HydrophobicContact CB-CD2 4.27Å; L143-Y146 HydrophobicContact CB-CE2 4.13Å; L143-Y146 HydrophobicContact CD1-CD2 4.4Å; L143-Y146 HydrophobicContact CD1-CE2 4.05Å; L143-Y146 HydrophobicContact CD2-CE2 3.76Å; L143-Y146 HydrophobicContact CG-CE2 4.16Å
144	R	49.5	Very low	47.5	Very low	223 Å²	223	127.6 Å²	127.6	84%	0.842	63%	0.629	S	S	*	*			trans	-62.8	113.1	167.2	-70.9	-178.6	-171.2	147.9	2.4	107.1	G142	G142-R144 PolarHBondContact O-N 3.06Å
145	N	42.2	Very low	47.1	Very low	131 Å²	131	126.3 Å²	126.3	70%	0.701	62%	0.622	S	S	*	*			trans	57.9	62.2	158.3	-52.1	-24.9	0	0	0	115.9	L143 S147	L143-N145 PolarHBondContact O-N 3.33Å; N145-S147 VanDerWaalsContact C-N 3.3Å; N145-S147 PolarHBondContact O-N 2.84Å
146	Y	39.2	Very low	46.8	Very low	177 Å²	177	122.9 Å²	122.9	69%	0.694	61%	0.605	S	S	*	*			trans	-77.9	100.5	135.2	-56.8	-66.2	0	0	0	105.7	L143 V148	L143-Y146 HydrophobicContact CB-CD2 4.27Å; L143-Y146 HydrophobicContact CB-CE2 4.13Å; L143-Y146 HydrophobicContact CD1-CD2 4.4Å; L143-Y146 HydrophobicContact CD1-CE2 4.05Å; L143-Y146 HydrophobicContact CD2-CE2 3.76Å; L143-Y146 HydrophobicContact CG-CE2 4.16Å; Y146-V148 PolarHBondContact O-N 3.29Å
147	S	40.4	Very low	46.8	Very low	82 Å²	82	126 Å²	126	57%	0.573	62%	0.622	S	S	*	*			trans	-47.8	129.3	167.1	-177.1	0	0	0	0	106.9	N145 R149	N145-S147 VanDerWaalsContact C-N 3.3Å; N145-S147 PolarHBondContact O-N 2.84Å; S147-R149 PolarHBondContact O-N 3.22Å
148	V	45.3	Very low	46.7	Very low	127 Å²	127	125.9 Å²	125.9	77%	0.77	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	14.3	177.1	168.6	0	0	0	0	112.4	Y146	Y146-V148 PolarHBondContact O-N 3.29Å
149	R	42.5	Very low	46.4	Very low	219 Å²	219	123.8 Å²	123.8	83%	0.826	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-2.4	-170	-68.6	-176.6	159.3	-91.9	-1.1	115.5	S147	S147-R149 PolarHBondContact O-N 3.22Å
150	E	41.1	Very low	46.4	Very low	181 Å²	181	120.5 Å²	120.5	85%	0.846	61%	0.606	S	S	*	*			trans	-121.6	74.4	169.9	-69.7	-175.3	-172.3	0	0	109.3
151	R	38.4	Very low	46.7	Very low	161 Å²	161	114.6 Å²	114.6	61%	0.608	59%	0.589	S	S	*	*			trans	-62.5	127.8	164.4	-107	-179.1	171.4	82.9	-1.7	107.1
152	P	40	Very low	46.5	Very low	81 Å²	81	116.9 Å²	116.9	53%	0.526	60%	0.595	S	S	.	*			trans	-55.9	130.2	174.2	20.1	-29.7	0	0	0	109.1	I154 I155	P152-I154 PolarHBondContact O-N 3.43Å; P152-I155 PolarHBondContact O-N 2.9Å
153	P	48.1	Very low	46.8	Very low	115 Å²	115	119.4 Å²	119.4	75%	0.747	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	9.6	-166.2	24.3	-33	0	0	0	115.6
154	I	50.9	Low	47.2	Very low	154 Å²	154	119.9 Å²	119.9	79%	0.79	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-26.7	-177.8	-53.3	173.4	0	0	0	111.6	P152	P152-I154 PolarHBondContact O-N 3.43Å
155	I	45.2	Very low	47.6	Very low	104 Å²	104	111.9 Å²	111.9	53%	0.533	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.6	-14	179.6	-65.2	151.2	0	0	0	111.8	P152 I159	P152-I155 PolarHBondContact O-N 2.9Å; I155-I159 HydrophobicContact CG2-CD1 3.67Å; I155-I159 HydrophobicContact CG2-CG1 4.34Å
156	G	45.8	Very low	48.1	Very low	4 Å²	4	109.4 Å²	109.4	4%	0.041	56%	0.56	C	S	.	*	H	α-helix	trans	-53.7	-53.1	175	0	0	0	0	0	113.4	L158 I159 E160	G156-L158 VanDerWaalsContact C-N 3.33Å; G156-L158 PolarHBondContact O-N 2.88Å; G156-I159 PolarHBondContact O-N 3.16Å; G156-E160 WeakPolarHBondContact O-CA 3.45Å; G156-E160 WeakPolarHBondContact O-CB 3.38Å; G156-E160 WeakPolarHBondContact O-CG 3.2Å; G156-E160 PolarHBondContact O-N 2.85Å
157	P	52.2	Low	49	Very low	81 Å²	81	107.7 Å²	107.7	53%	0.526	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-34.9	-170.5	-24	33.3	0	0	0	114.3	S161	P157-S161 VanDerWaalsContact O-CB 3.31Å; P157-S161 WeakPolarHBondContact O-CB 3.4Å; P157-S161 PolarHBondContact O-N 2.73Å; P157-S161 PolarHBondContact O-OG 2.81Å
158	L	48.2	Very low	49.8	Very low	109 Å²	109	109.9 Å²	109.9	57%	0.571	56%	0.558	S	S	*	*	H	α-helix	trans	-73.1	-49.8	-177.4	-167.6	68.2	0	0	0	111.1	G156 E160 S161 E162	G156-L158 VanDerWaalsContact C-N 3.33Å; G156-L158 PolarHBondContact O-N 2.88Å; L158-E160 VanDerWaalsContact C-N 3.31Å; L158-E160 PolarHBondContact O-N 3.33Å; L158-S161 PolarHBondContact O-N 3.06Å; L158-S161 PolarHBondContact O-OG 2.82Å; L158-E162 PolarHBondContact O-N 2.78Å
159	I	50.2	Low	50.2	Low	57 Å²	57	106 Å²	106	29%	0.292	53%	0.532	S	S	.	.	H	α-helix	trans	-69.5	-33.2	177.7	-58.7	173	0	0	0	110.4	I155 G156 E162 M163	I155-I159 HydrophobicContact CG2-CD1 3.67Å; I155-I159 HydrophobicContact CG2-CG1 4.34Å; G156-I159 PolarHBondContact O-N 3.16Å; I159-E162 PolarHBondContact O-N 3.36Å; I159-M163 HydrophobicContact CG2-CE 4.42Å; I159-M163 HydrophobicContact CG2-CG 3.94Å; I159-M163 WeakPolarHBondContact O-CB 3.49Å; I159-M163 WeakPolarHBondContact O-CG 3.25Å; I159-M163 PolarHBondContact O-N 2.8Å
160	E	49.1	Very low	50.7	Low	128 Å²	128	103.2 Å²	103.2	60%	0.598	53%	0.526	S	S	*	.	H	α-helix	trans	-67.7	-41	173.8	-74.5	171	-158.4	0	0	111.1	G156 L158 E162 M163 N164	G156-E160 WeakPolarHBondContact O-CA 3.45Å; G156-E160 WeakPolarHBondContact O-CB 3.38Å; G156-E160 WeakPolarHBondContact O-CG 3.2Å; G156-E160 PolarHBondContact O-N 2.85Å; L158-E160 VanDerWaalsContact C-N 3.31Å; L158-E160 PolarHBondContact O-N 3.33Å; E160-E162 VanDerWaalsContact C-N 3.27Å; E160-E162 PolarHBondContact O-N 2.84Å; E160-M163 CarbonylContact O-C 3.54Å; E160-M163 PolarHBondContact O-N 3.34Å; E160-N164 WeakPolarHBondContact O-CA 3.39Å; E160-N164 WeakPolarHBondContact O-CB 3.36Å; E160-N164 PolarHBondContact O-N 3.22Å
161	S	55.1	Low	51.3	Low	68 Å²	68	102.1 Å²	102.1	48%	0.476	52%	0.521	S	S	.	.	H	α-helix	trans	-61.1	-39.1	173.6	73.8	0	0	0	0	111.6	P157 L158 C165	P157-S161 VanDerWaalsContact O-CB 3.31Å; P157-S161 WeakPolarHBondContact O-CB 3.4Å; P157-S161 PolarHBondContact O-N 2.73Å; P157-S161 PolarHBondContact O-OG 2.81Å; L158-S161 PolarHBondContact O-N 3.06Å; L158-S161 PolarHBondContact O-OG 2.82Å; S161-C165 WeakPolarHBondContact O-CB 3.11Å; S161-C165 PolarHBondContact O-N 2.68Å
162	E	54.9	Low	51.8	Low	121 Å²	121	96.7 Å²	96.7	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-70.8	-42	177	-167.8	176.8	-166.1	0	0	111.7	L158 I159 E160 L166	L158-E162 PolarHBondContact O-N 2.78Å; I159-E162 PolarHBondContact O-N 3.36Å; E160-E162 VanDerWaalsContact C-N 3.27Å; E160-E162 PolarHBondContact O-N 2.84Å; E162-L166 WeakPolarHBondContact O-CB 3.44Å; E162-L166 VanDerWaalsContact O-CG 3.25Å; E162-L166 WeakPolarHBondContact O-CG 3.34Å; E162-L166 PolarHBondContact O-N 2.81Å
163	M	54.1	Low	52.3	Low	106 Å²	106	96.4 Å²	96.4	52%	0.522	50%	0.499	S	S	.	.	H	α-helix	trans	-71.8	-30.3	176.6	-73.3	-75.7	164.6	0	0	112.7	I159 E160 L166 K167	I159-M163 HydrophobicContact CG2-CE 4.42Å; I159-M163 HydrophobicContact CG2-CG 3.94Å; I159-M163 WeakPolarHBondContact O-CB 3.49Å; I159-M163 WeakPolarHBondContact O-CG 3.25Å; I159-M163 PolarHBondContact O-N 2.8Å; E160-M163 CarbonylContact O-C 3.54Å; E160-M163 PolarHBondContact O-N 3.34Å; M163-L166 CarbonylContact O-C 3.58Å; M163-L166 HydrophobicContact SD-CD1 4.36Å; M163-K167 WeakPolarHBondContact O-CB 3.35Å; M163-K167 WeakPolarHBondContact O-CG 3.48Å; M163-K167 PolarHBondContact O-N 2.79Å
164	N	59.4	Low	52.6	Low	89 Å²	89	98.7 Å²	98.7	48%	0.476	50%	0.5	S	S	.	.	H	α-helix	trans	-78.8	-39.4	176.5	-150.4	21.2	0	0	0	109.5	E160 L166 K167 E168	E160-N164 WeakPolarHBondContact O-CA 3.39Å; E160-N164 WeakPolarHBondContact O-CB 3.36Å; E160-N164 PolarHBondContact O-N 3.22Å; N164-L166 VanDerWaalsContact C-N 3.3Å; N164-L166 PolarHBondContact O-N 2.74Å; N164-K167 CarbonylContact O-C 3.59Å; N164-K167 PolarHBondContact O-N 2.86Å; N164-K167 VanDerWaalsContact O-N 3.09Å; N164-E168 WeakPolarHBondContact O-CB 3.34Å; N164-E168 WeakPolarHBondContact O-CG 3.12Å; N164-E168 PolarHBondContact O-N 3.45Å
165	C	56.7	Low	52.5	Low	54 Å²	54	101.1 Å²	101.1	37%	0.365	50%	0.501	S	S	.	.	H	α-helix	trans	-57.5	-44.8	165.8	-169.9	0	0	0	0	110.4	S161 K167 L169	S161-C165 WeakPolarHBondContact O-CB 3.11Å; S161-C165 PolarHBondContact O-N 2.68Å; C165-K167 VanDerWaalsContact C-N 3.34Å; C165-K167 PolarHBondContact O-N 3.34Å; C165-L169 WeakPolarHBondContact O-CB 3.26Å; C165-L169 WeakPolarHBondContact O-CD1 3.17Å; C165-L169 WeakPolarHBondContact O-CG 3.45Å; C165-L169 PolarHBondContact O-N 3.42Å
166	L	53.1	Low	52.9	Low	80 Å²	80	100.4 Å²	100.4	42%	0.419	50%	0.497	S	S	.	.	H	α-helix	trans	-66	-30.5	173.7	-77.2	166.6	0	0	0	113.6	E162 M163 N164 K170	E162-L166 WeakPolarHBondContact O-CB 3.44Å; E162-L166 VanDerWaalsContact O-CG 3.25Å; E162-L166 WeakPolarHBondContact O-CG 3.34Å; E162-L166 PolarHBondContact O-N 2.81Å; M163-L166 CarbonylContact O-C 3.58Å; M163-L166 HydrophobicContact SD-CD1 4.36Å; N164-L166 VanDerWaalsContact C-N 3.3Å; N164-L166 PolarHBondContact O-N 2.74Å; L166-K170 WeakPolarHBondContact O-CB 3.3Å; L166-K170 WeakPolarHBondContact O-CG 3.37Å; L166-K170 PolarHBondContact O-N 3.12Å
167	K	59.7	Low	53.7	Low	141 Å²	141	106 Å²	106	61%	0.613	53%	0.527	S	S	*	.	H	α-helix	trans	-76.3	-45.4	175.6	-87.7	-178.2	178.5	178.7	0	111.8	M163 N164 C165 L169 K170 Q171	M163-K167 WeakPolarHBondContact O-CB 3.35Å; M163-K167 WeakPolarHBondContact O-CG 3.48Å; M163-K167 PolarHBondContact O-N 2.79Å; N164-K167 CarbonylContact O-C 3.59Å; N164-K167 PolarHBondContact O-N 2.86Å; N164-K167 VanDerWaalsContact O-N 3.09Å; C165-K167 VanDerWaalsContact C-N 3.34Å; C165-K167 PolarHBondContact O-N 3.34Å; K167-L169 PolarHBondContact O-N 3.46Å; K167-K170 CarbonylContact O-C 3.58Å; K167-K170 PolarHBondContact O-N 3.11Å; K167-K170 VanDerWaalsContact O-N 3.12Å; K167-Q171 WeakPolarHBondContact O-CB 3.39Å; K167-Q171 PolarHBondContact O-N 3.3Å
168	E	56.9	Low	54.1	Low	128 Å²	128	109.1 Å²	109.1	60%	0.598	53%	0.534	S	S	*	.	H	α-helix	trans	-58	-38.8	170.1	-75.8	-177.2	167.7	0	0	109.9	N164 Q171 S172	N164-E168 WeakPolarHBondContact O-CB 3.34Å; N164-E168 WeakPolarHBondContact O-CG 3.12Å; N164-E168 PolarHBondContact O-N 3.45Å; E168-Q171 PolarHBondContact O-N 3.13Å; E168-S172 WeakPolarHBondContact O-CB 3.44Å; E168-S172 PolarHBondContact O-N 3.38Å; E168-S172 PolarHBondContact O-OG 3.49Å
169	L	52.2	Low	54.6	Low	45 Å²	45	113.5 Å²	113.5	24%	0.236	54%	0.543	C	S	.	.	H	α-helix	trans	-67.5	-41.7	172.1	-75.1	168.7	0	0	0	112.3	C165 K167 Q171 S172 Q173	C165-L169 WeakPolarHBondContact O-CB 3.26Å; C165-L169 WeakPolarHBondContact O-CD1 3.17Å; C165-L169 WeakPolarHBondContact O-CG 3.45Å; C165-L169 PolarHBondContact O-N 3.42Å; K167-L169 PolarHBondContact O-N 3.46Å; L169-Q171 VanDerWaalsContact C-N 3.33Å; L169-Q171 PolarHBondContact O-N 3.2Å; L169-S172 VanDerWaalsContact CA-OG 3.3Å; L169-S172 WeakPolarHBondContact CA-OG 3.37Å; L169-S172 CarbonylContact O-C 3.55Å; L169-S172 PolarHBondContact O-N 3.09Å; L169-S172 PolarHBondContact O-OG 3.48Å; L169-S172 VanDerWaalsContact O-OG 3.12Å; L169-Q173 WeakPolarHBondContact O-CA 3.38Å; L169-Q173 VanDerWaalsContact O-CB 3.26Å; L169-Q173 WeakPolarHBondContact O-CB 3.33Å; L169-Q173 PolarHBondContact O-N 2.95Å
170	K	53.2	Low	55.1	Low	161 Å²	161	116.6 Å²	116.6	70%	0.7	56%	0.556	S	S	*	*	H	α-helix	trans	-65.8	-35	173.9	-84.8	-174.1	178.4	-171.2	0	112.8	L166 K167 Q173	L166-K170 WeakPolarHBondContact O-CB 3.3Å; L166-K170 WeakPolarHBondContact O-CG 3.37Å; L166-K170 PolarHBondContact O-N 3.12Å; K167-K170 CarbonylContact O-C 3.58Å; K167-K170 PolarHBondContact O-N 3.11Å; K167-K170 VanDerWaalsContact O-N 3.12Å; K170-Q173 WeakPolarHBondContact O-CB 3.46Å; K170-Q173 PolarHBondContact O-N 3.32Å
171	Q	53.3	Low	55.4	Low	158 Å²	158	111.7 Å²	111.7	74%	0.738	53%	0.533	S	S	*	.	H	α-helix	trans	-75.7	-30.8	177.7	-162.7	155.1	24.9	0	0	111.1	K167 E168 L169	K167-Q171 WeakPolarHBondContact O-CB 3.39Å; K167-Q171 PolarHBondContact O-N 3.3Å; E168-Q171 PolarHBondContact O-N 3.13Å; L169-Q171 VanDerWaalsContact C-N 3.33Å; L169-Q171 PolarHBondContact O-N 3.2Å
172	S	49.3	Very low	55.3	Low	47 Å²	47	113.6 Å²	113.6	33%	0.329	54%	0.536	S	S	.	.	H	α-helix	trans	-83.3	-13.4	168.2	56.5	0	0	0	0	113.8	E168 L169 E174 Y175 L176	E168-S172 WeakPolarHBondContact O-CB 3.44Å; E168-S172 PolarHBondContact O-N 3.38Å; E168-S172 PolarHBondContact O-OG 3.49Å; L169-S172 VanDerWaalsContact CA-OG 3.3Å; L169-S172 WeakPolarHBondContact CA-OG 3.37Å; L169-S172 CarbonylContact O-C 3.55Å; L169-S172 PolarHBondContact O-N 3.09Å; L169-S172 PolarHBondContact O-OG 3.48Å; L169-S172 VanDerWaalsContact O-OG 3.12Å; S172-E174 PolarHBondContact O-N 3.5Å; S172-Y175 PolarHBondContact O-N 3.17Å; S172-Y175 VanDerWaalsContact O-N 3.11Å; S172-L176 PolarHBondContact O-N 3.12Å
173	Q	50.8	Low	55.9	Low	75 Å²	75	112.9 Å²	112.9	35%	0.35	54%	0.536	S	S	.	.	H	α-helix	trans	-61.9	-29.9	176.4	-169.1	71.9	69.2	0	0	111.5	L169 K170 Y175	L169-Q173 WeakPolarHBondContact O-CA 3.38Å; L169-Q173 VanDerWaalsContact O-CB 3.26Å; L169-Q173 WeakPolarHBondContact O-CB 3.33Å; L169-Q173 PolarHBondContact O-N 2.95Å; K170-Q173 WeakPolarHBondContact O-CB 3.46Å; K170-Q173 PolarHBondContact O-N 3.32Å; Q173-Y175 PolarHBondContact O-N 3.36Å; Q173-Y175 VanDerWaalsContact O-N 3.13Å
174	E	54.4	Low	56.6	Low	163 Å²	163	113.2 Å²	113.2	76%	0.762	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.9	177.1	-80.3	-174	160.6	0	0	113.4	S172	S172-E174 PolarHBondContact O-N 3.5Å
175	Y	47.9	Very low	56.7	Low	205 Å²	205	112.3 Å²	112.3	80%	0.804	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	-2.9	-176.8	-82.6	-80	0	0	0	117.1	S172 Q173	S172-Y175 PolarHBondContact O-N 3.17Å; S172-Y175 VanDerWaalsContact O-N 3.11Å; Q173-Y175 PolarHBondContact O-N 3.36Å; Q173-Y175 VanDerWaalsContact O-N 3.13Å
176	L	53.9	Low	56.7	Low	89 Å²	89	113.4 Å²	113.4	47%	0.466	53%	0.534	S	S	.	.	S	Bend	trans	-130.5	121.9	-176.8	-74.5	170.1	0	0	0	113.4	S172 E178 Q181	S172-L176 PolarHBondContact O-N 3.12Å; L176-E178 PolarHBondContact O-N 3.47Å; L176-Q181 HydrophobicContact CB-CG 4.43Å; L176-Q181 PolarHBondContact O-NE2 2.89Å
177	N	62.2	Low	57.4	Low	122 Å²	122	115.8 Å²	115.8	65%	0.652	54%	0.542	S	S	*	.			trans	-43.6	117.2	179.9	-152.3	-13	0	0	0	110.7	R179 Q180	N177-R179 PolarHBondContact O-N 3.41Å; N177-Q180 PolarHBondContact O-N 2.93Å
178	E	61	Low	57.4	Low	145 Å²	145	112.3 Å²	112.3	68%	0.678	53%	0.528	S	S	*	.	H	α-helix	trans	-45.7	-32	-171.8	-66.3	-177.4	167.9	0	0	113.6	L176 Q181 M182	L176-E178 PolarHBondContact O-N 3.47Å; E178-Q181 PolarHBondContact O-N 2.85Å; E178-M182 WeakPolarHBondContact O-CG 3.41Å; E178-M182 PolarHBondContact O-N 3.22Å
179	R	58.7	Low	57.4	Low	202 Å²	202	109.9 Å²	109.9	76%	0.762	52%	0.518	S	S	*	.	H	α-helix	trans	-68.9	-34	-179.4	-161.9	156.9	-178.5	119.9	-3.7	114.2	N177 N183	N177-R179 PolarHBondContact O-N 3.41Å; R179-N183 PolarHBondContact O-N 3.38Å
180	Q	60.9	Low	57.7	Low	121 Å²	121	110.3 Å²	110.3	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-70.9	-38.4	174.9	-70.1	-178.8	-3.2	0	0	110.7	N177 N183 M184	N177-Q180 PolarHBondContact O-N 2.93Å; Q180-N183 PolarHBondContact O-N 2.9Å; Q180-M184 PolarHBondContact O-N 3.48Å
181	Q	54.8	Low	57.9	Low	26 Å²	26	107.3 Å²	107.3	12%	0.121	51%	0.514	C	S	.	.	H	α-helix	trans	-68.3	-44.2	176.7	-68	-180	-6.1	0	0	111.9	L176 E178 N183 M184 L185	L176-Q181 HydrophobicContact CB-CG 4.43Å; L176-Q181 PolarHBondContact O-NE2 2.89Å; E178-Q181 PolarHBondContact O-N 2.85Å; Q181-N183 PolarHBondContact O-N 3.5Å; Q181-M184 PolarHBondContact O-N 3.25Å; Q181-L185 WeakPolarHBondContact O-CB 3.41Å; Q181-L185 PolarHBondContact O-N 2.84Å
182	M	54.8	Low	58.1	Low	107 Å²	107	105.5 Å²	105.5	53%	0.527	50%	0.5	S	S	.	.	H	α-helix	trans	-57.8	-36.2	173.5	-76.3	-59.8	-64.7	0	0	111.9	E178 N186	E178-M182 WeakPolarHBondContact O-CG 3.41Å; E178-M182 PolarHBondContact O-N 3.22Å; M182-N186 WeakPolarHBondContact O-CB 3.32Å; M182-N186 PolarHBondContact O-N 3.43Å; M182-N186 PolarHBondContact O-ND2 2.84Å
183	N	66.4	Low	58.5	Low	106 Å²	106	110.3 Å²	110.3	57%	0.567	51%	0.511	S	S	*	.	H	α-helix	trans	-69.9	-40.7	173.9	-76.5	-14.6	0	0	0	112.7	R179 Q180 Q181 K187	R179-N183 PolarHBondContact O-N 3.38Å; Q180-N183 PolarHBondContact O-N 2.9Å; Q181-N183 PolarHBondContact O-N 3.5Å; N183-K187 WeakPolarHBondContact O-CB 3.37Å; N183-K187 PolarHBondContact O-N 3.25Å
184	M	69	Low	59	Low	113 Å²	113	112.6 Å²	112.6	56%	0.557	52%	0.523	S	S	*	.	H	α-helix	trans	-67.4	-43.5	177.5	-167.9	169.2	76.8	0	0	111.7	Q180 Q181 K187 E188	Q180-M184 PolarHBondContact O-N 3.48Å; Q181-M184 PolarHBondContact O-N 3.25Å; M184-K187 WeakPolarHBondContact O-CB 3.4Å; M184-K187 PolarHBondContact O-N 3.23Å; M184-E188 PolarHBondContact O-N 2.88Å
185	L	60.3	Low	60	Low	71 Å²	71	110.3 Å²	110.3	37%	0.372	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-43	175.6	-135.4	-176.3	0	0	0	110.6	Q181 K187 E188 L189	Q181-L185 WeakPolarHBondContact O-CB 3.41Å; Q181-L185 PolarHBondContact O-N 2.84Å; L185-K187 VanDerWaalsContact C-N 3.27Å; L185-K187 PolarHBondContact O-N 3.43Å; L185-E188 PolarHBondContact O-N 2.92Å; L185-L189 HydrophobicContact CD2-CD1 3.7Å; L185-L189 HydrophobicContact CD2-CD2 4.36Å; L185-L189 HydrophobicContact CD2-CG 3.65Å; L185-L189 WeakPolarHBondContact O-CB 3.36Å; L185-L189 VanDerWaalsContact O-CG 3.23Å; L185-L189 WeakPolarHBondContact O-CG 3.39Å; L185-L189 PolarHBondContact O-N 3.35Å
186	N	58.5	Low	61.3	Low	76 Å²	76	101.9 Å²	101.9	41%	0.406	48%	0.477	S	S	.	.	H	α-helix	trans	-64.3	-33.6	172.8	-77.7	-32.7	0	0	0	111.9	M182 S190	M182-N186 WeakPolarHBondContact O-CB 3.32Å; M182-N186 PolarHBondContact O-N 3.43Å; M182-N186 PolarHBondContact O-ND2 2.84Å; N186-S190 WeakPolarHBondContact O-CA 2.96Å; N186-S190 WeakPolarHBondContact O-CB 3.21Å; N186-S190 PolarHBondContact O-N 3.2Å; N186-S190 PolarHBondContact O-OG 3.09Å
187	K	66.9	Low	62.4	Low	131 Å²	131	101 Å²	101	57%	0.57	47%	0.471	S	S	*	.	H	α-helix	trans	-66.4	-48.3	174.6	-174.9	-174.7	176.1	-164.4	0	110.3	N183 M184 L185 S190 E191	N183-K187 WeakPolarHBondContact O-CB 3.37Å; N183-K187 PolarHBondContact O-N 3.25Å; M184-K187 WeakPolarHBondContact O-CB 3.4Å; M184-K187 PolarHBondContact O-N 3.23Å; L185-K187 VanDerWaalsContact C-N 3.27Å; L185-K187 PolarHBondContact O-N 3.43Å; K187-S190 CarbonylContact O-C 3.5Å; K187-S190 WeakPolarHBondContact O-CB 3.44Å; K187-S190 PolarHBondContact O-N 2.99Å; K187-E191 WeakPolarHBondContact CE-OE1 3.2Å; K187-E191 WeakPolarHBondContact O-CB 3.43Å; K187-E191 VanDerWaalsContact O-CG 3.29Å; K187-E191 WeakPolarHBondContact O-CG 3.44Å; K187-E191 PolarHBondContact O-N 3.28Å
188	E	60.4	Low	63	Low	68 Å²	68	97.9 Å²	97.9	32%	0.318	46%	0.459	S	S	.	.	H	α-helix	trans	-66.7	-41.8	177.9	-166.7	-174.6	160.7	0	0	112.2	M184 L185 S190 E191 R192	M184-E188 PolarHBondContact O-N 2.88Å; L185-E188 PolarHBondContact O-N 2.92Å; E188-S190 VanDerWaalsContact C-N 3.3Å; E188-S190 PolarHBondContact O-N 2.83Å; E188-E191 PolarHBondContact O-N 3.14Å; E188-R192 PolarHBondContact O-N 3.11Å; E188-R192 IonicContact OE1-CZ 3.15Å; E188-R192 IonicContact OE1-NH1 2.72Å; E188-R192 PolarHBondContact OE1-NH1 3.31Å; E188-R192 IonicContact OE1-NH2 2.85Å; E188-R192 PolarHBondContact OE1-NH2 2.98Å
189	L	57	Low	63.8	Low	76 Å²	76	94 Å²	94	40%	0.398	44%	0.44	S	S	.	.	H	α-helix	trans	-64.8	-34.9	172.2	-73.7	176.8	0	0	0	111.6	L185 R193	L185-L189 HydrophobicContact CD2-CD1 3.7Å; L185-L189 HydrophobicContact CD2-CD2 4.36Å; L185-L189 HydrophobicContact CD2-CG 3.65Å; L185-L189 WeakPolarHBondContact O-CB 3.36Å; L185-L189 VanDerWaalsContact O-CG 3.23Å; L185-L189 WeakPolarHBondContact O-CG 3.39Å; L185-L189 PolarHBondContact O-N 3.35Å; L189-R193 WeakPolarHBondContact O-CB 3.23Å; L189-R193 PolarHBondContact O-N 3.38Å
190	S	56.8	Low	64.6	Low	55 Å²	55	84.4 Å²	84.4	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-68.2	-45.5	173.3	-65.3	0	0	0	0	110	N186 K187 E188 R192 R193 M194	N186-S190 WeakPolarHBondContact O-CA 2.96Å; N186-S190 WeakPolarHBondContact O-CB 3.21Å; N186-S190 PolarHBondContact O-N 3.2Å; N186-S190 PolarHBondContact O-OG 3.09Å; K187-S190 CarbonylContact O-C 3.5Å; K187-S190 WeakPolarHBondContact O-CB 3.44Å; K187-S190 PolarHBondContact O-N 2.99Å; E188-S190 VanDerWaalsContact C-N 3.3Å; E188-S190 PolarHBondContact O-N 2.83Å; S190-R192 PolarHBondContact O-N 2.94Å; S190-R193 CarbonylContact O-C 3.57Å; S190-R193 PolarHBondContact O-N 2.94Å; S190-M194 WeakPolarHBondContact O-CB 3.47Å; S190-M194 WeakPolarHBondContact O-CG 3.44Å; S190-M194 PolarHBondContact O-N 3.24Å
191	E	59.2	Low	65.5	Low	98 Å²	98	79.6 Å²	79.6	46%	0.458	39%	0.387	S	S	.	.	H	α-helix	trans	-57.5	-47.9	175.1	-73.9	170.6	-167.1	0	0	111.2	K187 E188 M194 K195	K187-E191 WeakPolarHBondContact CE-OE1 3.2Å; K187-E191 WeakPolarHBondContact O-CB 3.43Å; K187-E191 VanDerWaalsContact O-CG 3.29Å; K187-E191 WeakPolarHBondContact O-CG 3.44Å; K187-E191 PolarHBondContact O-N 3.28Å; E188-E191 PolarHBondContact O-N 3.14Å; E191-M194 PolarHBondContact O-N 3.49Å; E191-K195 WeakPolarHBondContact O-CG 3.37Å; E191-K195 PolarHBondContact O-N 2.94Å; E191-K195 VanDerWaalsContact O-N 3.08Å
192	R	56.4	Low	66.6	Low	119 Å²	119	85.4 Å²	85.4	45%	0.449	41%	0.409	S	S	.	.	H	α-helix	trans	-62.5	-43.2	173.8	-74.2	-165.1	177.4	99.1	10.2	112.4	E188 S190 M194 K195	E188-R192 PolarHBondContact O-N 3.11Å; E188-R192 IonicContact OE1-CZ 3.15Å; E188-R192 IonicContact OE1-NH1 2.72Å; E188-R192 PolarHBondContact OE1-NH1 3.31Å; E188-R192 IonicContact OE1-NH2 2.85Å; E188-R192 PolarHBondContact OE1-NH2 2.98Å; S190-R192 PolarHBondContact O-N 2.94Å; R192-M194 PolarHBondContact O-N 3.49Å; R192-K195 PolarHBondContact O-N 3.2Å
193	R	58.9	Low	67.7	Low	148 Å²	148	80.8 Å²	80.8	56%	0.558	39%	0.386	S	S	*	.	H	α-helix	trans	-61.2	-33.9	176	-174.3	-179	-63	174.6	1.2	111.4	L189 S190 W196 Q197	L189-R193 WeakPolarHBondContact O-CB 3.23Å; L189-R193 PolarHBondContact O-N 3.38Å; S190-R193 CarbonylContact O-C 3.57Å; S190-R193 PolarHBondContact O-N 2.94Å; R193-W196 PolarHBondContact O-NE1 3.3Å; R193-Q197 WeakPolarHBondContact O-CB 3.39Å; R193-Q197 VanDerWaalsContact O-CD 3.26Å; R193-Q197 WeakPolarHBondContact O-CG 3.09Å; R193-Q197 PolarHBondContact O-OE1 3.3Å
194	M	59.8	Low	68.3	Low	123 Å²	123	75.7 Å²	75.7	61%	0.606	36%	0.359	S	S	*	.	H	α-helix	trans	-74.9	-30.2	177.2	-68.6	-48	-157.5	0	0	112.9	S190 E191 R192 S198	S190-M194 WeakPolarHBondContact O-CB 3.47Å; S190-M194 WeakPolarHBondContact O-CG 3.44Å; S190-M194 PolarHBondContact O-N 3.24Å; E191-M194 PolarHBondContact O-N 3.49Å; R192-M194 PolarHBondContact O-N 3.49Å; M194-S198 VanDerWaalsContact O-CB 3.29Å; M194-S198 WeakPolarHBondContact O-CB 3.35Å; M194-S198 PolarHBondContact O-N 3.05Å
195	K	75.3	Confident	68.7	Low	116 Å²	116	71.8 Å²	71.8	50%	0.504	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-58.2	-177.8	-74.4	179.8	-176.2	-172.8	0	112.4	E191 R192 Q197 S198 E199	E191-K195 WeakPolarHBondContact O-CG 3.37Å; E191-K195 PolarHBondContact O-N 2.94Å; E191-K195 VanDerWaalsContact O-N 3.08Å; R192-K195 PolarHBondContact O-N 3.2Å; K195-Q197 PolarHBondContact O-N 2.86Å; K195-S198 WeakPolarHBondContact O-CB 3.21Å; K195-S198 PolarHBondContact O-N 2.73Å; K195-S198 VanDerWaalsContact O-N 3.14Å; K195-E199 WeakPolarHBondContact O-CG 3.45Å; K195-E199 PolarHBondContact O-N 3.3Å
196	W	76.2	Confident	69.6	Low	27 Å²	27	70.6 Å²	70.6	10%	0.102	35%	0.345	C	S	.	.	H	α-helix	trans	-65.5	-30.6	-179.6	73.2	-96	0	0	0	112.2	R193 E199 L200 M335 Q339 L342	R193-W196 PolarHBondContact O-NE1 3.3Å; W196-E199 PolarHBondContact O-N 3.07Å; W196-L200 HydrophobicContact CE3-CB 4.48Å; W196-L200 HydrophobicContact CE3-CD2 4.36Å; W196-L200 HydrophobicContact CZ3-CD2 3.86Å; W196-L200 VanDerWaalsContact O-CB 3.29Å; W196-L200 WeakPolarHBondContact O-CB 3.38Å; W196-L200 PolarHBondContact O-N 2.99Å; W196-M335 HydrophobicContact CH2-SD 4.3Å; W196-Q339 HydrophobicContact CB-CG 4.41Å; W196-Q339 HydrophobicContact CD2-CG 3.79Å; W196-Q339 VanDerWaalsContact CE2-NE2 3.31Å; W196-Q339 HydrophobicContact CE3-CG 4.46Å; W196-Q339 HydrophobicContact CG-CB 4.33Å; W196-Q339 HydrophobicContact CG-CG 3.74Å; W196-L342 HydrophobicContact CB-CB 4.37Å; W196-L342 HydrophobicContact CE3-CD1 4.26Å
197	Q	76.9	Confident	70.2	Confident	70 Å²	70	67 Å²	67	33%	0.327	33%	0.326	S	S	.	.	H	α-helix	trans	-67.4	-40.7	174.2	-73.9	178.2	-11.2	0	0	111.5	R193 K195 G201	R193-Q197 WeakPolarHBondContact O-CB 3.39Å; R193-Q197 VanDerWaalsContact O-CD 3.26Å; R193-Q197 WeakPolarHBondContact O-CG 3.09Å; R193-Q197 PolarHBondContact O-OE1 3.3Å; K195-Q197 PolarHBondContact O-N 2.86Å; Q197-G201 PolarHBondContact O-N 2.92Å
198	S	75.7	Confident	70.4	Confident	58 Å²	58	61.6 Å²	61.6	41%	0.406	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-45.7	172.6	-167	0	0	0	0	110.7	M194 K195 G201 Y202	M194-S198 VanDerWaalsContact O-CB 3.29Å; M194-S198 WeakPolarHBondContact O-CB 3.35Å; M194-S198 PolarHBondContact O-N 3.05Å; K195-S198 WeakPolarHBondContact O-CB 3.21Å; K195-S198 PolarHBondContact O-N 2.73Å; K195-S198 VanDerWaalsContact O-N 3.14Å; S198-G201 CarbonylContact O-C 3.56Å; S198-G201 WeakPolarHBondContact O-CA 3.48Å; S198-G201 PolarHBondContact O-N 3.33Å; S198-G201 VanDerWaalsContact O-N 3.16Å; S198-Y202 WeakPolarHBondContact O-CD2 3.3Å; S198-Y202 PolarHBondContact O-N 3.42Å; S198-Y202 VanDerWaalsContact OG-CE2 3.22Å; S198-Y202 WeakPolarHBondContact OG-CE2 3.43Å
199	E	77.1	Confident	70.8	Confident	62 Å²	62	62 Å²	62	29%	0.29	31%	0.314	S	S	.	.	H	α-helix	trans	-61.9	-46.3	177.3	-70.1	-61.9	133.2	0	0	112.4	K195 W196 G201 Y202 L203 K350	K195-E199 WeakPolarHBondContact O-CG 3.45Å; K195-E199 PolarHBondContact O-N 3.3Å; W196-E199 PolarHBondContact O-N 3.07Å; E199-G201 PolarHBondContact O-N 2.87Å; E199-Y202 WeakPolarHBondContact O-CB 3.45Å; E199-Y202 PolarHBondContact O-N 3.27Å; E199-Y202 VanDerWaalsContact O-N 3.12Å; E199-L203 WeakPolarHBondContact O-CG 3.48Å; E199-L203 PolarHBondContact O-N 2.9Å; E199-K350 IonicContact OE2-NZ 2.73Å; E199-K350 PolarHBondContact OE2-NZ 2.98Å
200	L	75.5	Confident	71	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-38.9	174	-174.2	62	0	0	0	110.6	W196 L203 T204 E319 I322 F323 I326 L342	W196-L200 HydrophobicContact CE3-CB 4.48Å; W196-L200 HydrophobicContact CE3-CD2 4.36Å; W196-L200 HydrophobicContact CZ3-CD2 3.86Å; W196-L200 VanDerWaalsContact O-CB 3.29Å; W196-L200 WeakPolarHBondContact O-CB 3.38Å; W196-L200 PolarHBondContact O-N 2.99Å; L200-L203 PolarHBondContact O-N 3.37Å; L200-T204 HydrophobicContact CD1-CG2 4.48Å; L200-T204 HydrophobicContact CG-CG2 4.41Å; L200-T204 WeakPolarHBondContact O-CB 3.35Å; L200-T204 WeakPolarHBondContact O-CG2 3.43Å; L200-T204 PolarHBondContact O-N 3.48Å; L200-T204 PolarHBondContact O-OG1 2.92Å; L200-T204 VanDerWaalsContact O-OG1 3.12Å; L200-E319 HydrophobicContact CD2-CG 3.48Å; L200-E319 VanDerWaalsContact CD2-CG 3.48Å; L200-E319 HydrophobicContact CG-CG 3.83Å; L200-I322 HydrophobicContact CD1-CG2 4.19Å; L200-F323 HydrophobicContact CD2-CB 4.41Å; L200-F323 HydrophobicContact CD2-CD2 4.36Å; L200-I326 HydrophobicContact CD1-CD1 3.99Å; L200-L342 HydrophobicContact CB-CD1 4.36Å
201	G	78.9	Confident	71.1	Confident	19 Å²	19	62.1 Å²	62.1	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-62.1	-37.7	172.6	0	0	0	0	0	113.9	Q197 S198 E199 T204 G205	Q197-G201 PolarHBondContact O-N 2.92Å; S198-G201 CarbonylContact O-C 3.56Å; S198-G201 WeakPolarHBondContact O-CA 3.48Å; S198-G201 PolarHBondContact O-N 3.33Å; S198-G201 VanDerWaalsContact O-N 3.16Å; E199-G201 PolarHBondContact O-N 2.87Å; G201-T204 WeakPolarHBondContact CA-OG1 3.32Å; G201-T204 PolarHBondContact O-OG1 2.95Å; G201-G205 PolarHBondContact O-N 3.27Å
202	Y	79.4	Confident	70.9	Confident	149 Å²	149	65.1 Å²	65.1	58%	0.584	32%	0.321	S	S	*	.	H	α-helix	trans	-68.1	-42.3	173.3	-75.2	-65.9	0	0	0	111.5	S198 E199 S206	S198-Y202 WeakPolarHBondContact O-CD2 3.3Å; S198-Y202 PolarHBondContact O-N 3.42Å; S198-Y202 VanDerWaalsContact OG-CE2 3.22Å; S198-Y202 WeakPolarHBondContact OG-CE2 3.43Å; E199-Y202 WeakPolarHBondContact O-CB 3.45Å; E199-Y202 PolarHBondContact O-N 3.27Å; E199-Y202 VanDerWaalsContact O-N 3.12Å; Y202-S206 VanDerWaalsContact O-CB 3.26Å; Y202-S206 WeakPolarHBondContact O-CB 3.19Å; Y202-S206 PolarHBondContact O-N 3.39Å; Y202-S206 PolarHBondContact O-OG 3.24Å
203	L	76.9	Confident	70.7	Confident	9 Å²	9	61.5 Å²	61.5	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-48.4	175.2	-67.6	178.3	0	0	0	110.9	E199 L200 S206 I207 I326 L342 K350 I354	E199-L203 WeakPolarHBondContact O-CG 3.48Å; E199-L203 PolarHBondContact O-N 2.9Å; L200-L203 PolarHBondContact O-N 3.37Å; L203-S206 PolarHBondContact O-N 3.18Å; L203-I207 WeakPolarHBondContact O-CB 3.45Å; L203-I207 WeakPolarHBondContact O-CD1 3.2Å; L203-I207 VanDerWaalsContact O-CG1 3.24Å; L203-I207 WeakPolarHBondContact O-CG1 3.45Å; L203-I207 PolarHBondContact O-N 3.06Å; L203-I326 HydrophobicContact CD1-CD1 4.14Å; L203-L342 HydrophobicContact CD1-CD2 3.55Å; L203-K350 HydrophobicContact CD2-CB 4.26Å; L203-I354 HydrophobicContact CD2-CD1 3.68Å; L203-I354 HydrophobicContact CD2-CG1 3.56Å
204	T	79.1	Confident	69.7	Low	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-65.2	-44.5	179.9	58.7	0	0	0	0	111.4	L200 G201 S206 I207 L208 F315 E319 I322	L200-T204 HydrophobicContact CD1-CG2 4.48Å; L200-T204 HydrophobicContact CG-CG2 4.41Å; L200-T204 WeakPolarHBondContact O-CB 3.35Å; L200-T204 WeakPolarHBondContact O-CG2 3.43Å; L200-T204 PolarHBondContact O-N 3.48Å; L200-T204 PolarHBondContact O-OG1 2.92Å; L200-T204 VanDerWaalsContact O-OG1 3.12Å; G201-T204 WeakPolarHBondContact CA-OG1 3.32Å; G201-T204 PolarHBondContact O-OG1 2.95Å; T204-S206 VanDerWaalsContact C-N 3.31Å; T204-S206 PolarHBondContact O-N 2.99Å; T204-I207 PolarHBondContact O-N 3.3Å; T204-L208 VanDerWaalsContact O-CB 3.31Å; T204-L208 WeakPolarHBondContact O-CB 3.29Å; T204-L208 WeakPolarHBondContact O-CG 3.48Å; T204-L208 PolarHBondContact O-N 3.31Å; T204-F315 WeakPolarHBondContact OG1-CE2 3.44Å; T204-F315 WeakPolarHBondContact OG1-CZ 3.09Å; T204-E319 HydrophobicContact CG2-CB 4Å; T204-E319 HydrophobicContact CG2-CG 4.23Å; T204-I322 HydrophobicContact CG2-CB 4.18Å; T204-I322 HydrophobicContact CG2-CD1 3.51Å; T204-I322 HydrophobicContact CG2-CG1 4.38Å; T204-I322 HydrophobicContact CG2-CG2 4.36Å
205	G	76.9	Confident	68.8	Low	31 Å²	31	58.4 Å²	58.4	32%	0.32	31%	0.312	S	S	.	.	H	α-helix	trans	-59.9	-39.7	174.5	0	0	0	0	0	112.9	G201 S209	G201-G205 PolarHBondContact O-N 3.27Å; G205-S209 WeakPolarHBondContact O-CB 3.08Å; G205-S209 PolarHBondContact O-N 3.49Å; G205-S209 PolarHBondContact O-OG 2.65Å
206	S	78.8	Confident	66.9	Low	45 Å²	45	60 Å²	60	32%	0.315	32%	0.321	S	S	.	.	H	α-helix	trans	-69.3	-40.3	177.9	-59.1	0	0	0	0	112.7	Y202 L203 T204 S209 Q210	Y202-S206 VanDerWaalsContact O-CB 3.26Å; Y202-S206 WeakPolarHBondContact O-CB 3.19Å; Y202-S206 PolarHBondContact O-N 3.39Å; Y202-S206 PolarHBondContact O-OG 3.24Å; L203-S206 PolarHBondContact O-N 3.18Å; T204-S206 VanDerWaalsContact C-N 3.31Å; T204-S206 PolarHBondContact O-N 2.99Å; S206-S209 PolarHBondContact O-OG 3.5Å; S206-Q210 WeakPolarHBondContact O-CG 3.46Å; S206-Q210 PolarHBondContact O-N 2.9Å; S206-Q210 VanDerWaalsContact O-N 3.17Å
207	I	72.4	Confident	65.1	Low	1 Å²	1	61.6 Å²	61.6	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-69	-42	176.8	-69.4	160.6	0	0	0	110.2	L203 T204 S209 Q210 L211 I322 I354 V357 L361	L203-I207 WeakPolarHBondContact O-CB 3.45Å; L203-I207 WeakPolarHBondContact O-CD1 3.2Å; L203-I207 VanDerWaalsContact O-CG1 3.24Å; L203-I207 WeakPolarHBondContact O-CG1 3.45Å; L203-I207 PolarHBondContact O-N 3.06Å; T204-I207 PolarHBondContact O-N 3.3Å; I207-S209 PolarHBondContact O-N 3.24Å; I207-Q210 PolarHBondContact O-N 2.84Å; I207-L211 HydrophobicContact CG2-CD1 3.93Å; I207-L211 HydrophobicContact CG2-CG 4.44Å; I207-L211 VanDerWaalsContact O-CG 3.32Å; I207-L211 WeakPolarHBondContact O-CG 3.21Å; I207-L211 PolarHBondContact O-N 2.72Å; I207-I322 HydrophobicContact CB-CD1 4.18Å; I207-I322 HydrophobicContact CD1-CD1 3.63Å; I207-I322 HydrophobicContact CD1-CG1 4.11Å; I207-I322 HydrophobicContact CD1-CG2 4.16Å; I207-I322 HydrophobicContact CG2-CD1 4.2Å; I207-I354 HydrophobicContact CG1-CB 4.41Å; I207-I354 HydrophobicContact CG1-CG1 4.48Å; I207-I354 HydrophobicContact CG1-CG2 3.94Å; I207-V357 HydrophobicContact CD1-CB 3.89Å; I207-V357 HydrophobicContact CD1-CG1 3.62Å; I207-V357 HydrophobicContact CG1-CG1 4.46Å; I207-V357 HydrophobicContact CG2-CG1 4.34Å; I207-L361 HydrophobicContact CG2-CD1 3.57Å
208	L	71.6	Confident	63	Low	18 Å²	18	63.7 Å²	63.7	9%	0.094	35%	0.353	C	S	.	.	H	α-helix	trans	-65	-38.2	178	-71.8	175.2	0	0	0	112.7	T204 L211 Q212 I213 F315 Y318	T204-L208 VanDerWaalsContact O-CB 3.31Å; T204-L208 WeakPolarHBondContact O-CB 3.29Å; T204-L208 WeakPolarHBondContact O-CG 3.48Å; T204-L208 PolarHBondContact O-N 3.31Å; L208-L211 PolarHBondContact O-N 2.83Å; L208-Q212 PolarHBondContact O-N 3.47Å; L208-I213 HydrophobicContact CD2-CD1 3.33Å; L208-F315 HydrophobicContact CD1-CD2 3.66Å; L208-F315 HydrophobicContact CD1-CE2 4.21Å; L208-Y318 HydrophobicContact CD1-CD2 4.27Å; L208-Y318 HydrophobicContact CD1-CG 4.45Å; L208-Y318 HydrophobicContact CD2-CD1 3.81Å; L208-Y318 HydrophobicContact CD2-CD2 3.46Å; L208-Y318 VanDerWaalsContact CD2-CD2 3.46Å; L208-Y318 HydrophobicContact CD2-CE1 3.96Å; L208-Y318 HydrophobicContact CD2-CE2 3.61Å; L208-Y318 HydrophobicContact CD2-CG 3.57Å; L208-Y318 HydrophobicContact CG-CD2 4.42Å; L208-Y318 HydrophobicContact CG-CG 4.38Å
209	S	68.3	Low	60.9	Low	77 Å²	77	68.4 Å²	68.4	54%	0.538	37%	0.374	S	S	.	.	H	α-helix	trans	-66.7	-37	175.3	70.2	0	0	0	0	112	G205 S206 I207 Q212	G205-S209 WeakPolarHBondContact O-CB 3.08Å; G205-S209 PolarHBondContact O-N 3.49Å; G205-S209 PolarHBondContact O-OG 2.65Å; S206-S209 PolarHBondContact O-OG 3.5Å; I207-S209 PolarHBondContact O-N 3.24Å; S209-Q212 PolarHBondContact O-N 2.75Å
210	Q	60.9	Low	58.8	Low	103 Å²	103	70.8 Å²	70.8	48%	0.481	39%	0.389	S	S	.	.	H	α-helix	trans	-68.4	-36.8	174.5	-73.9	176.7	18.1	0	0	113.3	S206 I207 Q212 I354 S358	S206-Q210 WeakPolarHBondContact O-CG 3.46Å; S206-Q210 PolarHBondContact O-N 2.9Å; S206-Q210 VanDerWaalsContact O-N 3.17Å; I207-Q210 PolarHBondContact O-N 2.84Å; Q210-Q212 PolarHBondContact O-N 2.86Å; Q210-Q212 VanDerWaalsContact O-N 3.17Å; Q210-I354 VanDerWaalsContact NE2-CG2 3.29Å; Q210-S358 VanDerWaalsContact OE1-CB 3.32Å; Q210-S358 PolarHBondContact OE1-OG 3.2Å
211	L	58.2	Low	56.6	Low	30 Å²	30	77.1 Å²	77.1	16%	0.157	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-2.2	176.9	-68.7	172.3	0	0	0	112.8	I207 L208 I213 L361	I207-L211 HydrophobicContact CG2-CD1 3.93Å; I207-L211 HydrophobicContact CG2-CG 4.44Å; I207-L211 VanDerWaalsContact O-CG 3.32Å; I207-L211 WeakPolarHBondContact O-CG 3.21Å; I207-L211 PolarHBondContact O-N 2.72Å; L208-L211 PolarHBondContact O-N 2.83Å; L211-I213 HydrophobicContact CB-CD1 3.73Å; L211-I213 HydrophobicContact CB-CG1 3.85Å; L211-I213 HydrophobicContact CD1-CD1 4.01Å; L211-I213 PolarHBondContact O-N 3.3Å; L211-L361 HydrophobicContact CD1-CB 3.7Å; L211-L361 HydrophobicContact CD1-CD1 3.78Å; L211-L361 HydrophobicContact CD1-CG 4.4Å; L211-L361 HydrophobicContact CD2-CB 4.19Å
212	Q	56.5	Low	54.6	Low	160 Å²	160	86 Å²	86	75%	0.748	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	31.4	179.9	-143.4	84.9	53.6	0	0	112.3	L208 S209 Q210 P214	L208-Q212 PolarHBondContact O-N 3.47Å; S209-Q212 PolarHBondContact O-N 2.75Å; Q210-Q212 PolarHBondContact O-N 2.86Å; Q210-Q212 VanDerWaalsContact O-N 3.17Å; Q212-P214 WeakPolarHBondContact O-CD 3.45Å; Q212-P214 VanDerWaalsContact O-N 3.08Å
213	I	50.9	Low	52.1	Low	44 Å²	44	85 Å²	85	23%	0.226	46%	0.456	C	S	.	.			trans	-62.3	119.4	179.2	-65.9	153.8	0	0	0	104.8	L208 L211 I215 Y318	L208-I213 HydrophobicContact CD2-CD1 3.33Å; L211-I213 HydrophobicContact CB-CD1 3.73Å; L211-I213 HydrophobicContact CB-CG1 3.85Å; L211-I213 HydrophobicContact CD1-CD1 4.01Å; L211-I213 PolarHBondContact O-N 3.3Å; I213-I215 PolarHBondContact O-N 3.34Å; I213-Y318 HydrophobicContact CD1-CE1 4.21Å; I213-Y318 HydrophobicContact CD1-CE2 4.16Å; I213-Y318 WeakPolarHBondContact CD1-OH 3.34Å
214	P	39.4	Very low	49.9	Very low	100 Å²	100	92.8 Å²	92.8	65%	0.649	49%	0.492	S	S	*	.			trans	-60.7	97.9	175.4	-17.7	30.4	0	0	0	106.3	Q212 Q216	Q212-P214 WeakPolarHBondContact O-CD 3.45Å; Q212-P214 VanDerWaalsContact O-N 3.08Å; P214-Q216 HydrophobicContact CB-CG 4.23Å; P214-Q216 PolarHBondContact O-N 3.41Å
215	I	41.1	Very low	47.5	Very low	106 Å²	106	100.4 Å²	100.4	54%	0.544	53%	0.527	S	S	.	.			trans	-70	79.8	158.2	-53	170	0	0	0	101.9	I213 A217 V311	I213-I215 PolarHBondContact O-N 3.34Å; I215-A217 PolarHBondContact O-N 2.85Å; I215-V311 HydrophobicContact CG2-CG1 3.81Å; I215-V311 HydrophobicContact CG2-CG2 4.08Å
216	Q	34.6	Very low	45	Very low	150 Å²	150	108 Å²	108	70%	0.701	55%	0.552	S	S	*	*			trans	-63.8	75.8	160.8	-80.2	173.4	-47	0	0	104.9	P214 D218	P214-Q216 HydrophobicContact CB-CG 4.23Å; P214-Q216 PolarHBondContact O-N 3.41Å; Q216-D218 PolarHBondContact O-N 2.77Å
217	A	37.7	Very low	42.5	Very low	60 Å²	60	111 Å²	111	50%	0.496	56%	0.564	S	S	.	*			trans	-60.3	86	139.8	0	0	0	0	0	103	I215 N219	I215-A217 PolarHBondContact O-N 2.85Å; A217-N219 VanDerWaalsContact C-N 3.35Å; A217-N219 PolarHBondContact O-N 3.19Å; A217-N219 PolarHBondContact O-OD1 2.98Å
218	D	32.5	Very low	40.3	Very low	113 Å²	113	122 Å²	122	60%	0.604	61%	0.606	S	S	*	*			trans	-49.1	113.7	166.6	-76.6	-29.1	0	0	0	104.6	Q216 N220	Q216-D218 PolarHBondContact O-N 2.77Å; D218-N220 PolarHBondContact O-N 3.05Å
219	N	31.4	Very low	38.2	Very low	157 Å²	157	130.8 Å²	130.8	84%	0.84	64%	0.644	S	S	*	*			trans	-66.6	63.7	-179.5	-71.2	-38.6	0	0	0	108.3	A217 N221	A217-N219 VanDerWaalsContact C-N 3.35Å; A217-N219 PolarHBondContact O-N 3.19Å; A217-N219 PolarHBondContact O-OD1 2.98Å; N219-N221 PolarHBondContact O-N 3.24Å
220	N	33.9	Very low	36.1	Very low	113 Å²	113	133.9 Å²	133.9	60%	0.604	65%	0.654	S	S	*	*			trans	-74.2	92.7	162.5	-67.3	-28.9	0	0	0	103.9	D218 Y222	D218-N220 PolarHBondContact O-N 3.05Å; N220-Y222 HydrophobicContact CB-CD2 4.05Å; N220-Y222 HydrophobicContact CB-CE2 3.82Å; N220-Y222 WeakPolarHBondContact O-CD2 3.37Å; N220-Y222 PolarHBondContact O-N 2.92Å
221	N	29.1	Very low	34.3	Very low	134 Å²	134	136.5 Å²	136.5	72%	0.717	67%	0.671	S	S	*	*			trans	-41.6	81	163.1	-177.4	24.9	0	0	0	110.2	N219 D223	N219-N221 PolarHBondContact O-N 3.24Å; N221-D223 PolarHBondContact O-N 3.22Å
222	Y	36.3	Very low	32.8	Very low	207 Å²	207	140.5 Å²	140.5	81%	0.812	70%	0.702	S	S	*	*			trans	-90.4	97.2	163.4	-78.2	-72.4	0	0	0	105.4	N220 Q224	N220-Y222 HydrophobicContact CB-CD2 4.05Å; N220-Y222 HydrophobicContact CB-CE2 3.82Å; N220-Y222 WeakPolarHBondContact O-CD2 3.37Å; N220-Y222 PolarHBondContact O-N 2.92Å; Y222-Q224 PolarHBondContact O-N 3.31Å
223	D	28.7	Very low	31.3	Very low	127 Å²	127	138.7 Å²	138.7	68%	0.679	71%	0.707	S	S	*	*			trans	-38.2	136.5	168.7	-82.5	-52.6	0	0	0	111.3	N221 H225	N221-D223 PolarHBondContact O-N 3.22Å; D223-H225 VanDerWaalsContact C-N 3.31Å; D223-H225 PolarHBondContact O-N 2.9Å
224	Q	30.8	Very low	30	Very low	173 Å²	173	143.8 Å²	143.8	81%	0.808	74%	0.735	S	S	*	*			trans	-57.1	75.1	-176	-165.7	164.4	18	0	0	113	Y222 F226	Y222-Q224 PolarHBondContact O-N 3.31Å; Q224-F226 PolarHBondContact O-N 3.37Å
225	H	27.9	Very low	29.4	Very low	159 Å²	159	149.9 Å²	149.9	74%	0.736	75%	0.745	S	S	*	*			trans	-96.4	72.3	162.1	-99.3	-72.7	0	0	0	110.3	D223 D227	D223-H225 VanDerWaalsContact C-N 3.31Å; D223-H225 PolarHBondContact O-N 2.9Å; H225-D227 IonicContact CE1-OD2 3.75Å; H225-D227 IonicContact ND1-OD2 3.04Å; H225-D227 PolarHBondContact ND1-OD2 3.19Å; H225-D227 PolarHBondContact O-N 3.13Å
226	F	23.9	Very low	28.7	Very low	192 Å²	192	151.4 Å²	151.4	84%	0.842	75%	0.754	S	S	*	*			trans	-76.7	56.8	167.4	-105.4	-88.7	0	0	0	110.5	Q224 R228	Q224-F226 PolarHBondContact O-N 3.37Å; F226-R228 PolarHBondContact O-N 3.31Å
227	D	27.9	Very low	28	Very low	106 Å²	106	149.3 Å²	149.3	57%	0.567	76%	0.756	S	S	*	*			trans	-97.5	86	170.7	-73.4	-51.9	0	0	0	110.3	H225 F229	H225-D227 IonicContact CE1-OD2 3.75Å; H225-D227 IonicContact ND1-OD2 3.04Å; H225-D227 PolarHBondContact ND1-OD2 3.19Å; H225-D227 PolarHBondContact O-N 3.13Å; D227-F229 VanDerWaalsContact O-CD2 3.27Å; D227-F229 WeakPolarHBondContact O-CD2 3.32Å; D227-F229 PolarHBondContact O-N 3.4Å
228	R	25.4	Very low	27.5	Very low	234 Å²	234	150.9 Å²	150.9	88%	0.883	76%	0.763	S	S	*	*				43.1	63.6	128.8	-152.2	-177.5	-146.7	-178.6	6.5	117.4	F226	F226-R228 PolarHBondContact O-N 3.31Å
229	F	28.2	Very low	27.3	Very low	201 Å²	201	155 Å²	155	88%	0.882	77%	0.771	S	S	*	*			trans	-106	64.8	159.8	-73.9	-76.4	0	0	0	111.3	D227	D227-F229 VanDerWaalsContact O-CD2 3.27Å; D227-F229 WeakPolarHBondContact O-CD2 3.32Å; D227-F229 PolarHBondContact O-N 3.4Å
230	N	23.2	Very low	27.2	Very low	142 Å²	142	158.2 Å²	158.2	76%	0.759	77%	0.774	S	S	*	*			trans	-92.6	127.9	157.4	-85.5	-26.2	0	0	0	108.4
231	N	24.1	Very low	26.8	Very low	158 Å²	158	160.1 Å²	160.1	85%	0.845	78%	0.783	S	S	*	*			trans	75.2	78.5	157.3	-54.7	-25.9	0	0	0	118.6
232	S	25.1	Very low	26.6	Very low	114 Å²	114	159.6 Å²	159.6	80%	0.797	79%	0.787	S	S	*	*			trans	-126.6	56.2	154.6	61.1	0	0	0	0	111.1
233	S	25.9	Very low	26	Very low	123 Å²	123	155.6 Å²	155.6	86%	0.86	79%	0.789	S	S	*	*			trans	-143.9	54.6	173.3	-67.8	0	0	0	0	111.4
234	N	23.9	Very low	25.7	Very low	150 Å²	150	154.3 Å²	154.3	80%	0.802	79%	0.79	S	S	*	*			trans	-168.4	84.9	157.6	-170.6	2.4	0	0	0	111.2
235	R	25.3	Very low	25.8	Very low	229 Å²	229	154.3 Å²	154.3	86%	0.864	80%	0.795	S	S	*	*			trans	-154.2	118	153.9	-75.4	-155.2	-176.3	174.8	1.4	111.2
236	N	26.4	Very low	25.6	Very low	138 Å²	138	154.1 Å²	154.1	74%	0.738	80%	0.799	S	S	*	*			trans	94.6	79.6	141.9	-51.4	-11.5	0	0	0	118.4	S238	N236-S238 PolarHBondContact O-N 2.94Å; N236-S238 VanDerWaalsContact O-N 3.13Å
237	S	21.3	Very low	26	Very low	105 Å²	105	154.4 Å²	154.4	73%	0.734	80%	0.803	S	S	*	*			trans	-56.8	97.5	137.9	173.4	0	0	0	0	109.3
238	S	26.3	Very low	26.1	Very low	93 Å²	93	159.3 Å²	159.3	65%	0.65	82%	0.819	S	S	*	*			trans	-105.2	113.2	170.1	-173.9	0	0	0	0	109.3	N236 Y240	N236-S238 PolarHBondContact O-N 2.94Å; N236-S238 VanDerWaalsContact O-N 3.13Å; S238-Y240 PolarHBondContact O-N 2.77Å
239	Y	28.2	Very low	26.1	Very low	199 Å²	199	155 Å²	155	78%	0.78	81%	0.812	S	S	*	*			trans	-60.3	118.1	174.6	-63.7	-93.2	0	0	0	110.2	L241	Y239-L241 PolarHBondContact O-N 3.04Å
240	Y	29.8	Very low	26	Very low	226 Å²	226	150.8 Å²	150.8	89%	0.886	81%	0.805	S	S	*	*			trans	-80.5	106.6	165.2	-79.2	-87.9	0	0	0	108.4	S238	S238-Y240 PolarHBondContact O-N 2.77Å
241	L	25.4	Very low	26	Very low	153 Å²	153	153.5 Å²	153.5	80%	0.801	81%	0.811	S	S	*	*			trans	-80.2	133.5	164.4	-98.5	146.5	0	0	0	108.8	Y239 S243	Y239-L241 PolarHBondContact O-N 3.04Å; L241-S243 PolarHBondContact O-N 3.35Å
242	P	23.8	Very low	26.2	Very low	123 Å²	123	155.8 Å²	155.8	80%	0.799	81%	0.813	S	S	*	*			trans	-83.8	110.9	-178.8	3.6	14.6	0	0	0	110.2
243	S	25.5	Very low	26.1	Very low	123 Å²	123	157.5 Å²	157.5	86%	0.86	81%	0.81	S	S	*	*			trans	-86.7	109.9	170.2	-67.5	0	0	0	0	110.3	L241	L241-S243 PolarHBondContact O-N 3.35Å
244	S	22	Very low	26.3	Very low	100 Å²	100	159.3 Å²	159.3	70%	0.699	81%	0.811	S	S	*	*			trans	-55	120.8	164.1	155.1	0	0	0	0	112.1
245	L	31.5	Very low	26.3	Very low	172 Å²	172	159 Å²	159	90%	0.901	81%	0.809	S	S	*	*			trans	-143.2	108.5	151.3	-88.8	169.2	0	0	0	108.4
246	D	25.5	Very low	26.5	Very low	156 Å²	156	156.6 Å²	156.6	83%	0.834	81%	0.807	S	S	*	*			trans	-59	123.4	168	-73.1	-56.7	0	0	0	110.8
247	E	31.5	Very low	26.3	Very low	197 Å²	197	157.5 Å²	157.5	92%	0.921	81%	0.811	S	S	*	*			trans	-139.4	128.4	157.2	-144.8	170.1	-164.9	0	0	111.5
248	K	29.6	Very low	26.9	Very low	209 Å²	209	158.1 Å²	158.1	91%	0.909	82%	0.815	S	S	*	*			trans	-74.7	137.9	-165.7	-76.4	171.5	168.1	-172.7	0	113.4
249	I	26	Very low	26.9	Very low	143 Å²	143	162 Å²	162	73%	0.733	82%	0.823	S	S	*	*			trans	-71.5	145	158.2	-61.4	161.2	0	0	0	107.5	F251	I249-F251 HydrophobicContact CG2-CD2 4.22Å
250	P	26.6	Very low	26.8	Very low	114 Å²	114	158.6 Å²	158.6	74%	0.74	82%	0.823	S	S	*	*				-155.5	146	66.5	38	-14	0	0	0	120.9
251	F	22.4	Very low	26.6	Very low	199 Å²	199	156 Å²	156	87%	0.873	82%	0.821	S	S	*	*			trans	23.9	116.9	136.6	-83.8	-98.7	0	0	0	119.4	I249	I249-F251 HydrophobicContact CG2-CD2 4.22Å
252	K	27.6	Very low	26.8	Very low	205 Å²	205	155.7 Å²	155.7	89%	0.891	82%	0.82	S	S	*	*			trans	-127.7	118.2	150.7	-159.4	171.9	-176.8	179.2	0	110.1
253	M	23.5	Very low	27.1	Very low	150 Å²	150	157 Å²	157	74%	0.739	81%	0.813	S	S	*	*			trans	-51.4	144.6	173.3	-130.6	165.1	-176.6	0	0	111.8
254	N	30	Very low	27.4	Very low	162 Å²	162	159.4 Å²	159.4	87%	0.866	82%	0.816	S	S	*	*			trans	-167	105.2	140.7	-88.4	-17.5	0	0	0	109.2
255	N	23.3	Very low	28	Very low	142 Å²	142	161.8 Å²	161.8	76%	0.759	82%	0.816	S	S	*	*			trans	-72.1	120.8	170.6	-66.9	-25	0	0	0	109.3
256	Q	30.2	Very low	28.2	Very low	180 Å²	180	161.7 Å²	161.7	84%	0.841	82%	0.817	S	S	*	*			trans	-150	99.8	155	-69	-150.8	66	0	0	110.5
257	I	23.5	Very low	28.7	Very low	157 Å²	157	158.5 Å²	158.5	81%	0.805	81%	0.812	S	S	*	*			trans	28.7	115.6	133.1	-52.1	162.3	0	0	0	116.8
258	S	32.5	Very low	28.9	Very low	118 Å²	118	154.5 Å²	154.5	83%	0.825	80%	0.803	S	S	*	*				-175.5	126.5	125.7	-76.5	0	0	0	0	110.2
259	E	25.7	Very low	29.7	Very low	175 Å²	175	150.2 Å²	150.2	82%	0.818	80%	0.796	S	S	*	*			trans	-67	167.1	174.2	-64.9	169	147.4	0	0	111.7
260	T	26.6	Very low	30.8	Very low	126 Å²	126	151 Å²	151	77%	0.773	80%	0.797	S	S	*	*			trans	94.9	117.4	162.9	78.2	0	0	0	0	116.7
261	M	26.8	Very low	31.9	Very low	172 Å²	172	151.3 Å²	151.3	85%	0.847	79%	0.792	S	S	*	*			trans	69.5	80.2	152.9	-51	-124.9	178.6	0	0	116.4
262	N	28.4	Very low	33.8	Very low	146 Å²	146	147 Å²	147	78%	0.781	78%	0.778	S	S	*	*				169.3	146	121.4	-102.6	-62.5	0	0	0	113.9
263	K	29.9	Very low	35.4	Very low	150 Å²	150	144.2 Å²	144.2	65%	0.652	76%	0.762	S	S	*	*			trans	72	74.9	149.6	-65.3	164.5	-177.3	-177.2	0	117.8	Q265	K263-Q265 HydrophobicContact CB-CG 4.35Å; K263-Q265 HydrophobicContact CG-CG 4.28Å; K263-Q265 PolarHBondContact O-N 3.08Å
264	N	31.7	Very low	36.9	Very low	175 Å²	175	138.3 Å²	138.3	94%	0.936	74%	0.736	S	S	*	*			trans	-83.6	76.6	139.8	-75.2	-23.6	0	0	0	108.6
265	Q	34.5	Very low	38.5	Very low	150 Å²	150	136.9 Å²	136.9	70%	0.701	74%	0.738	S	S	*	*			trans	-99	66.2	166.8	-67.4	-174.5	-2.8	0	0	108.8	K263	K263-Q265 HydrophobicContact CB-CG 4.35Å; K263-Q265 HydrophobicContact CG-CG 4.28Å; K263-Q265 PolarHBondContact O-N 3.08Å
266	N	36.5	Very low	40.5	Very low	170 Å²	170	139.5 Å²	139.5	91%	0.909	74%	0.743	S	S	*	*			trans	-158.1	28.2	173.3	-84.1	-46.1	0	0	0	113.5
267	A	35.3	Very low	42	Very low	88 Å²	88	134.8 Å²	134.8	73%	0.727	73%	0.727	S	S	*	*	S	Bend	trans	-116.3	127.3	169.8	0	0	0	0	0	109.5
268	P	35.5	Very low	43.9	Very low	114 Å²	114	129.7 Å²	129.7	74%	0.74	71%	0.713	S	S	*	*			trans	-58.4	147.7	174.3	24.5	-31.2	0	0	0	109.7	E270	P268-E270 PolarHBondContact O-N 2.98Å
269	P	47.1	Very low	45.6	Very low	118 Å²	118	133 Å²	133	77%	0.766	71%	0.707	S	S	*	*			trans	-59.3	104.1	-173.4	23.5	-32.6	0	0	0	109.5	L271	P269-L271 PolarHBondContact O-N 3.45Å
270	E	48.3	Very low	47.7	Very low	159 Å²	159	129.1 Å²	129.1	74%	0.743	69%	0.692	S	S	*	*			trans	-63.5	104.6	177	-166.3	171.5	-175.2	0	0	106.9	P268 L272	P268-E270 PolarHBondContact O-N 2.98Å; E270-L272 HydrophobicContact CB-CG 4.48Å; E270-L272 HydrophobicContact CG-CD2 3.94Å; E270-L272 HydrophobicContact CG-CG 4.22Å; E270-L272 PolarHBondContact O-N 3.06Å
271	L	49.9	Very low	49.3	Very low	122 Å²	122	127.2 Å²	127.2	64%	0.639	68%	0.677	S	S	*	*			trans	-66.2	81.7	173.4	-78	140.6	0	0	0	107.6	P269 Y273 L280	P269-L271 PolarHBondContact O-N 3.45Å; L271-Y273 PolarHBondContact O-N 3.03Å; L271-L280 HydrophobicContact CB-CD2 4.17Å
272	L	62.8	Low	51	Low	109 Å²	109	123.6 Å²	123.6	57%	0.571	67%	0.666	S	S	*	*			trans	-67.1	120.9	-178.1	-72.3	169.2	0	0	0	109.7	E270 L281	E270-L272 HydrophobicContact CB-CG 4.48Å; E270-L272 HydrophobicContact CG-CD2 3.94Å; E270-L272 HydrophobicContact CG-CG 4.22Å; E270-L272 PolarHBondContact O-N 3.06Å; L272-L281 PolarHBondContact O-N 3.35Å
273	Y	61.1	Low	52.3	Low	146 Å²	146	121.9 Å²	121.9	57%	0.573	66%	0.663	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.9	137.2	168.9	-101.3	-103.2	0	0	0	109.9	L271 S275 G278 L280	L271-Y273 PolarHBondContact O-N 3.03Å; Y273-S275 PolarHBondContact O-N 3.17Å; Y273-S275 VanDerWaalsContact O-N 3.17Å; Y273-G278 VanDerWaalsContact CD1-C 3.44Å; Y273-G278 WeakPolarHBondContact CD1-O 3.27Å; Y273-G278 WeakPolarHBondContact CE1-O 3.49Å; Y273-L280 HydrophobicContact CD2-CD2 3.51Å; Y273-L280 HydrophobicContact CD2-CG 4.19Å; Y273-L280 HydrophobicContact CE1-CG 4.43Å; Y273-L280 HydrophobicContact CE2-CD1 4.48Å; Y273-L280 HydrophobicContact CE2-CD2 3.19Å; Y273-L280 HydrophobicContact CE2-CG 3.62Å; Y273-L280 HydrophobicContact CG-CD2 4.42Å
274	S	54.6	Low	53.3	Low	25 Å²	25	120.5 Å²	120.5	18%	0.175	67%	0.667	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.4	112.1	164.8	174.8	0	0	0	0	109	K276 T277 G278 R279	S274-K276 PolarHBondContact O-N 2.84Å; S274-K276 VanDerWaalsContact O-N 3.11Å; S274-T277 WeakPolarHBondContact CB-OG1 3.25Å; S274-T277 PolarHBondContact O-N 3.1Å; S274-T277 PolarHBondContact OG-N 3.08Å; S274-T277 PolarHBondContact OG-OG1 2.81Å; S274-G278 WeakPolarHBondContact O-CA 3.08Å; S274-G278 PolarHBondContact O-N 3.2Å; S274-R279 PolarHBondContact N-O 2.86Å
275	S	63.9	Low	54	Low	132 Å²	132	117.1 Å²	117.1	92%	0.923	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-18.3	176.9	35.8	0	0	0	0	113.7	Y273	Y273-S275 PolarHBondContact O-N 3.17Å; Y273-S275 VanDerWaalsContact O-N 3.17Å
276	K	66.1	Low	54.6	Low	197 Å²	197	116.8 Å²	116.8	86%	0.857	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-30.1	177.6	-166.8	164.8	-175.6	175.3	0	113.9	S274	S274-K276 PolarHBondContact O-N 2.84Å; S274-K276 VanDerWaalsContact O-N 3.11Å
277	T	62.2	Low	54.9	Low	81 Å²	81	111.7 Å²	111.7	50%	0.497	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.8	-8.3	-174.1	57	0	0	0	0	113.7	S274 R279	S274-T277 WeakPolarHBondContact CB-OG1 3.25Å; S274-T277 PolarHBondContact O-N 3.1Å; S274-T277 PolarHBondContact OG-N 3.08Å; S274-T277 PolarHBondContact OG-OG1 2.81Å; T277-R279 PolarHBondContact O-N 3.25Å; T277-R279 VanDerWaalsContact O-N 3.14Å
278	G	63.4	Low	55.2	Low	51 Å²	51	116.7 Å²	116.7	53%	0.526	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	56.4	26.4	-173.1	0	0	0	0	0	111.7	Y273 S274	Y273-G278 VanDerWaalsContact CD1-C 3.44Å; Y273-G278 WeakPolarHBondContact CD1-O 3.27Å; Y273-G278 WeakPolarHBondContact CE1-O 3.49Å; S274-G278 WeakPolarHBondContact O-CA 3.08Å; S274-G278 PolarHBondContact O-N 3.2Å
279	R	68.6	Low	55.4	Low	186 Å²	186	121.2 Å²	121.2	70%	0.702	63%	0.634	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.2	139.3	179.3	-68	179.1	-176.4	-135.6	0.6	109.3	S274 T277 L281	S274-R279 PolarHBondContact N-O 2.86Å; T277-R279 PolarHBondContact O-N 3.25Å; T277-R279 VanDerWaalsContact O-N 3.14Å; R279-L281 PolarHBondContact O-N 2.73Å
280	L	67.9	Low	54.9	Low	94 Å²	94	120.9 Å²	120.9	49%	0.492	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-57.5	118.4	166.8	-72.2	166.1	0	0	0	108.5	L271 Y273	L271-L280 HydrophobicContact CB-CD2 4.17Å; Y273-L280 HydrophobicContact CD2-CD2 3.51Å; Y273-L280 HydrophobicContact CD2-CG 4.19Å; Y273-L280 HydrophobicContact CE1-CG 4.43Å; Y273-L280 HydrophobicContact CE2-CD1 4.48Å; Y273-L280 HydrophobicContact CE2-CD2 3.19Å; Y273-L280 HydrophobicContact CE2-CG 3.62Å; Y273-L280 HydrophobicContact CG-CD2 4.42Å
281	L	61.9	Low	54.1	Low	87 Å²	87	124.2 Å²	124.2	46%	0.455	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-76.2	127.8	171.6	-69.9	168	0	0	0	107.7	L272 R279	L272-L281 PolarHBondContact O-N 3.35Å; R279-L281 PolarHBondContact O-N 2.73Å
282	P	61.7	Low	53.4	Low	96 Å²	96	123.3 Å²	123.3	62%	0.623	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-57.4	145.2	174.7	21.2	-29.2	0	0	0	109.2	T284	P282-T284 PolarHBondContact O-N 2.9Å
283	P	56	Low	52	Low	109 Å²	109	128.5 Å²	128.5	71%	0.708	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-49.6	118.9	-175	18.1	-30.5	0	0	0	109.1	N285	P283-N285 PolarHBondContact O-N 3.27Å
284	T	50.4	Low	50.9	Low	122 Å²	122	129.3 Å²	129.3	75%	0.748	66%	0.656	S	S	*	*			trans	-68.6	89.6	176.5	52.5	0	0	0	0	106.4	P282 D286	P282-T284 PolarHBondContact O-N 2.9Å; T284-D286 VanDerWaalsContact C-N 3.27Å; T284-D286 PolarHBondContact O-N 3.33Å
285	N	47.2	Very low	50.3	Low	104 Å²	104	134.8 Å²	134.8	56%	0.556	68%	0.679	S	S	*	*			trans	-65.2	96.7	169.2	-168.9	-12.1	0	0	0	106.4	P283 S287 R288	P283-N285 PolarHBondContact O-N 3.27Å; N285-S287 PolarHBondContact O-N 2.82Å; N285-S287 PolarHBondContact OD1-OG 3.19Å; N285-R288 PolarHBondContact O-N 3.33Å
286	D	45.6	Very low	49.1	Very low	142 Å²	142	133.1 Å²	133.1	76%	0.759	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	39	-177.7	-166.8	19	0	0	0	112.4	T284	T284-D286 VanDerWaalsContact C-N 3.27Å; T284-D286 PolarHBondContact O-N 3.33Å
287	S	44.6	Very low	47.9	Very low	64 Å²	64	128.6 Å²	128.6	45%	0.448	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.1	-2	172	57.6	0	0	0	0	112	N285 Y289 T290	N285-S287 PolarHBondContact O-N 2.82Å; N285-S287 PolarHBondContact OD1-OG 3.19Å; S287-Y289 PolarHBondContact O-N 3.08Å; S287-T290 PolarHBondContact O-OG1 3.19Å
288	R	41.2	Very low	46.6	Very low	193 Å²	193	127.1 Å²	127.1	73%	0.728	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-0.7	-178	-70.7	-167	-77.1	-173.9	-4.6	115.2	N285	N285-R288 PolarHBondContact O-N 3.33Å
289	Y	39.4	Very low	45.3	Very low	208 Å²	208	127.9 Å²	127.9	82%	0.816	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	0.9	174.9	-68	-70.8	0	0	0	114.8	S287 R291	S287-Y289 PolarHBondContact O-N 3.08Å; Y289-R291 VanDerWaalsContact C-N 3.33Å; Y289-R291 PolarHBondContact O-N 2.8Å; Y289-R291 VanDerWaalsContact O-N 3.13Å
290	T	35.9	Very low	43.8	Very low	112 Å²	112	125 Å²	125	69%	0.687	64%	0.64	S	S	*	*			trans	-90.1	76.2	170	55	0	0	0	0	110.4	S287 T292	S287-T290 PolarHBondContact O-OG1 3.19Å; T290-T292 PolarHBondContact O-N 3.22Å
291	R	32.3	Very low	42.3	Very low	228 Å²	228	129 Å²	129	86%	0.86	65%	0.648	S	S	*	*			trans	-62.6	91.3	168.2	-179.9	177.8	166.5	-133	3.2	109.4	Y289	Y289-R291 VanDerWaalsContact C-N 3.33Å; Y289-R291 PolarHBondContact O-N 2.8Å; Y289-R291 VanDerWaalsContact O-N 3.13Å
292	T	35.4	Very low	40.9	Very low	103 Å²	103	134.5 Å²	134.5	63%	0.632	66%	0.663	S	S	*	*			trans	-107	126.4	163.3	60.9	0	0	0	0	110	T290 H294	T290-T292 PolarHBondContact O-N 3.22Å; T292-H294 PolarHBondContact O-N 3.47Å
293	R	33.5	Very low	39.9	Very low	219 Å²	219	135.8 Å²	135.8	83%	0.826	66%	0.661	S	S	*	*	S	Bend	trans	-74.3	25.8	-161.6	-162.8	178.6	-133.8	-179.7	1.7	115
294	H	38.1	Very low	38.9	Very low	163 Å²	163	133.6 Å²	133.6	76%	0.755	65%	0.648	S	S	*	*			trans	-135.9	32.8	-167.1	-65.5	-70.1	0	0	0	115.6	T292	T292-H294 PolarHBondContact O-N 3.47Å
295	Q	41.6	Very low	38.4	Very low	139 Å²	139	133.8 Å²	133.8	65%	0.65	64%	0.644	S	S	*	*			trans	-107.7	75	171.8	-70.3	-173.1	39.3	0	0	111.8	T297	Q295-T297 VanDerWaalsContact C-N 3.34Å
296	S	37.7	Very low	37.9	Very low	98 Å²	98	138.3 Å²	138.3	69%	0.685	65%	0.653	S	S	*	*	S	Bend	trans	-87	2.2	162	-64.3	0	0	0	0	113.3
297	T	42.1	Very low	37.9	Very low	101 Å²	101	137.7 Å²	137.7	62%	0.62	65%	0.65	S	S	*	*	S	Bend	trans	-116.6	2.7	-175	58.1	0	0	0	0	114.7	Q295	Q295-T297 VanDerWaalsContact C-N 3.34Å
298	S	34.8	Very low	37.5	Very low	50 Å²	50	137.7 Å²	137.7	35%	0.35	65%	0.654	S	S	.	*	H	α-helix	trans	-91.5	-30.5	176.5	-175.4	0	0	0	0	112.7	E300 R301 R302	S298-E300 VanDerWaalsContact C-N 3.31Å; S298-E300 PolarHBondContact O-N 3.18Å; S298-R301 PolarHBondContact O-N 2.82Å; S298-R302 PolarHBondContact O-N 3.45Å
299	C	35.5	Very low	37.8	Very low	67 Å²	67	131.4 Å²	131.4	45%	0.453	64%	0.637	S	S	.	*	H	α-helix	trans	-66.2	-33.6	173.8	50.7	0	0	0	0	112	R301 R302 Q303	C299-R301 PolarHBondContact O-N 3.42Å; C299-R302 PolarHBondContact O-N 2.77Å; C299-Q303 WeakPolarHBondContact O-CG 3.49Å; C299-Q303 PolarHBondContact O-N 2.62Å
300	E	38.2	Very low	38.7	Very low	125 Å²	125	123.8 Å²	123.8	58%	0.584	61%	0.614	S	S	*	*	H	α-helix	trans	-65.8	-37	176.8	-73	173.9	162.8	0	0	112.3	S298 R302 Q303 S304	S298-E300 VanDerWaalsContact C-N 3.31Å; S298-E300 PolarHBondContact O-N 3.18Å; E300-R302 VanDerWaalsContact C-N 3.32Å; E300-R302 PolarHBondContact O-N 2.79Å; E300-Q303 PolarHBondContact O-N 2.77Å; E300-S304 WeakPolarHBondContact O-CB 3.32Å; E300-S304 PolarHBondContact O-N 2.81Å; E300-S304 PolarHBondContact O-OG 2.85Å
301	R	34.6	Very low	39.7	Very low	178 Å²	178	122.2 Å²	122.2	67%	0.672	60%	0.604	S	S	*	*	H	α-helix	trans	-69.5	-28.6	175.1	-170.2	175.1	-76.2	124.3	-4.2	112.7	S298 C299 S304 L305	S298-R301 PolarHBondContact O-N 2.82Å; C299-R301 PolarHBondContact O-N 3.42Å; R301-S304 PolarHBondContact O-OG 3.12Å; R301-L305 HydrophobicContact CG-CD1 4.3Å; R301-L305 WeakPolarHBondContact O-CD1 3.43Å; R301-L305 PolarHBondContact O-N 2.94Å
302	R	33.5	Very low	41.3	Very low	204 Å²	204	115.1 Å²	115.1	77%	0.77	59%	0.59	S	S	*	*	H	α-helix	trans	-80.6	-30.9	173.5	-72.8	-170.2	-179.3	176.1	1.4	112.9	S298 C299 E300 R306	S298-R302 PolarHBondContact O-N 3.45Å; C299-R302 PolarHBondContact O-N 2.77Å; E300-R302 VanDerWaalsContact C-N 3.32Å; E300-R302 PolarHBondContact O-N 2.79Å; R302-R306 PolarHBondContact O-N 3.01Å
303	Q	40.2	Very low	42.9	Very low	122 Å²	122	114.8 Å²	114.8	57%	0.57	58%	0.581	S	S	*	*	H	α-helix	trans	-72.8	-36.2	172.6	-74.7	176.5	4.3	0	0	110.9	C299 E300 L305 R306 N307	C299-Q303 WeakPolarHBondContact O-CG 3.49Å; C299-Q303 PolarHBondContact O-N 2.62Å; E300-Q303 PolarHBondContact O-N 2.77Å; Q303-L305 VanDerWaalsContact C-N 3.32Å; Q303-L305 PolarHBondContact O-N 3.2Å; Q303-R306 PolarHBondContact O-N 2.9Å; Q303-N307 PolarHBondContact O-N 2.81Å; Q303-N307 PolarHBondContact O-OD1 3.23Å
304	S	35	Very low	44.8	Very low	64 Å²	64	107.8 Å²	107.8	45%	0.448	56%	0.559	S	S	.	*	H	α-helix	trans	-68.7	-27.4	173.9	76.1	0	0	0	0	113.1	E300 R301 A308	E300-S304 WeakPolarHBondContact O-CB 3.32Å; E300-S304 PolarHBondContact O-N 2.81Å; E300-S304 PolarHBondContact O-OG 2.85Å; R301-S304 PolarHBondContact O-OG 3.12Å; S304-A308 WeakPolarHBondContact O-CA 3.4Å; S304-A308 WeakPolarHBondContact O-CB 3.23Å; S304-A308 PolarHBondContact O-N 2.96Å
305	L	40.4	Very low	46.7	Very low	125 Å²	125	103.2 Å²	103.2	65%	0.654	54%	0.537	S	S	*	.	H	α-helix	trans	-74.7	-24	168.4	-95.7	86.8	0	0	0	113.6	R301 Q303 A308 T309	R301-L305 HydrophobicContact CG-CD1 4.3Å; R301-L305 WeakPolarHBondContact O-CD1 3.43Å; R301-L305 PolarHBondContact O-N 2.94Å; Q303-L305 VanDerWaalsContact C-N 3.32Å; Q303-L305 PolarHBondContact O-N 3.2Å; L305-A308 CarbonylContact O-C 3.42Å; L305-T309 PolarHBondContact O-N 2.96Å
306	R	37.4	Very low	48.4	Very low	200 Å²	200	104.2 Å²	104.2	76%	0.755	54%	0.535	S	S	*	.	H	α-helix	trans	-81.7	-28.9	175.1	-158.9	-179.5	-78	-133.2	0.6	111.6	R302 Q303 T309	R302-R306 PolarHBondContact O-N 3.01Å; Q303-R306 PolarHBondContact O-N 2.9Å; R306-T309 WeakPolarHBondContact O-CG2 3.29Å; R306-T309 PolarHBondContact O-N 3.32Å; R306-T309 PolarHBondContact O-OG1 2.88Å
307	N	43.7	Very low	50.4	Low	128 Å²	128	104.3 Å²	104.3	68%	0.684	53%	0.528	S	S	*	.	H	α-helix	trans	-85	-33.8	174.1	-60.8	-1.8	0	0	0	111.3	Q303 T309	Q303-N307 PolarHBondContact O-N 2.81Å; Q303-N307 PolarHBondContact O-OD1 3.23Å; N307-T309 PolarHBondContact O-N 3.38Å; N307-T309 VanDerWaalsContact O-N 3.16Å; N307-T309 PolarHBondContact O-OG1 3.44Å
308	A	37.6	Very low	52.2	Low	65 Å²	65	101.5 Å²	101.5	54%	0.537	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	33.5	163	0	0	0	0	0	111.6	S304 L305 S310	S304-A308 WeakPolarHBondContact O-CA 3.4Å; S304-A308 WeakPolarHBondContact O-CB 3.23Å; S304-A308 PolarHBondContact O-N 2.96Å; L305-A308 CarbonylContact O-C 3.42Å; A308-S310 WeakPolarHBondContact O-CA 3.41Å; A308-S310 PolarHBondContact O-N 2.8Å
309	T	47.8	Very low	54.6	Low	61 Å²	61	101.3 Å²	101.3	37%	0.374	50%	0.5	S	S	.	.	S	Bend	trans	-46.6	89.8	133.3	37.6	0	0	0	0	105.1	L305 R306 N307	L305-T309 PolarHBondContact O-N 2.96Å; R306-T309 WeakPolarHBondContact O-CG2 3.29Å; R306-T309 PolarHBondContact O-N 3.32Å; R306-T309 PolarHBondContact O-OG1 2.88Å; N307-T309 PolarHBondContact O-N 3.38Å; N307-T309 VanDerWaalsContact O-N 3.16Å; N307-T309 PolarHBondContact O-OG1 3.44Å
310	S	58	Low	56.7	Low	47 Å²	47	104.2 Å²	104.2	33%	0.329	51%	0.508	S	S	.	.			trans	-54.2	150.7	-158.1	55	0	0	0	0	108.8	A308 S312 E313 I314	A308-S310 WeakPolarHBondContact O-CA 3.41Å; A308-S310 PolarHBondContact O-N 2.8Å; S310-S312 CarbonylContact O-C 3.59Å; S310-S312 PolarHBondContact O-N 3.41Å; S310-E313 WeakPolarHBondContact O-CA 3.4Å; S310-E313 PolarHBondContact O-N 3.29Å; S310-E313 PolarHBondContact OG-N 3.45Å; S310-E313 VanDerWaalsContact OG-N 3.11Å; S310-I314 PolarHBondContact O-N 3.38Å; S310-I314 VanDerWaalsContact O-N 3.08Å
311	V	56.3	Low	58.9	Low	79 Å²	79	101.4 Å²	101.4	48%	0.479	49%	0.494	S	S	.	.	H	α-helix	trans	-46.2	-33.2	169.8	177.2	0	0	0	0	110.1	I215 F315	I215-V311 HydrophobicContact CG2-CG1 3.81Å; I215-V311 HydrophobicContact CG2-CG2 4.08Å; V311-F315 VanDerWaalsContact O-CB 3.23Å; V311-F315 WeakPolarHBondContact O-CB 3.16Å; V311-F315 PolarHBondContact O-N 2.87Å
312	S	65	Low	61.3	Low	80 Å²	80	93 Å²	93	56%	0.559	46%	0.462	S	S	*	.	H	α-helix	trans	-64.7	-36.9	172.2	-47.9	0	0	0	0	115.7	S310 R316	S310-S312 CarbonylContact O-C 3.59Å; S310-S312 PolarHBondContact O-N 3.41Å; S312-R316 VanDerWaalsContact O-CB 3.29Å; S312-R316 WeakPolarHBondContact O-CB 3.49Å; S312-R316 PolarHBondContact O-N 3.19Å
313	E	70.1	Confident	63.8	Low	96 Å²	96	84.8 Å²	84.8	45%	0.449	43%	0.433	S	S	.	.	H	α-helix	trans	-77.3	-38.4	178.2	-169.4	151	-155.4	0	0	111.7	S310 F315 R316 N317	S310-E313 WeakPolarHBondContact O-CA 3.4Å; S310-E313 PolarHBondContact O-N 3.29Å; S310-E313 PolarHBondContact OG-N 3.45Å; S310-E313 VanDerWaalsContact OG-N 3.11Å; E313-F315 VanDerWaalsContact C-N 3.34Å; E313-R316 PolarHBondContact O-N 2.95Å; E313-N317 PolarHBondContact O-N 3.09Å; E313-N317 PolarHBondContact O-ND2 3.43Å; E313-N317 VanDerWaalsContact O-ND2 3.14Å
314	I	73.6	Confident	65.9	Low	72 Å²	72	81.4 Å²	81.4	37%	0.369	43%	0.425	S	S	.	.	H	α-helix	trans	-59.4	-49.3	169.9	-61.7	169.3	0	0	0	109.2	S310 R316 N317 Y318	S310-I314 PolarHBondContact O-N 3.38Å; S310-I314 VanDerWaalsContact O-N 3.08Å; I314-R316 VanDerWaalsContact C-N 3.34Å; I314-R316 PolarHBondContact O-N 2.94Å; I314-N317 WeakPolarHBondContact O-CB 3.32Å; I314-N317 PolarHBondContact O-N 3.38Å; I314-N317 VanDerWaalsContact O-N 3.13Å; I314-Y318 HydrophobicContact CG2-CD2 3.83Å; I314-Y318 HydrophobicContact CG2-CE2 3.56Å; I314-Y318 WeakPolarHBondContact O-CD2 3.47Å; I314-Y318 PolarHBondContact O-N 2.84Å; I314-Y318 VanDerWaalsContact O-N 3.08Å
315	F	77.1	Confident	68.3	Low	67 Å²	67	80.3 Å²	80.3	29%	0.294	41%	0.414	S	S	.	.	H	α-helix	trans	-57.2	-44.7	176.2	-174.1	-92	0	0	0	112.5	T204 L208 V311 E313 N317 Y318 E319	T204-F315 WeakPolarHBondContact OG1-CE2 3.44Å; T204-F315 WeakPolarHBondContact OG1-CZ 3.09Å; L208-F315 HydrophobicContact CD1-CD2 3.66Å; L208-F315 HydrophobicContact CD1-CE2 4.21Å; V311-F315 VanDerWaalsContact O-CB 3.23Å; V311-F315 WeakPolarHBondContact O-CB 3.16Å; V311-F315 PolarHBondContact O-N 2.87Å; E313-F315 VanDerWaalsContact C-N 3.34Å; F315-N317 VanDerWaalsContact C-N 3.3Å; F315-N317 PolarHBondContact O-N 2.99Å; F315-Y318 PolarHBondContact O-N 3.42Å; F315-E319 WeakPolarHBondContact O-CB 3.43Å; F315-E319 PolarHBondContact O-N 2.81Å
316	R	78.6	Confident	70.5	Confident	159 Å²	159	74.3 Å²	74.3	60%	0.6	38%	0.382	S	S	*	.	H	α-helix	trans	-63.6	-34.5	177.2	-170.5	177.3	-70.2	164.5	-1	112.6	S312 E313 I314 E319 M320	S312-R316 VanDerWaalsContact O-CB 3.29Å; S312-R316 WeakPolarHBondContact O-CB 3.49Å; S312-R316 PolarHBondContact O-N 3.19Å; E313-R316 PolarHBondContact O-N 2.95Å; I314-R316 VanDerWaalsContact C-N 3.34Å; I314-R316 PolarHBondContact O-N 2.94Å; R316-E319 WeakPolarHBondContact O-CB 3.29Å; R316-E319 PolarHBondContact O-N 3.12Å; R316-M320 PolarHBondContact O-N 2.93Å
317	N	78.4	Confident	72.8	Confident	101 Å²	101	65.8 Å²	65.8	54%	0.54	35%	0.353	S	S	.	.	H	α-helix	trans	-66.5	-40.9	174.8	-66.7	-27.8	0	0	0	111.3	E313 I314 F315 K321	E313-N317 PolarHBondContact O-N 3.09Å; E313-N317 PolarHBondContact O-ND2 3.43Å; E313-N317 VanDerWaalsContact O-ND2 3.14Å; I314-N317 WeakPolarHBondContact O-CB 3.32Å; I314-N317 PolarHBondContact O-N 3.38Å; I314-N317 VanDerWaalsContact O-N 3.13Å; F315-N317 VanDerWaalsContact C-N 3.3Å; F315-N317 PolarHBondContact O-N 2.99Å; N317-K321 WeakPolarHBondContact O-CB 3.2Å; N317-K321 PolarHBondContact O-N 3.14Å; N317-K321 VanDerWaalsContact O-N 3.11Å
318	Y	81.1	Confident	74.8	Confident	42 Å²	42	64 Å²	64	17%	0.165	35%	0.35	C	S	.	.	H	α-helix	trans	-68.1	-39.2	173.5	-76.1	-76.6	0	0	0	112.2	L208 I213 I314 F315 M320 K321 I322 L361	L208-Y318 HydrophobicContact CD1-CD2 4.27Å; L208-Y318 HydrophobicContact CD1-CG 4.45Å; L208-Y318 HydrophobicContact CD2-CD1 3.81Å; L208-Y318 HydrophobicContact CD2-CD2 3.46Å; L208-Y318 VanDerWaalsContact CD2-CD2 3.46Å; L208-Y318 HydrophobicContact CD2-CE1 3.96Å; L208-Y318 HydrophobicContact CD2-CE2 3.61Å; L208-Y318 HydrophobicContact CD2-CG 3.57Å; L208-Y318 HydrophobicContact CG-CD2 4.42Å; L208-Y318 HydrophobicContact CG-CG 4.38Å; I213-Y318 HydrophobicContact CD1-CE1 4.21Å; I213-Y318 HydrophobicContact CD1-CE2 4.16Å; I213-Y318 WeakPolarHBondContact CD1-OH 3.34Å; I314-Y318 HydrophobicContact CG2-CD2 3.83Å; I314-Y318 HydrophobicContact CG2-CE2 3.56Å; I314-Y318 WeakPolarHBondContact O-CD2 3.47Å; I314-Y318 PolarHBondContact O-N 2.84Å; I314-Y318 VanDerWaalsContact O-N 3.08Å; F315-Y318 PolarHBondContact O-N 3.42Å; Y318-M320 PolarHBondContact O-N 3.4Å; Y318-K321 PolarHBondContact O-N 3.31Å; Y318-I322 VanDerWaalsContact O-CB 3.28Å; Y318-I322 WeakPolarHBondContact O-CB 3.22Å; Y318-I322 WeakPolarHBondContact O-CG1 3.37Å; Y318-I322 PolarHBondContact O-N 2.85Å; Y318-L361 HydrophobicContact CD1-CD1 4.46Å
319	E	83.9	Confident	77.1	Confident	46 Å²	46	63.8 Å²	63.8	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-56.2	-49.2	173.7	-170.3	-176.4	179.1	0	0	111.9	L200 T204 F315 R316 K321 I322 F323	L200-E319 HydrophobicContact CD2-CG 3.48Å; L200-E319 VanDerWaalsContact CD2-CG 3.48Å; L200-E319 HydrophobicContact CG-CG 3.83Å; T204-E319 HydrophobicContact CG2-CB 4Å; T204-E319 HydrophobicContact CG2-CG 4.23Å; F315-E319 WeakPolarHBondContact O-CB 3.43Å; F315-E319 PolarHBondContact O-N 2.81Å; R316-E319 WeakPolarHBondContact O-CB 3.29Å; R316-E319 PolarHBondContact O-N 3.12Å; E319-K321 VanDerWaalsContact C-N 3.32Å; E319-K321 PolarHBondContact O-N 3.38Å; E319-I322 PolarHBondContact O-N 3.41Å; E319-F323 VanDerWaalsContact O-CB 3.23Å; E319-F323 WeakPolarHBondContact O-CB 3.28Å; E319-F323 PolarHBondContact O-N 2.84Å
320	M	81.1	Confident	79	Confident	127 Å²	127	63.2 Å²	63.2	63%	0.626	33%	0.334	S	S	*	.	H	α-helix	trans	-63	-39	178	-169.1	59.5	60.1	0	0	112.2	R316 Y318 A324	R316-M320 PolarHBondContact O-N 2.93Å; Y318-M320 PolarHBondContact O-N 3.4Å; M320-A324 WeakPolarHBondContact O-CB 3.16Å; M320-A324 PolarHBondContact O-N 3.36Å
321	K	84.3	Confident	80.5	Confident	66 Å²	66	68.2 Å²	68.2	29%	0.287	35%	0.352	S	S	.	.	H	α-helix	trans	-71.6	-41.4	179.6	-171.2	176.2	-178.3	-171.6	0	112.4	N317 Y318 E319 A324 M325 L361	N317-K321 WeakPolarHBondContact O-CB 3.2Å; N317-K321 PolarHBondContact O-N 3.14Å; N317-K321 VanDerWaalsContact O-N 3.11Å; Y318-K321 PolarHBondContact O-N 3.31Å; E319-K321 VanDerWaalsContact C-N 3.32Å; E319-K321 PolarHBondContact O-N 3.38Å; K321-A324 PolarHBondContact O-N 3Å; K321-M325 WeakPolarHBondContact O-CB 3.37Å; K321-M325 PolarHBondContact O-N 3.46Å; K321-L361 HydrophobicContact CD-CD2 3.77Å; K321-L361 HydrophobicContact CG-CD2 4.45Å
322	I	84.5	Confident	81.9	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-66.6	-44.1	176.5	-69.9	168.8	0	0	0	109.3	L200 T204 I207 Y318 E319 A324 M325 I326 V357	L200-I322 HydrophobicContact CD1-CG2 4.19Å; T204-I322 HydrophobicContact CG2-CB 4.18Å; T204-I322 HydrophobicContact CG2-CD1 3.51Å; T204-I322 HydrophobicContact CG2-CG1 4.38Å; T204-I322 HydrophobicContact CG2-CG2 4.36Å; I207-I322 HydrophobicContact CB-CD1 4.18Å; I207-I322 HydrophobicContact CD1-CD1 3.63Å; I207-I322 HydrophobicContact CD1-CG1 4.11Å; I207-I322 HydrophobicContact CD1-CG2 4.16Å; I207-I322 HydrophobicContact CG2-CD1 4.2Å; Y318-I322 VanDerWaalsContact O-CB 3.28Å; Y318-I322 WeakPolarHBondContact O-CB 3.22Å; Y318-I322 WeakPolarHBondContact O-CG1 3.37Å; Y318-I322 PolarHBondContact O-N 2.85Å; E319-I322 PolarHBondContact O-N 3.41Å; I322-A324 VanDerWaalsContact C-N 3.35Å; I322-A324 PolarHBondContact O-N 2.94Å; I322-M325 CarbonylContact O-C 3.56Å; I322-M325 WeakPolarHBondContact O-CB 3.24Å; I322-M325 PolarHBondContact O-N 3.49Å; I322-M325 VanDerWaalsContact O-N 3.09Å; I322-I326 HydrophobicContact CG2-CD1 3.82Å; I322-I326 HydrophobicContact CG2-CG1 4.36Å; I322-I326 VanDerWaalsContact O-CG1 3.32Å; I322-I326 WeakPolarHBondContact O-CG1 3.47Å; I322-I326 PolarHBondContact O-N 3.42Å; I322-V357 HydrophobicContact CG1-CG1 3.96Å
323	F	85.8	Confident	82.8	Confident	33 Å²	33	70.4 Å²	70.4	15%	0.145	36%	0.357	C	S	.	.	H	α-helix	trans	-56.4	-48.2	172.9	-178.9	-95.7	0	0	0	111.6	L200 E319 M325 I326 C327 M335 V338	L200-F323 HydrophobicContact CD2-CB 4.41Å; L200-F323 HydrophobicContact CD2-CD2 4.36Å; E319-F323 VanDerWaalsContact O-CB 3.23Å; E319-F323 WeakPolarHBondContact O-CB 3.28Å; E319-F323 PolarHBondContact O-N 2.84Å; F323-M325 VanDerWaalsContact C-N 3.27Å; F323-M325 PolarHBondContact O-N 3.11Å; F323-I326 PolarHBondContact O-N 2.83Å; F323-C327 WeakPolarHBondContact CE1-SG 3.26Å; F323-C327 PolarHBondContact O-N 3.08Å; F323-C327 PolarHBondContact O-SG 3.29Å; F323-M335 HydrophobicContact CE1-CE 3.88Å; F323-M335 HydrophobicContact CE2-CE 3.91Å; F323-M335 HydrophobicContact CE2-SD 3.67Å; F323-M335 HydrophobicContact CZ-CE 3.34Å; F323-M335 HydrophobicContact CZ-SD 3.57Å; F323-M335 VanDerWaalsContact CZ-SD 3.57Å; F323-V338 HydrophobicContact CD2-CG1 4.09Å; F323-V338 HydrophobicContact CE2-CB 4.02Å; F323-V338 HydrophobicContact CE2-CG1 3.58Å; F323-V338 HydrophobicContact CE2-CG2 4.43Å; F323-V338 HydrophobicContact CZ-CB 4.46Å; F323-V338 HydrophobicContact CZ-CG1 4.42Å
324	A	84.7	Confident	83.4	Confident	51 Å²	51	69.5 Å²	69.5	42%	0.421	36%	0.355	S	S	.	.	H	α-helix	trans	-60.9	-35.9	176.1	0	0	0	0	0	112.8	M320 K321 I322 S328	M320-A324 WeakPolarHBondContact O-CB 3.16Å; M320-A324 PolarHBondContact O-N 3.36Å; K321-A324 PolarHBondContact O-N 3Å; I322-A324 VanDerWaalsContact C-N 3.35Å; I322-A324 PolarHBondContact O-N 2.94Å; A324-S328 PolarHBondContact O-N 2.98Å; A324-S328 VanDerWaalsContact O-N 3.08Å; A324-S328 PolarHBondContact O-OG 2.99Å
325	M	85.5	Confident	83.9	Confident	40 Å²	40	69.8 Å²	69.8	20%	0.197	36%	0.356	C	S	.	.	H	α-helix	trans	-70.4	-40.3	176	-161.3	172.5	-60.1	0	0	111.8	K321 I322 F323 S328 I329 V357 A360 L361	K321-M325 WeakPolarHBondContact O-CB 3.37Å; K321-M325 PolarHBondContact O-N 3.46Å; I322-M325 CarbonylContact O-C 3.56Å; I322-M325 WeakPolarHBondContact O-CB 3.24Å; I322-M325 PolarHBondContact O-N 3.49Å; I322-M325 VanDerWaalsContact O-N 3.09Å; F323-M325 VanDerWaalsContact C-N 3.27Å; F323-M325 PolarHBondContact O-N 3.11Å; M325-S328 CarbonylContact O-C 3.58Å; M325-S328 WeakPolarHBondContact O-CA 3.48Å; M325-S328 WeakPolarHBondContact O-CB 3.4Å; M325-S328 PolarHBondContact O-N 3.38Å; M325-S328 VanDerWaalsContact O-N 3.1Å; M325-I329 HydrophobicContact CG-CD1 4.16Å; M325-I329 VanDerWaalsContact O-CG1 3.3Å; M325-I329 WeakPolarHBondContact O-CG1 3.28Å; M325-I329 PolarHBondContact O-N 2.68Å; M325-V357 HydrophobicContact CB-CG2 4.44Å; M325-V357 HydrophobicContact CE-CG1 4.35Å; M325-V357 HydrophobicContact CG-CG2 4.09Å; M325-V357 HydrophobicContact SD-CB 3.84Å; M325-V357 HydrophobicContact SD-CG1 3.73Å; M325-V357 HydrophobicContact SD-CG2 3.57Å; M325-V357 VanDerWaalsContact SD-CG2 3.57Å; M325-A360 HydrophobicContact CE-CB 3.88Å; M325-A360 HydrophobicContact SD-CB 3.77Å; M325-L361 HydrophobicContact CE-CD2 4.38Å; M325-L361 HydrophobicContact CE-CG 4.48Å
326	I	86.4	Confident	84.2	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-46.7	174	-69.2	166.9	0	0	0	110.4	L200 L203 I322 F323 S328 I329 L330 V338 W341 L342 I353	L200-I326 HydrophobicContact CD1-CD1 3.99Å; L203-I326 HydrophobicContact CD1-CD1 4.14Å; I322-I326 HydrophobicContact CG2-CD1 3.82Å; I322-I326 HydrophobicContact CG2-CG1 4.36Å; I322-I326 VanDerWaalsContact O-CG1 3.32Å; I322-I326 WeakPolarHBondContact O-CG1 3.47Å; I322-I326 PolarHBondContact O-N 3.42Å; F323-I326 PolarHBondContact O-N 2.83Å; I326-S328 PolarHBondContact O-N 2.83Å; I326-I329 PolarHBondContact O-N 2.82Å; I326-I329 VanDerWaalsContact O-N 3.17Å; I326-L330 HydrophobicContact CG2-CD1 3.64Å; I326-L330 HydrophobicContact CG2-CG 4.19Å; I326-L330 WeakPolarHBondContact O-CB 2.88Å; I326-L330 WeakPolarHBondContact O-CG 3.19Å; I326-L330 PolarHBondContact O-N 3.34Å; I326-V338 HydrophobicContact CG2-CG1 3.91Å; I326-W341 HydrophobicContact CG2-CE3 4.24Å; I326-W341 HydrophobicContact CG2-CZ3 4.21Å; I326-L342 HydrophobicContact CD1-CD2 4.39Å; I326-I353 HydrophobicContact CG1-CG2 3.99Å
327	C	85.2	Confident	84.4	Confident	21 Å²	21	65.7 Å²	65.7	14%	0.142	35%	0.354	C	S	.	.	H	α-helix	trans	-54.8	-38.7	173	-70.2	0	0	0	0	111.9	F323 Q331 T332	F323-C327 WeakPolarHBondContact CE1-SG 3.26Å; F323-C327 PolarHBondContact O-N 3.08Å; F323-C327 PolarHBondContact O-SG 3.29Å; C327-Q331 CarbonylContact O-C 3.6Å; C327-Q331 VanDerWaalsContact O-CA 3.32Å; C327-Q331 WeakPolarHBondContact O-CA 3.33Å; C327-Q331 PolarHBondContact O-N 3.3Å; C327-T332 WeakPolarHBondContact CA-O 3.13Å; C327-T332 WeakPolarHBondContact CB-O 3.5Å; C327-T332 PolarHBondContact O-N 2.93Å
328	S	86.9	Confident	84.7	Confident	89 Å²	89	60.9 Å²	60.9	62%	0.622	33%	0.328	S	S	*	.	H	α-helix	trans	-71.6	-41.1	178.1	-56.2	0	0	0	0	112.5	A324 M325 I326 Q331	A324-S328 PolarHBondContact O-N 2.98Å; A324-S328 VanDerWaalsContact O-N 3.08Å; A324-S328 PolarHBondContact O-OG 2.99Å; M325-S328 CarbonylContact O-C 3.58Å; M325-S328 WeakPolarHBondContact O-CA 3.48Å; M325-S328 WeakPolarHBondContact O-CB 3.4Å; M325-S328 PolarHBondContact O-N 3.38Å; M325-S328 VanDerWaalsContact O-N 3.1Å; I326-S328 PolarHBondContact O-N 2.83Å; S328-Q331 PolarHBondContact O-N 2.7Å
329	I	85.2	Confident	84.7	Confident	61 Å²	61	61.2 Å²	61.2	31%	0.313	33%	0.331	S	S	.	.	H	α-helix	trans	-66.4	-44.3	177.9	-67.1	161	0	0	0	110.6	M325 I326 Q331 I353 L356 V357	M325-I329 HydrophobicContact CG-CD1 4.16Å; M325-I329 VanDerWaalsContact O-CG1 3.3Å; M325-I329 WeakPolarHBondContact O-CG1 3.28Å; M325-I329 PolarHBondContact O-N 2.68Å; I326-I329 PolarHBondContact O-N 2.82Å; I326-I329 VanDerWaalsContact O-N 3.17Å; I329-Q331 VanDerWaalsContact C-N 3.28Å; I329-Q331 PolarHBondContact O-N 2.93Å; I329-I353 HydrophobicContact CD1-CD1 4.31Å; I329-I353 HydrophobicContact CD1-CG2 4.21Å; I329-I353 HydrophobicContact CG2-CD1 4.06Å; I329-L356 HydrophobicContact CD1-CD2 3.73Å; I329-L356 HydrophobicContact CD1-CG 4.45Å; I329-L356 HydrophobicContact CG1-CD2 3.92Å; I329-V357 HydrophobicContact CD1-CG2 4.13Å
330	L	87.9	Confident	84.6	Confident	50 Å²	50	63.8 Å²	63.8	26%	0.262	34%	0.343	S	S	.	.	H	α-helix	trans	-79.8	-10.1	179.1	-62.1	178.3	0	0	0	113.2	I326 T332 W341	I326-L330 HydrophobicContact CG2-CD1 3.64Å; I326-L330 HydrophobicContact CG2-CG 4.19Å; I326-L330 WeakPolarHBondContact O-CB 2.88Å; I326-L330 WeakPolarHBondContact O-CG 3.19Å; I326-L330 PolarHBondContact O-N 3.34Å; L330-T332 HydrophobicContact CB-CG2 4.31Å; L330-T332 PolarHBondContact O-N 2.87Å; L330-W341 HydrophobicContact CD1-CB 4Å; L330-W341 HydrophobicContact CD1-CD2 3.59Å; L330-W341 HydrophobicContact CD1-CE3 3.83Å; L330-W341 HydrophobicContact CD1-CG 3.64Å; L330-W341 HydrophobicContact CD2-CD2 4.08Å; L330-W341 HydrophobicContact CD2-CG 4.17Å; L330-W341 HydrophobicContact CD2-CZ2 4.43Å; L330-W341 HydrophobicContact CG-CD2 4.43Å
331	Q	89.3	Confident	84.9	Confident	152 Å²	152	59.8 Å²	59.8	71%	0.71	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	34.8	-173.9	-54.3	177.8	15.8	0	0	112.9	C327 S328 I329	C327-Q331 CarbonylContact O-C 3.6Å; C327-Q331 VanDerWaalsContact O-CA 3.32Å; C327-Q331 WeakPolarHBondContact O-CA 3.33Å; C327-Q331 PolarHBondContact O-N 3.3Å; S328-Q331 PolarHBondContact O-N 2.7Å; I329-Q331 VanDerWaalsContact C-N 3.28Å; I329-Q331 PolarHBondContact O-N 2.93Å
332	T	86	Confident	84.7	Confident	45 Å²	45	56.7 Å²	56.7	28%	0.276	31%	0.308	S	S	.	.			trans	-116.5	142.4	-179.9	55.6	0	0	0	0	110.9	C327 L330 A337 V338	C327-T332 WeakPolarHBondContact CA-O 3.13Å; C327-T332 WeakPolarHBondContact CB-O 3.5Å; C327-T332 PolarHBondContact O-N 2.93Å; L330-T332 HydrophobicContact CB-CG2 4.31Å; L330-T332 PolarHBondContact O-N 2.87Å; T332-A337 HydrophobicContact CG2-CB 4.31Å; T332-V338 WeakPolarHBondContact OG1-CG2 3.22Å
333	N	82.7	Confident	84.5	Confident	160 Å²	160	60.7 Å²	60.7	86%	0.856	33%	0.326	S	S	*	.			trans	-109.8	-2.2	168.8	65.7	-15.8	0	0	0	112.3
334	D	83.8	Confident	84.4	Confident	76 Å²	76	63.7 Å²	63.7	41%	0.406	34%	0.344	S	S	.	.			trans	-86	118.9	179.5	-174.1	4.6	0	0	0	110.5	N336 A337 V338	D334-N336 PolarHBondContact O-N 3.3Å; D334-N336 PolarHBondContact OD1-N 3.11Å; D334-N336 PolarHBondContact OD1-ND2 3.22Å; D334-A337 HydrophobicContact CB-CB 4Å; D334-A337 PolarHBondContact O-N 2.91Å; D334-V338 PolarHBondContact O-N 3.4Å
335	M	82.9	Confident	84.4	Confident	78 Å²	78	61.8 Å²	61.8	38%	0.384	33%	0.328	S	S	.	.	H	α-helix	trans	-55.3	-39.4	174	179.4	63	69.7	0	0	111.4	W196 F323 A337 V338 Q339	W196-M335 HydrophobicContact CH2-SD 4.3Å; F323-M335 HydrophobicContact CE1-CE 3.88Å; F323-M335 HydrophobicContact CE2-CE 3.91Å; F323-M335 HydrophobicContact CE2-SD 3.67Å; F323-M335 HydrophobicContact CZ-CE 3.34Å; F323-M335 HydrophobicContact CZ-SD 3.57Å; F323-M335 VanDerWaalsContact CZ-SD 3.57Å; M335-A337 PolarHBondContact O-N 2.78Å; M335-V338 PolarHBondContact O-N 3.46Å; M335-Q339 HydrophobicContact CG-CG 4.38Å; M335-Q339 WeakPolarHBondContact O-CB 3.49Å; M335-Q339 WeakPolarHBondContact O-CG 3.41Å; M335-Q339 PolarHBondContact O-N 2.94Å; M335-Q339 HydrophobicContact SD-CG 4.32Å
336	N	84.2	Confident	84.4	Confident	102 Å²	102	63.4 Å²	63.4	55%	0.545	34%	0.34	S	S	.	.	H	α-helix	trans	-68.9	-37.2	-177.2	-59.2	-37.9	0	0	0	111.5	D334 Q339 H340	D334-N336 PolarHBondContact O-N 3.3Å; D334-N336 PolarHBondContact OD1-N 3.11Å; D334-N336 PolarHBondContact OD1-ND2 3.22Å; N336-Q339 PolarHBondContact O-N 2.83Å; N336-H340 WeakPolarHBondContact O-CB 3.49Å; N336-H340 PolarHBondContact O-N 2.99Å
337	A	83.8	Confident	84.2	Confident	38 Å²	38	69.1 Å²	69.1	31%	0.314	37%	0.371	S	S	.	.	H	α-helix	trans	-65.5	-42.5	176.4	0	0	0	0	0	111.4	T332 D334 M335 H340 W341	T332-A337 HydrophobicContact CG2-CB 4.31Å; D334-A337 HydrophobicContact CB-CB 4Å; D334-A337 PolarHBondContact O-N 2.91Å; M335-A337 PolarHBondContact O-N 2.78Å; A337-H340 PolarHBondContact O-N 2.83Å; A337-W341 WeakPolarHBondContact O-CB 3.32Å; A337-W341 PolarHBondContact O-N 3.11Å
338	V	82.6	Confident	84	Confident	0 Å²	0	78 Å²	78	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-66.6	-39.5	175.8	179.4	0	0	0	0	111.2	F323 I326 T332 D334 M335 W341 L342	F323-V338 HydrophobicContact CD2-CG1 4.09Å; F323-V338 HydrophobicContact CE2-CB 4.02Å; F323-V338 HydrophobicContact CE2-CG1 3.58Å; F323-V338 HydrophobicContact CE2-CG2 4.43Å; F323-V338 HydrophobicContact CZ-CB 4.46Å; F323-V338 HydrophobicContact CZ-CG1 4.42Å; I326-V338 HydrophobicContact CG2-CG1 3.91Å; T332-V338 WeakPolarHBondContact OG1-CG2 3.22Å; D334-V338 PolarHBondContact O-N 3.4Å; M335-V338 PolarHBondContact O-N 3.46Å; V338-W341 PolarHBondContact O-N 3.28Å; V338-L342 HydrophobicContact CG1-CD1 3.96Å; V338-L342 HydrophobicContact CG1-CG 4.3Å; V338-L342 WeakPolarHBondContact O-CB 2.99Å; V338-L342 WeakPolarHBondContact O-CG 3.42Å; V338-L342 PolarHBondContact O-N 3.12Å
339	Q	82.7	Confident	84	Confident	49 Å²	49	77.8 Å²	77.8	23%	0.229	39%	0.391	C	S	.	.	H	α-helix	trans	-61.1	-48.6	175.1	-74.8	174.8	-0.6	0	0	111.8	W196 M335 N336 W341 L342 E343	W196-Q339 HydrophobicContact CB-CG 4.41Å; W196-Q339 HydrophobicContact CD2-CG 3.79Å; W196-Q339 VanDerWaalsContact CE2-NE2 3.31Å; W196-Q339 HydrophobicContact CE3-CG 4.46Å; W196-Q339 HydrophobicContact CG-CB 4.33Å; W196-Q339 HydrophobicContact CG-CG 3.74Å; M335-Q339 HydrophobicContact CG-CG 4.38Å; M335-Q339 WeakPolarHBondContact O-CB 3.49Å; M335-Q339 WeakPolarHBondContact O-CG 3.41Å; M335-Q339 PolarHBondContact O-N 2.94Å; M335-Q339 HydrophobicContact SD-CG 4.32Å; N336-Q339 PolarHBondContact O-N 2.83Å; Q339-W341 VanDerWaalsContact C-N 3.29Å; Q339-W341 PolarHBondContact O-N 3.4Å; Q339-L342 PolarHBondContact O-N 3.16Å; Q339-E343 WeakPolarHBondContact O-CB 3.4Å; Q339-E343 PolarHBondContact O-N 2.85Å
340	H	80.6	Confident	84	Confident	100 Å²	100	76 Å²	76	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-63.5	-37.1	177.4	-176.1	-78.3	0	0	0	111.9	N336 A337 N344	N336-H340 WeakPolarHBondContact O-CB 3.49Å; N336-H340 PolarHBondContact O-N 2.99Å; A337-H340 PolarHBondContact O-N 2.83Å; H340-N344 PolarHBondContact CD2-ND2 3.35Å; H340-N344 PolarHBondContact CE1-ND2 3.41Å; H340-N344 PolarHBondContact ND1-ND2 3.4Å; H340-N344 PolarHBondContact NE2-ND2 2.95Å; H340-N344 VanDerWaalsContact NE2-ND2 3.17Å; H340-N344 WeakPolarHBondContact O-CB 3Å; H340-N344 PolarHBondContact O-N 2.89Å; H340-N344 PolarHBondContact O-ND2 3.26Å
341	W	87.1	Confident	83.7	Confident	44 Å²	44	78 Å²	78	17%	0.167	39%	0.392	C	S	.	.	H	α-helix	trans	-65.7	-47.6	174	-176.9	84.8	0	0	0	111.1	I326 L330 A337 V338 Q339 E343 N344 A345 E349 I353	I326-W341 HydrophobicContact CG2-CE3 4.24Å; I326-W341 HydrophobicContact CG2-CZ3 4.21Å; L330-W341 HydrophobicContact CD1-CB 4Å; L330-W341 HydrophobicContact CD1-CD2 3.59Å; L330-W341 HydrophobicContact CD1-CE3 3.83Å; L330-W341 HydrophobicContact CD1-CG 3.64Å; L330-W341 HydrophobicContact CD2-CD2 4.08Å; L330-W341 HydrophobicContact CD2-CG 4.17Å; L330-W341 HydrophobicContact CD2-CZ2 4.43Å; L330-W341 HydrophobicContact CG-CD2 4.43Å; A337-W341 WeakPolarHBondContact O-CB 3.32Å; A337-W341 PolarHBondContact O-N 3.11Å; V338-W341 PolarHBondContact O-N 3.28Å; Q339-W341 VanDerWaalsContact C-N 3.29Å; Q339-W341 PolarHBondContact O-N 3.4Å; W341-E343 VanDerWaalsContact C-N 3.27Å; W341-E343 PolarHBondContact O-N 3.17Å; W341-N344 PolarHBondContact O-N 3.36Å; W341-A345 HydrophobicContact CD2-CB 3.97Å; W341-A345 HydrophobicContact CE3-CB 4.4Å; W341-A345 HydrophobicContact CG-CB 4.41Å; W341-A345 HydrophobicContact CH2-CB 4.18Å; W341-A345 HydrophobicContact CZ2-CB 3.8Å; W341-A345 WeakPolarHBondContact O-CA 3.15Å; W341-A345 WeakPolarHBondContact O-CB 3.32Å; W341-A345 PolarHBondContact O-N 3.44Å; W341-E349 HydrophobicContact CZ2-CB 4.16Å; W341-I353 HydrophobicContact CH2-CB 4.45Å; W341-I353 HydrophobicContact CH2-CD1 3.15Å; W341-I353 HydrophobicContact CH2-CG1 3.78Å; W341-I353 HydrophobicContact CZ2-CD1 3.53Å; W341-I353 HydrophobicContact CZ2-CG1 4.13Å; W341-I353 HydrophobicContact CZ3-CD1 3.86Å
342	L	81	Confident	83.6	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-60.9	-36	178	-76	170.1	0	0	0	112.8	W196 L200 L203 I326 V338 Q339 K350	W196-L342 HydrophobicContact CB-CB 4.37Å; W196-L342 HydrophobicContact CE3-CD1 4.26Å; L200-L342 HydrophobicContact CB-CD1 4.36Å; L203-L342 HydrophobicContact CD1-CD2 3.55Å; I326-L342 HydrophobicContact CD1-CD2 4.39Å; V338-L342 HydrophobicContact CG1-CD1 3.96Å; V338-L342 HydrophobicContact CG1-CG 4.3Å; V338-L342 WeakPolarHBondContact O-CB 2.99Å; V338-L342 WeakPolarHBondContact O-CG 3.42Å; V338-L342 PolarHBondContact O-N 3.12Å; Q339-L342 PolarHBondContact O-N 3.16Å; L342-K350 WeakPolarHBondContact O-CE 3.14Å; L342-K350 PolarHBondContact O-NZ 2.88Å
343	E	81.1	Confident	83.6	Confident	85 Å²	85	75 Å²	75	40%	0.397	38%	0.378	S	S	.	.	H	α-helix	trans	-73.6	-37.8	178.8	-171.6	168.7	-164.9	0	0	112.7	Q339 W341	Q339-E343 WeakPolarHBondContact O-CB 3.4Å; Q339-E343 PolarHBondContact O-N 2.85Å; W341-E343 VanDerWaalsContact C-N 3.27Å; W341-E343 PolarHBondContact O-N 3.17Å
344	N	82.8	Confident	83.6	Confident	97 Å²	97	68 Å²	68	52%	0.519	34%	0.34	S	S	.	.	H	α-helix	trans	-108.7	-7.6	-172.7	-61.9	-63.7	0	0	0	115.2	H340 W341	H340-N344 PolarHBondContact CD2-ND2 3.35Å; H340-N344 PolarHBondContact CE1-ND2 3.41Å; H340-N344 PolarHBondContact ND1-ND2 3.4Å; H340-N344 PolarHBondContact NE2-ND2 2.95Å; H340-N344 VanDerWaalsContact NE2-ND2 3.17Å; H340-N344 WeakPolarHBondContact O-CB 3Å; H340-N344 PolarHBondContact O-N 2.89Å; H340-N344 PolarHBondContact O-ND2 3.26Å; W341-N344 PolarHBondContact O-N 3.36Å
345	A	84.8	Confident	83.5	Confident	10 Å²	10	67.4 Å²	67.4	8%	0.083	34%	0.342	C	S	.	.			trans	-62.4	140.8	-179.5	0	0	0	0	0	110.7	W341 K350	W341-A345 HydrophobicContact CD2-CB 3.97Å; W341-A345 HydrophobicContact CE3-CB 4.4Å; W341-A345 HydrophobicContact CG-CB 4.41Å; W341-A345 HydrophobicContact CH2-CB 4.18Å; W341-A345 HydrophobicContact CZ2-CB 3.8Å; W341-A345 WeakPolarHBondContact O-CA 3.15Å; W341-A345 WeakPolarHBondContact O-CB 3.32Å; W341-A345 PolarHBondContact O-N 3.44Å; A345-K350 HydrophobicContact CB-CG 4.22Å; A345-K350 WeakPolarHBondContact O-CE 3.41Å
346	T	84.8	Confident	83.7	Confident	74 Å²	74	68 Å²	68	45%	0.454	35%	0.346	S	S	.	.			trans	-70	152	176.6	60.8	0	0	0	0	110.8	R348 E349 K350	T346-R348 PolarHBondContact O-N 3.43Å; T346-R348 VanDerWaalsContact O-N 3.08Å; T346-E349 PolarHBondContact N-OE2 3.36Å; T346-E349 PolarHBondContact O-N 3.17Å; T346-E349 WeakPolarHBondContact OG1-CG 3.31Å; T346-E349 PolarHBondContact OG1-N 2.93Å; T346-E349 PolarHBondContact OG1-OE2 2.9Å; T346-K350 PolarHBondContact O-N 3.4Å
347	D	82.6	Confident	83.8	Confident	120 Å²	120	63.2 Å²	63.2	64%	0.642	32%	0.321	S	S	*	.	H	α-helix	trans	-56.7	-29.1	177.3	-61.3	-49.4	0	0	0	112.4	N351	D347-N351 WeakPolarHBondContact O-CB 3.29Å; D347-N351 PolarHBondContact O-N 2.89Å; D347-N351 PolarHBondContact O-ND2 3.18Å
348	R	82.2	Confident	83.7	Confident	209 Å²	209	61.9 Å²	61.9	79%	0.789	31%	0.309	S	S	*	.	H	α-helix	trans	-64.8	-47.8	175.7	-64.9	-175.1	-177.7	-171.8	0.6	111.7	T346 K350 N351 L352	T346-R348 PolarHBondContact O-N 3.43Å; T346-R348 VanDerWaalsContact O-N 3.08Å; R348-K350 VanDerWaalsContact C-N 3.35Å; R348-N351 PolarHBondContact O-N 2.95Å; R348-L352 WeakPolarHBondContact O-CG 3.45Å; R348-L352 PolarHBondContact O-N 3.28Å
349	E	85.3	Confident	83.7	Confident	84 Å²	84	65.3 Å²	65.3	39%	0.393	33%	0.33	S	S	.	.	H	α-helix	trans	-64.6	-42.1	178	-68.5	164.8	143.7	0	0	110.9	W341 T346 N351 L352 I353	W341-E349 HydrophobicContact CZ2-CB 4.16Å; T346-E349 PolarHBondContact N-OE2 3.36Å; T346-E349 PolarHBondContact O-N 3.17Å; T346-E349 WeakPolarHBondContact OG1-CG 3.31Å; T346-E349 PolarHBondContact OG1-N 2.93Å; T346-E349 PolarHBondContact OG1-OE2 2.9Å; E349-N351 PolarHBondContact O-N 3.48Å; E349-L352 PolarHBondContact O-N 3.08Å; E349-I353 WeakPolarHBondContact O-CG1 3.44Å; E349-I353 PolarHBondContact O-N 2.9Å
350	K	85	Confident	83.6	Confident	22 Å²	22	64.7 Å²	64.7	10%	0.096	33%	0.333	C	S	.	.	H	α-helix	trans	-57.3	-48.5	174.6	-68.4	-178.5	-179.5	-178.1	0	111.2	E199 L203 L342 A345 T346 R348 L352 I353 I354	E199-K350 IonicContact OE2-NZ 2.73Å; E199-K350 PolarHBondContact OE2-NZ 2.98Å; L203-K350 HydrophobicContact CD2-CB 4.26Å; L342-K350 WeakPolarHBondContact O-CE 3.14Å; L342-K350 PolarHBondContact O-NZ 2.88Å; A345-K350 HydrophobicContact CB-CG 4.22Å; A345-K350 WeakPolarHBondContact O-CE 3.41Å; T346-K350 PolarHBondContact O-N 3.4Å; R348-K350 VanDerWaalsContact C-N 3.35Å; K350-L352 VanDerWaalsContact C-N 3.32Å; K350-L352 PolarHBondContact O-N 3.14Å; K350-I353 PolarHBondContact O-N 2.93Å; K350-I354 VanDerWaalsContact O-CG1 3.27Å; K350-I354 WeakPolarHBondContact O-CG1 3.38Å; K350-I354 PolarHBondContact O-N 3.3Å
351	N	83.2	Confident	83.5	Confident	94 Å²	94	60 Å²	60	50%	0.503	31%	0.311	S	S	.	.	H	α-helix	trans	-62.9	-34.9	178.3	-74	-35.8	0	0	0	113.6	D347 R348 E349 S355	D347-N351 WeakPolarHBondContact O-CB 3.29Å; D347-N351 PolarHBondContact O-N 2.89Å; D347-N351 PolarHBondContact O-ND2 3.18Å; R348-N351 PolarHBondContact O-N 2.95Å; E349-N351 PolarHBondContact O-N 3.48Å; N351-S355 WeakPolarHBondContact O-CB 3.41Å; N351-S355 PolarHBondContact O-N 3.4Å; N351-S355 PolarHBondContact O-OG 3.14Å
352	L	85.8	Confident	83	Confident	122 Å²	122	60.4 Å²	60.4	64%	0.639	32%	0.321	S	S	*	.	H	α-helix	trans	-66.4	-44.1	173.8	-70.9	171.4	0	0	0	111.5	R348 E349 K350 S355 L356	R348-L352 WeakPolarHBondContact O-CG 3.45Å; R348-L352 PolarHBondContact O-N 3.28Å; E349-L352 PolarHBondContact O-N 3.08Å; K350-L352 VanDerWaalsContact C-N 3.32Å; K350-L352 PolarHBondContact O-N 3.14Å; L352-S355 PolarHBondContact O-N 3.4Å; L352-L356 WeakPolarHBondContact O-CB 3.23Å; L352-L356 PolarHBondContact O-N 3.13Å
353	I	86.7	Confident	82.6	Confident	11 Å²	11	66.3 Å²	66.3	6%	0.056	35%	0.349	C	S	.	.	H	α-helix	trans	-62.8	-45.6	175.1	-64.9	-147.4	0	0	0	110.4	I326 I329 W341 E349 K350 S355 L356 V357	I326-I353 HydrophobicContact CG1-CG2 3.99Å; I329-I353 HydrophobicContact CD1-CD1 4.31Å; I329-I353 HydrophobicContact CD1-CG2 4.21Å; I329-I353 HydrophobicContact CG2-CD1 4.06Å; W341-I353 HydrophobicContact CH2-CB 4.45Å; W341-I353 HydrophobicContact CH2-CD1 3.15Å; W341-I353 HydrophobicContact CH2-CG1 3.78Å; W341-I353 HydrophobicContact CZ2-CD1 3.53Å; W341-I353 HydrophobicContact CZ2-CG1 4.13Å; W341-I353 HydrophobicContact CZ3-CD1 3.86Å; E349-I353 WeakPolarHBondContact O-CG1 3.44Å; E349-I353 PolarHBondContact O-N 2.9Å; K350-I353 PolarHBondContact O-N 2.93Å; I353-S355 VanDerWaalsContact C-N 3.3Å; I353-S355 PolarHBondContact O-N 3.39Å; I353-L356 PolarHBondContact O-N 2.81Å; I353-V357 HydrophobicContact CG2-CG2 3.68Å; I353-V357 VanDerWaalsContact O-CB 3.25Å; I353-V357 WeakPolarHBondContact O-CB 3.47Å; I353-V357 WeakPolarHBondContact O-CG2 3.08Å; I353-V357 PolarHBondContact O-N 3.39Å
354	I	83.4	Confident	82	Confident	13 Å²	13	65.7 Å²	65.7	7%	0.067	35%	0.346	C	S	.	.	H	α-helix	trans	-54.4	-50.8	175.7	-66.9	167.5	0	0	0	109.7	L203 I207 Q210 K350 L356 V357 S358	L203-I354 HydrophobicContact CD2-CD1 3.68Å; L203-I354 HydrophobicContact CD2-CG1 3.56Å; I207-I354 HydrophobicContact CG1-CB 4.41Å; I207-I354 HydrophobicContact CG1-CG1 4.48Å; I207-I354 HydrophobicContact CG1-CG2 3.94Å; Q210-I354 VanDerWaalsContact NE2-CG2 3.29Å; K350-I354 VanDerWaalsContact O-CG1 3.27Å; K350-I354 WeakPolarHBondContact O-CG1 3.38Å; K350-I354 PolarHBondContact O-N 3.3Å; I354-L356 PolarHBondContact O-N 3.13Å; I354-V357 PolarHBondContact O-N 3.2Å; I354-S358 WeakPolarHBondContact O-CB 3.37Å; I354-S358 PolarHBondContact O-N 3.21Å; I354-S358 PolarHBondContact O-OG 3.01Å
355	S	81	Confident	81.1	Confident	63 Å²	63	63.3 Å²	63.3	44%	0.441	33%	0.333	S	S	.	.	H	α-helix	trans	-60.7	-47	-178.9	-56.2	0	0	0	0	111.7	N351 L352 I353 S358 T359	N351-S355 WeakPolarHBondContact O-CB 3.41Å; N351-S355 PolarHBondContact O-N 3.4Å; N351-S355 PolarHBondContact O-OG 3.14Å; L352-S355 PolarHBondContact O-N 3.4Å; I353-S355 VanDerWaalsContact C-N 3.3Å; I353-S355 PolarHBondContact O-N 3.39Å; S355-S358 PolarHBondContact O-N 2.92Å; S355-T359 WeakPolarHBondContact O-CB 3.18Å; S355-T359 PolarHBondContact O-N 2.95Å; S355-T359 PolarHBondContact O-OG1 3.32Å
356	L	87.5	Confident	79.8	Confident	92 Å²	92	67.7 Å²	67.7	48%	0.482	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-45.2	179.8	-179.5	61.3	0	0	0	112.1	I329 L352 I353 I354 T359 A360	I329-L356 HydrophobicContact CD1-CD2 3.73Å; I329-L356 HydrophobicContact CD1-CG 4.45Å; I329-L356 HydrophobicContact CG1-CD2 3.92Å; L352-L356 WeakPolarHBondContact O-CB 3.23Å; L352-L356 PolarHBondContact O-N 3.13Å; I353-L356 PolarHBondContact O-N 2.81Å; I354-L356 PolarHBondContact O-N 3.13Å; L356-T359 PolarHBondContact O-N 2.92Å; L356-A360 VanDerWaalsContact O-CB 3.32Å; L356-A360 WeakPolarHBondContact O-CB 3.4Å; L356-A360 PolarHBondContact O-N 2.91Å
357	V	86.1	Confident	78.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-68.3	-41.3	179.9	176.6	0	0	0	0	110.5	I207 I322 M325 I329 I353 I354 A360 L361	I207-V357 HydrophobicContact CD1-CB 3.89Å; I207-V357 HydrophobicContact CD1-CG1 3.62Å; I207-V357 HydrophobicContact CG1-CG1 4.46Å; I207-V357 HydrophobicContact CG2-CG1 4.34Å; I322-V357 HydrophobicContact CG1-CG1 3.96Å; M325-V357 HydrophobicContact CB-CG2 4.44Å; M325-V357 HydrophobicContact CE-CG1 4.35Å; M325-V357 HydrophobicContact CG-CG2 4.09Å; M325-V357 HydrophobicContact SD-CB 3.84Å; M325-V357 HydrophobicContact SD-CG1 3.73Å; M325-V357 HydrophobicContact SD-CG2 3.57Å; M325-V357 VanDerWaalsContact SD-CG2 3.57Å; I329-V357 HydrophobicContact CD1-CG2 4.13Å; I353-V357 HydrophobicContact CG2-CG2 3.68Å; I353-V357 VanDerWaalsContact O-CB 3.25Å; I353-V357 WeakPolarHBondContact O-CB 3.47Å; I353-V357 WeakPolarHBondContact O-CG2 3.08Å; I353-V357 PolarHBondContact O-N 3.39Å; I354-V357 PolarHBondContact O-N 3.2Å; V357-A360 PolarHBondContact O-N 2.93Å; V357-L361 HydrophobicContact CG1-CD1 3.85Å; V357-L361 HydrophobicContact CG1-CG 4.21Å; V357-L361 WeakPolarHBondContact O-CB 3.36Å; V357-L361 VanDerWaalsContact O-CG 3.28Å; V357-L361 WeakPolarHBondContact O-CG 3.48Å; V357-L361 PolarHBondContact O-N 3.44Å
358	S	82	Confident	77.4	Confident	11 Å²	11	69.8 Å²	69.8	8%	0.077	35%	0.348	C	S	.	.	H	α-helix	trans	-60.7	-46.1	173.9	-70.6	0	0	0	0	111.6	Q210 I354 S355 L361 S362	Q210-S358 VanDerWaalsContact OE1-CB 3.32Å; Q210-S358 PolarHBondContact OE1-OG 3.2Å; I354-S358 WeakPolarHBondContact O-CB 3.37Å; I354-S358 PolarHBondContact O-N 3.21Å; I354-S358 PolarHBondContact O-OG 3.01Å; S355-S358 PolarHBondContact O-N 2.92Å; S358-L361 PolarHBondContact O-N 3.28Å; S358-S362 WeakPolarHBondContact O-CB 3.38Å; S358-S362 PolarHBondContact O-N 3.12Å
359	T	81.4	Confident	76	Confident	71 Å²	71	63.2 Å²	63.2	44%	0.436	33%	0.328	S	S	.	.	H	α-helix	trans	-61.5	-44.4	174.4	-60.1	0	0	0	0	111.4	S355 L356 L361 S362 H363	S355-T359 WeakPolarHBondContact O-CB 3.18Å; S355-T359 PolarHBondContact O-N 2.95Å; S355-T359 PolarHBondContact O-OG1 3.32Å; L356-T359 PolarHBondContact O-N 2.92Å; T359-L361 PolarHBondContact O-N 2.94Å; T359-S362 PolarHBondContact O-N 3.31Å; T359-H363 WeakPolarHBondContact CG2-CE1 3.19Å; T359-H363 VanDerWaalsContact O-CG 3.26Å; T359-H363 PolarHBondContact O-N 2.86Å; T359-H363 PolarHBondContact O-ND1 3.08Å
360	A	80.4	Confident	74.4	Confident	36 Å²	36	63.7 Å²	63.7	30%	0.298	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-42	178.6	0	0	0	0	0	112.6	M325 L356 V357 Q364	M325-A360 HydrophobicContact CE-CB 3.88Å; M325-A360 HydrophobicContact SD-CB 3.77Å; L356-A360 VanDerWaalsContact O-CB 3.32Å; L356-A360 WeakPolarHBondContact O-CB 3.4Å; L356-A360 PolarHBondContact O-N 2.91Å; V357-A360 PolarHBondContact O-N 2.93Å; A360-Q364 WeakPolarHBondContact O-CB 3.46Å; A360-Q364 PolarHBondContact O-N 3.17Å; A360-Q364 VanDerWaalsContact O-N 3.08Å
361	L	79.2	Confident	72.6	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-71.7	-36.9	177	-70.4	176.3	0	0	0	112.2	I207 L211 Y318 K321 M325 V357 S358 T359 Q364 N365	I207-L361 HydrophobicContact CG2-CD1 3.57Å; L211-L361 HydrophobicContact CD1-CB 3.7Å; L211-L361 HydrophobicContact CD1-CD1 3.78Å; L211-L361 HydrophobicContact CD1-CG 4.4Å; L211-L361 HydrophobicContact CD2-CB 4.19Å; Y318-L361 HydrophobicContact CD1-CD1 4.46Å; K321-L361 HydrophobicContact CD-CD2 3.77Å; K321-L361 HydrophobicContact CG-CD2 4.45Å; M325-L361 HydrophobicContact CE-CD2 4.38Å; M325-L361 HydrophobicContact CE-CG 4.48Å; V357-L361 HydrophobicContact CG1-CD1 3.85Å; V357-L361 HydrophobicContact CG1-CG 4.21Å; V357-L361 WeakPolarHBondContact O-CB 3.36Å; V357-L361 VanDerWaalsContact O-CG 3.28Å; V357-L361 WeakPolarHBondContact O-CG 3.48Å; V357-L361 PolarHBondContact O-N 3.44Å; S358-L361 PolarHBondContact O-N 3.28Å; T359-L361 PolarHBondContact O-N 2.94Å; L361-Q364 PolarHBondContact O-N 2.73Å; L361-N365 PolarHBondContact O-N 2.68Å
362	S	76.3	Confident	70.7	Confident	53 Å²	53	70.7 Å²	70.7	37%	0.371	37%	0.365	S	S	.	.	H	α-helix	trans	-62.1	-47.5	174.9	180	0	0	0	0	111.3	S358 T359 Q364 N365 M366	S358-S362 WeakPolarHBondContact O-CB 3.38Å; S358-S362 PolarHBondContact O-N 3.12Å; T359-S362 PolarHBondContact O-N 3.31Å; S362-Q364 VanDerWaalsContact C-N 3.27Å; S362-Q364 PolarHBondContact O-N 2.93Å; S362-N365 PolarHBondContact O-N 3.03Å; S362-N365 VanDerWaalsContact O-N 3.17Å; S362-M366 WeakPolarHBondContact O-CG 3.41Å; S362-M366 PolarHBondContact O-N 3.28Å
363	H	73.7	Confident	68.9	Low	125 Å²	125	70.3 Å²	70.3	58%	0.579	37%	0.368	S	S	*	.	H	α-helix	trans	-61.1	-37.8	174.3	-66.3	158.3	0	0	0	112.4	T359 M366 Y367	T359-H363 WeakPolarHBondContact CG2-CE1 3.19Å; T359-H363 VanDerWaalsContact O-CG 3.26Å; T359-H363 PolarHBondContact O-N 2.86Å; T359-H363 PolarHBondContact O-ND1 3.08Å; H363-M366 PolarHBondContact O-N 2.71Å; H363-Y367 PolarHBondContact O-N 3.11Å; H363-Y367 VanDerWaalsContact O-N 3.11Å
364	Q	67.7	Low	66.5	Low	71 Å²	71	72.5 Å²	72.5	33%	0.332	39%	0.393	S	S	.	.	H	α-helix	trans	-65.5	-41	175.8	-176.4	169.6	9.9	0	0	111.9	A360 L361 S362 Y367 F368	A360-Q364 WeakPolarHBondContact O-CB 3.46Å; A360-Q364 PolarHBondContact O-N 3.17Å; A360-Q364 VanDerWaalsContact O-N 3.08Å; L361-Q364 PolarHBondContact O-N 2.73Å; S362-Q364 VanDerWaalsContact C-N 3.27Å; S362-Q364 PolarHBondContact O-N 2.93Å; Q364-Y367 PolarHBondContact O-N 2.91Å; Q364-F368 HydrophobicContact CG-CD2 4.11Å; Q364-F368 HydrophobicContact CG-CE2 3.59Å; Q364-F368 WeakPolarHBondContact O-CD2 3.49Å; Q364-F368 PolarHBondContact O-N 3.11Å
365	N	64.2	Low	64.1	Low	48 Å²	48	78.8 Å²	78.8	26%	0.257	43%	0.427	S	S	.	.	H	α-helix	trans	-64.8	-43.7	175.2	-75.6	-5.3	0	0	0	111.4	L361 S362 Y367 F368 D369	L361-N365 PolarHBondContact O-N 2.68Å; S362-N365 PolarHBondContact O-N 3.03Å; S362-N365 VanDerWaalsContact O-N 3.17Å; N365-Y367 VanDerWaalsContact C-N 3.28Å; N365-Y367 PolarHBondContact O-N 3.21Å; N365-F368 CarbonylContact O-C 3.44Å; N365-F368 WeakPolarHBondContact O-CA 3.01Å; N365-F368 PolarHBondContact O-N 3.46Å; N365-D369 PolarHBondContact O-N 3.17Å
366	M	56.8	Low	61.8	Low	102 Å²	102	81.4 Å²	81.4	50%	0.502	44%	0.436	S	S	.	.	H	α-helix	trans	-55.7	-41.2	175.3	-71.8	-70.9	96.4	0	0	112.6	S362 H363 F368 D369 T370	S362-M366 WeakPolarHBondContact O-CG 3.41Å; S362-M366 PolarHBondContact O-N 3.28Å; H363-M366 PolarHBondContact O-N 2.71Å; M366-F368 VanDerWaalsContact C-N 3.25Å; M366-F368 PolarHBondContact O-N 3.19Å; M366-D369 HydrophobicContact CE-CB 4.4Å; M366-D369 WeakPolarHBondContact CE-OD2 3.4Å; M366-D369 PolarHBondContact O-N 3.24Å; M366-T370 WeakPolarHBondContact O-CG2 3.17Å; M366-T370 PolarHBondContact O-N 2.94Å; M366-T370 PolarHBondContact O-OG1 2.84Å
367	Y	59.6	Low	59.1	Low	135 Å²	135	88 Å²	88	53%	0.529	46%	0.456	S	S	.	.	H	α-helix	trans	-62.3	-31.4	175.6	-177.1	-99.3	0	0	0	113.2	H363 Q364 N365 T370 K371	H363-Y367 PolarHBondContact O-N 3.11Å; H363-Y367 VanDerWaalsContact O-N 3.11Å; Q364-Y367 PolarHBondContact O-N 2.91Å; N365-Y367 VanDerWaalsContact C-N 3.28Å; N365-Y367 PolarHBondContact O-N 3.21Å; Y367-T370 PolarHBondContact O-OG1 2.91Å; Y367-T370 VanDerWaalsContact O-OG1 3.12Å; Y367-K371 VanDerWaalsContact CZ-CE 3.47Å; Y367-K371 WeakPolarHBondContact OH-CE 3.27Å; Y367-K371 PolarHBondContact OH-NZ 2.89Å
368	F	57.2	Low	56.8	Low	103 Å²	103	97.3 Å²	97.3	45%	0.452	49%	0.492	S	S	.	.	H	α-helix	trans	-82.8	-35.2	176.1	-67.9	-64.4	0	0	0	112.5	Q364 N365 M366 K371 Q372	Q364-F368 HydrophobicContact CG-CD2 4.11Å; Q364-F368 HydrophobicContact CG-CE2 3.59Å; Q364-F368 WeakPolarHBondContact O-CD2 3.49Å; Q364-F368 PolarHBondContact O-N 3.11Å; N365-F368 CarbonylContact O-C 3.44Å; N365-F368 WeakPolarHBondContact O-CA 3.01Å; N365-F368 PolarHBondContact O-N 3.46Å; M366-F368 VanDerWaalsContact C-N 3.25Å; M366-F368 PolarHBondContact O-N 3.19Å; F368-K371 PolarHBondContact O-N 3.29Å; F368-Q372 PolarHBondContact O-N 3.43Å
369	D	52.7	Low	54.3	Low	71 Å²	71	105.8 Å²	105.8	38%	0.38	53%	0.528	S	S	.	.	H	α-helix	trans	-68.7	-36.9	178.2	-67.7	-25.9	0	0	0	112	N365 M366 K371 Q372 T373	N365-D369 PolarHBondContact O-N 3.17Å; M366-D369 HydrophobicContact CE-CB 4.4Å; M366-D369 WeakPolarHBondContact CE-OD2 3.4Å; M366-D369 PolarHBondContact O-N 3.24Å; D369-K371 PolarHBondContact O-N 3.4Å; D369-Q372 PolarHBondContact O-N 2.78Å; D369-Q372 VanDerWaalsContact O-N 3.13Å; D369-T373 PolarHBondContact O-N 3.02Å; D369-T373 PolarHBondContact O-OG1 3.13Å
370	T	52.3	Low	51.9	Low	94 Å²	94	106.4 Å²	106.4	58%	0.577	54%	0.54	S	S	*	.	H	α-helix	trans	-63	-23.5	174.3	53.7	0	0	0	0	113.1	M366 Y367 T373	M366-T370 WeakPolarHBondContact O-CG2 3.17Å; M366-T370 PolarHBondContact O-N 2.94Å; M366-T370 PolarHBondContact O-OG1 2.84Å; Y367-T370 PolarHBondContact O-OG1 2.91Å; Y367-T370 VanDerWaalsContact O-OG1 3.12Å; T370-T373 PolarHBondContact O-OG1 2.79Å
371	K	46.9	Very low	49.4	Very low	125 Å²	125	109.9 Å²	109.9	54%	0.543	55%	0.554	S	S	.	*	H	α-helix	trans	-85.6	-27.4	175.8	-67.3	-172.2	-175.9	-174.5	0	112.8	Y367 F368 D369	Y367-K371 VanDerWaalsContact CZ-CE 3.47Å; Y367-K371 WeakPolarHBondContact OH-CE 3.27Å; Y367-K371 PolarHBondContact OH-NZ 2.89Å; F368-K371 PolarHBondContact O-N 3.29Å; D369-K371 PolarHBondContact O-N 3.4Å
372	Q	44.5	Very low	47.5	Very low	137 Å²	137	115.4 Å²	115.4	64%	0.64	59%	0.588	S	S	*	*	H	α-helix	trans	-84.9	-25.6	178.8	-68.3	-160	89.4	0	0	113.2	F368 D369 G374	F368-Q372 PolarHBondContact O-N 3.43Å; D369-Q372 PolarHBondContact O-N 2.78Å; D369-Q372 VanDerWaalsContact O-N 3.13Å; Q372-G374 PolarHBondContact O-N 2.71Å
373	T	46.8	Very low	45.1	Very low	115 Å²	115	119.7 Å²	119.7	71%	0.706	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-13.4	177.7	38.9	0	0	0	0	113.9	D369 T370 D375	D369-T373 PolarHBondContact O-N 3.02Å; D369-T373 PolarHBondContact O-OG1 3.13Å; T370-T373 PolarHBondContact O-OG1 2.79Å; T373-D375 PolarHBondContact O-N 2.9Å
374	G	36.9	Very low	43.3	Very low	56 Å²	56	118.8 Å²	118.8	58%	0.577	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-27.1	177.8	0	0	0	0	0	115.7	Q372	Q372-G374 PolarHBondContact O-N 2.71Å
375	D	33.1	Very low	41.3	Very low	146 Å²	146	122.3 Å²	122.3	78%	0.781	63%	0.631	S	S	*	*	S	Bend	trans	-134.7	12.6	-163	-81.7	-29.7	0	0	0	116.8	T373	T373-D375 PolarHBondContact O-N 2.9Å
376	N	32.7	Very low	39.3	Very low	117 Å²	117	131.2 Å²	131.2	63%	0.626	66%	0.661	S	S	*	*			trans	-136.1	87.7	178.6	-86	-43.8	0	0	0	114	Y378	N376-Y378 HydrophobicContact CB-CD2 4.24Å; N376-Y378 PolarHBondContact O-N 3.19Å; N376-Y378 WeakPolarHBondContact OD1-CE2 3.4Å
377	Y	30.3	Very low	37.9	Very low	232 Å²	232	131.4 Å²	131.4	91%	0.91	67%	0.673	S	S	*	*			trans	-65.7	69.5	157.3	-79.5	-94.9	0	0	0	110.7
378	Y	37.6	Very low	36.4	Very low	195 Å²	195	136.1 Å²	136.1	77%	0.765	69%	0.689	S	S	*	*			trans	-122.4	93.5	158.5	-60	-67.1	0	0	0	108.3	N376 A380	N376-Y378 HydrophobicContact CB-CD2 4.24Å; N376-Y378 PolarHBondContact O-N 3.19Å; N376-Y378 WeakPolarHBondContact OD1-CE2 3.4Å; Y378-A380 VanDerWaalsContact C-N 3.3Å; Y378-A380 PolarHBondContact O-N 3.16Å
379	K	29.6	Very low	34.8	Very low	188 Å²	188	141.5 Å²	141.5	82%	0.817	71%	0.707	S	S	*	*			trans	-48.4	86.7	167.3	-172.2	172.9	-173.9	171.2	0	110.6	N381	K379-N381 PolarHBondContact O-N 3.02Å
380	A	31.1	Very low	33.8	Very low	84 Å²	84	145.7 Å²	145.7	69%	0.694	72%	0.724	S	S	*	*			trans	-84	95.4	163.2	0	0	0	0	0	107	Y378 T382	Y378-A380 VanDerWaalsContact C-N 3.3Å; Y378-A380 PolarHBondContact O-N 3.16Å; A380-T382 VanDerWaalsContact C-N 3.33Å; A380-T382 PolarHBondContact O-N 2.89Å
381	N	28.4	Very low	32.6	Very low	109 Å²	109	149.4 Å²	149.4	58%	0.583	73%	0.732	S	S	*	*			trans	-57.4	97.3	169.6	-68.2	-23.5	0	0	0	108.5	K379	K379-N381 PolarHBondContact O-N 3.02Å
382	T	38.5	Very low	31.9	Very low	117 Å²	117	150.2 Å²	150.2	72%	0.718	74%	0.742	S	S	*	*			trans	-112.4	85.3	156.8	47.2	0	0	0	0	105.6	A380 T384	A380-T382 VanDerWaalsContact C-N 3.33Å; A380-T382 PolarHBondContact O-N 2.89Å; T382-T384 PolarHBondContact O-N 3.48Å
383	D	26	Very low	31.1	Very low	143 Å²	143	148.7 Å²	148.7	77%	0.765	75%	0.746	S	S	*	*			trans	-69.2	67.6	175.4	-64.1	-48	0	0	0	109.8	N385	D383-N385 PolarHBondContact O-N 3.04Å
384	T	36.7	Very low	30.1	Very low	107 Å²	107	150.5 Å²	150.5	66%	0.656	75%	0.752	S	S	*	*			trans	-96.6	80.9	164	40.3	0	0	0	0	108.4	T382 W386	T382-T384 PolarHBondContact O-N 3.48Å; T384-W386 PolarHBondContact O-N 3.24Å
385	N	24.9	Very low	30	Very low	145 Å²	145	154.7 Å²	154.7	78%	0.775	76%	0.761	S	S	*	*			trans	-22.8	84.6	158.6	-171.2	7.2	0	0	0	114.4	D383	D383-N385 PolarHBondContact O-N 3.04Å
386	W	22.9	Very low	29.7	Very low	235 Å²	235	155.2 Å²	155.2	89%	0.89	76%	0.763	S	S	*	*			trans	-131.5	73.3	159.8	-65.3	101	0	0	0	107.4	T384	T384-W386 PolarHBondContact O-N 3.24Å
387	S	27.6	Very low	29.6	Very low	106 Å²	106	155.2 Å²	155.2	74%	0.741	77%	0.77	S	S	*	*			trans	-130	101.6	165.8	-71.6	0	0	0	0	108.4	R389	S387-R389 PolarHBondContact O-N 3.35Å
388	R	26.9	Very low	29.6	Very low	234 Å²	234	149.4 Å²	149.4	88%	0.883	76%	0.763	S	S	*	*			trans	-49.3	115.3	171.6	-175.7	175.1	-67.8	164.5	0.2	108.3	E390	R388-E390 PolarHBondContact O-N 3.17Å
389	R	24.6	Very low	29	Very low	215 Å²	215	147.7 Å²	147.7	81%	0.811	77%	0.766	S	S	*	*			trans	-61.3	87.8	-176.4	-170.3	-175.6	-155.6	-168.2	7.3	111.5	S387 K391	S387-R389 PolarHBondContact O-N 3.35Å; R389-K391 PolarHBondContact O-N 2.77Å
390	E	30.9	Very low	29	Very low	160 Å²	160	145.9 Å²	145.9	75%	0.748	77%	0.766	S	S	*	*			trans	-81.9	108.1	163.1	-76.1	-173.1	171.4	0	0	108.9	R388 L392	R388-E390 PolarHBondContact O-N 3.17Å; E390-L392 PolarHBondContact O-N 3.46Å; E390-L392 VanDerWaalsContact O-N 3.17Å
391	K	28.1	Very low	28.7	Very low	172 Å²	172	150.4 Å²	150.4	75%	0.748	77%	0.773	S	S	*	*			trans	-75.8	91.4	170.1	-75.5	173.7	170.9	178.8	0	107.8	R389	R389-K391 PolarHBondContact O-N 2.77Å
392	L	32.1	Very low	28.7	Very low	141 Å²	141	151.4 Å²	151.4	74%	0.738	78%	0.783	S	S	*	*			trans	-113.9	122.3	162	-71.4	172.5	0	0	0	109.1	E390 N394	E390-L392 PolarHBondContact O-N 3.46Å; E390-L392 VanDerWaalsContact O-N 3.17Å; L392-N394 PolarHBondContact O-N 3Å
393	S	26.4	Very low	28.1	Very low	106 Å²	106	151.6 Å²	151.6	74%	0.741	78%	0.784	S	S	*	*			trans	-63.7	113.8	-179.2	171.1	0	0	0	0	110	N395	S393-N395 PolarHBondContact O-N 2.79Å
394	N	26.9	Very low	28.6	Very low	153 Å²	153	153 Å²	153	82%	0.818	79%	0.785	S	S	*	*			trans	-82.1	107.8	173.6	-65.3	-30.3	0	0	0	109.3	L392	L392-N394 PolarHBondContact O-N 3Å
395	N	34.2	Very low	28.2	Very low	143 Å²	143	155.5 Å²	155.5	77%	0.765	80%	0.795	S	S	*	*			trans	-99.5	102.2	161.5	-72.2	-11.3	0	0	0	107.8	S393	S393-N395 PolarHBondContact O-N 2.79Å
396	D	27.6	Very low	28.6	Very low	157 Å²	157	156.1 Å²	156.1	84%	0.84	79%	0.793	S	S	*	*			trans	41.8	153.5	142	-72.3	-28.4	0	0	0	124
397	P	30.9	Very low	29	Very low	117 Å²	117	153.7 Å²	153.7	76%	0.76	79%	0.792	S	S	*	*			trans	-107.8	150.5	-153.4	38.4	-27.3	0	0	0	113.3
398	S	29	Very low	29.1	Very low	111 Å²	111	156.2 Å²	156.2	78%	0.776	80%	0.795	S	S	*	*			trans	-150.3	112.8	149.6	53.7	0	0	0	0	111.4	N400	S398-N400 PolarHBondContact O-N 3.45Å
399	L	24.6	Very low	29.6	Very low	158 Å²	158	152.7 Å²	152.7	83%	0.827	79%	0.789	S	S	*	*			trans	-44.9	126.1	156.6	-84.6	135.3	0	0	0	110.2
400	N	30.1	Very low	29.8	Very low	150 Å²	150	149.8 Å²	149.8	80%	0.802	79%	0.789	S	S	*	*			trans	-146.6	98.5	151.3	-79.5	-29.3	0	0	0	107	S398	S398-N400 PolarHBondContact O-N 3.45Å
401	E	24.9	Very low	29.7	Very low	180 Å²	180	148.3 Å²	148.3	84%	0.841	80%	0.795	S	S	*	*			trans	-78.7	109.2	173.8	-142.3	174.9	-169.3	0	0	107.1
402	T	28.3	Very low	29.7	Very low	130 Å²	130	145.7 Å²	145.7	80%	0.798	80%	0.797	S	S	*	*			trans	-133.1	113.5	164.7	46.1	0	0	0	0	109.1	E404	T402-E404 PolarHBondContact O-N 2.88Å
403	V	27.4	Very low	29.9	Very low	121 Å²	121	145 Å²	145	73%	0.733	80%	0.799	S	S	*	*			trans	-61.6	109.4	175.3	175	0	0	0	0	109.9
404	E	34.7	Very low	30.6	Very low	171 Å²	171	145.9 Å²	145.9	80%	0.799	80%	0.8	S	S	*	*			trans	-143.1	94.7	155.5	-67.8	-167.6	167.1	0	0	107.6	T402 E406	T402-E404 PolarHBondContact O-N 2.88Å; E404-E406 VanDerWaalsContact C-N 3.25Å; E404-E406 PolarHBondContact O-N 3.17Å
405	D	28.3	Very low	31.1	Very low	161 Å²	161	144.5 Å²	144.5	86%	0.861	80%	0.797	S	S	*	*			trans	-72.6	76.3	173.7	-68.9	-46.3	0	0	0	109.5
406	E	35.1	Very low	31.2	Very low	157 Å²	157	144.3 Å²	144.3	73%	0.734	80%	0.796	S	S	*	*			trans	-87	127.1	169.2	-80.1	-84.3	148.7	0	0	109.8	E404 I408	E404-E406 VanDerWaalsContact C-N 3.25Å; E404-E406 PolarHBondContact O-N 3.17Å; E406-I408 WeakPolarHBondContact O-CG1 3.36Å; E406-I408 PolarHBondContact O-N 2.98Å
407	E	29.3	Very low	31.5	Very low	184 Å²	184	147.4 Å²	147.4	86%	0.86	80%	0.796	S	S	*	*			trans	-43	93.7	173.1	-93.1	172.6	144	0	0	112.9	Q409	E407-Q409 PolarHBondContact O-N 2.81Å
408	I	31.5	Very low	31.7	Very low	160 Å²	160	149.6 Å²	149.6	82%	0.821	80%	0.8	S	S	*	*			trans	-81.2	83.7	169.1	-51.8	-174.9	0	0	0	108.7	E406 N410	E406-I408 WeakPolarHBondContact O-CG1 3.36Å; E406-I408 PolarHBondContact O-N 2.98Å; I408-N410 PolarHBondContact O-N 3.48Å
409	Q	35.7	Very low	32.2	Very low	159 Å²	159	150.7 Å²	150.7	74%	0.743	80%	0.802	S	S	*	*			trans	-28.5	123.2	158.2	-168.8	85	-12.2	0	0	111.8	E407 C411	E407-Q409 PolarHBondContact O-N 2.81Å; Q409-C411 PolarHBondContact O-N 3.5Å
410	N	30.5	Very low	32.8	Very low	154 Å²	154	150.2 Å²	150.2	82%	0.824	80%	0.799	S	S	*	*			trans	-42.9	99.9	172.9	-69.9	-33.8	0	0	0	113	I408 C412	I408-N410 PolarHBondContact O-N 3.48Å; N410-C412 VanDerWaalsContact C-N 3.29Å; N410-C412 PolarHBondContact O-N 2.87Å
411	C	27.6	Very low	33.1	Very low	129 Å²	129	145.4 Å²	145.4	87%	0.872	78%	0.784	S	S	*	*			trans	-76.2	81	170	-71.7	0	0	0	0	110	Q409	Q409-C411 PolarHBondContact O-N 3.5Å
412	C	28.2	Very low	33.7	Very low	117 Å²	117	146 Å²	146	79%	0.791	79%	0.787	S	S	*	*			trans	-105	73.9	168.4	-165.6	0	0	0	0	109.7	N410	N410-C412 VanDerWaalsContact C-N 3.29Å; N410-C412 PolarHBondContact O-N 2.87Å
413	T	36.7	Very low	34.1	Very low	127 Å²	127	147.7 Å²	147.7	78%	0.779	79%	0.788	S	S	*	*			trans	-158.9	81.3	166.9	54.3	0	0	0	0	112.2
414	V	40.8	Very low	34.6	Very low	124 Å²	124	148.8 Å²	148.8	75%	0.752	79%	0.79	S	S	*	*			trans	-145.1	89.6	146.6	-171.9	0	0	0	0	107.3	D416	V414-D416 PolarHBondContact O-N 3.39Å; V414-D416 VanDerWaalsContact O-N 3.11Å
415	T	38.5	Very low	34.5	Very low	124 Å²	124	147.9 Å²	147.9	76%	0.761	79%	0.79	S	S	*	*			trans	-68	102	158.3	49.9	0	0	0	0	106.2	R417	T415-R417 VanDerWaalsContact C-N 3.28Å; T415-R417 PolarHBondContact O-N 2.66Å
416	D	36.3	Very low	35	Very low	139 Å²	139	148 Å²	148	74%	0.743	79%	0.789	S	S	*	*			trans	-59.9	97.7	166.2	-83.3	-29.4	0	0	0	107.7	V414 L418	V414-D416 PolarHBondContact O-N 3.39Å; V414-D416 VanDerWaalsContact O-N 3.11Å; D416-L418 PolarHBondContact O-N 3.4Å
417	R	33.9	Very low	34.9	Very low	223 Å²	223	147 Å²	147	84%	0.842	79%	0.789	S	S	*	*			trans	-66.7	102.7	166.1	-74.1	-171.4	169.4	173.4	-1.8	105.7	T415 V419	T415-R417 VanDerWaalsContact C-N 3.28Å; T415-R417 PolarHBondContact O-N 2.66Å; R417-V419 PolarHBondContact O-N 2.79Å
418	L	34	Very low	35	Very low	162 Å²	162	146.1 Å²	146.1	85%	0.848	79%	0.785	S	S	*	*			trans	-50.7	101.3	170.1	-69.1	169.8	0	0	0	108.6	D416 I420	D416-L418 PolarHBondContact O-N 3.4Å; L418-I420 PolarHBondContact O-N 3.47Å; L418-I420 VanDerWaalsContact O-N 3.12Å
419	V	40.9	Very low	35.2	Very low	134 Å²	134	144.1 Å²	144.1	81%	0.812	78%	0.781	S	S	*	*			trans	-70.9	105.2	168.6	177.8	0	0	0	0	105.2	R417 G421	R417-V419 PolarHBondContact O-N 2.79Å; V419-G421 VanDerWaalsContact C-N 3.32Å; V419-G421 PolarHBondContact O-N 3.46Å
420	I	36.9	Very low	35	Very low	149 Å²	149	144.5 Å²	144.5	76%	0.764	78%	0.782	S	S	*	*			trans	-64.6	101.5	168.7	-61.4	171.3	0	0	0	105.1	L418 E422	L418-I420 PolarHBondContact O-N 3.47Å; L418-I420 VanDerWaalsContact O-N 3.12Å; I420-E422 PolarHBondContact O-N 2.81Å
421	G	35.2	Very low	35.2	Very low	48 Å²	48	142 Å²	142	50%	0.495	78%	0.776	S	S	.	*			trans	-53.9	133	174.9	0	0	0	0	0	109.5	V419 M423	V419-G421 VanDerWaalsContact C-N 3.32Å; V419-G421 PolarHBondContact O-N 3.46Å; G421-M423 PolarHBondContact O-N 2.87Å
422	E	38.9	Very low	35.4	Very low	193 Å²	193	146.9 Å²	146.9	90%	0.902	78%	0.776	S	S	*	*			trans	-53.3	101.9	176	-150.5	165.3	-168.8	0	0	108.3	I420 D424	I420-E422 PolarHBondContact O-N 2.81Å; E422-D424 PolarHBondContact O-N 3.21Å
423	M	36	Very low	35.5	Very low	165 Å²	165	145.1 Å²	145.1	81%	0.813	78%	0.778	S	S	*	*			trans	-67.8	116	177.8	-112.6	90.1	83.4	0	0	107.9	G421 N425	G421-M423 PolarHBondContact O-N 2.87Å; M423-N425 PolarHBondContact O-N 3.33Å
424	D	38.3	Very low	35.4	Very low	144 Å²	144	145.5 Å²	145.5	77%	0.77	78%	0.78	S	S	*	*			trans	-51.9	128.7	171.7	-72.5	-48.1	0	0	0	110.4	E422 I426	E422-D424 PolarHBondContact O-N 3.21Å; D424-I426 VanDerWaalsContact C-N 3.27Å; D424-I426 PolarHBondContact O-N 3.41Å
425	N	33	Very low	35	Very low	152 Å²	152	148 Å²	148	81%	0.813	78%	0.784	S	S	*	*			trans	-57.5	84.1	172.2	-84.7	-46.7	0	0	0	110.5	M423 N427	M423-N425 PolarHBondContact O-N 3.33Å; N425-N427 PolarHBondContact O-N 3.39Å; N425-N427 VanDerWaalsContact O-N 3.13Å
426	I	37.6	Very low	34.7	Very low	163 Å²	163	146.1 Å²	146.1	84%	0.836	78%	0.78	S	S	*	*			trans	-78.9	95.3	162.8	46.1	165	0	0	0	108.1	D424 E428	D424-I426 VanDerWaalsContact C-N 3.27Å; D424-I426 PolarHBondContact O-N 3.41Å; I426-E428 PolarHBondContact O-N 3.24Å
427	N	34	Very low	34.5	Very low	136 Å²	136	146.7 Å²	146.7	73%	0.727	78%	0.784	S	S	*	*			trans	-40.5	131	174.7	-62.2	-39.3	0	0	0	112	N425 T429	N425-N427 PolarHBondContact O-N 3.39Å; N425-N427 VanDerWaalsContact O-N 3.13Å; N427-T429 PolarHBondContact O-N 3.28Å
428	E	30.9	Very low	34.3	Very low	166 Å²	166	143.8 Å²	143.8	78%	0.776	78%	0.784	S	S	*	*			trans	-47	100.2	168.8	-70	176.1	137.8	0	0	110.8	I426 H430	I426-E428 PolarHBondContact O-N 3.24Å; E428-H430 PolarHBondContact O-CE1 2.8Å; E428-H430 PolarHBondContact O-N 3.01Å; E428-H430 PolarHBondContact O-ND1 2.88Å; E428-H430 PolarHBondContact O-NE2 3.3Å
429	T	36.2	Very low	34.2	Very low	119 Å²	119	141.5 Å²	141.5	73%	0.73	78%	0.781	S	S	*	*			trans	-86.4	107.8	164.4	51.6	0	0	0	0	108.5	N427 S431	N427-T429 PolarHBondContact O-N 3.28Å; T429-S431 PolarHBondContact O-N 3.39Å
430	H	31.7	Very low	33.9	Very low	166 Å²	166	140.2 Å²	140.2	77%	0.769	78%	0.778	S	S	*	*			trans	-65.5	76.1	169.6	-15.4	-73.6	0	0	0	109.5	E428 R432	E428-H430 PolarHBondContact O-CE1 2.8Å; E428-H430 PolarHBondContact O-N 3.01Å; E428-H430 PolarHBondContact O-ND1 2.88Å; E428-H430 PolarHBondContact O-NE2 3.3Å; H430-R432 PolarHBondContact O-N 3.04Å
431	S	34.8	Very low	33.5	Very low	102 Å²	102	138 Å²	138	71%	0.713	78%	0.783	S	S	*	*			trans	-89.6	90	176.1	53	0	0	0	0	110.1	T429	T429-S431 PolarHBondContact O-N 3.39Å
432	R	31.5	Very low	33.3	Very low	231 Å²	231	141.4 Å²	141.4	87%	0.872	79%	0.794	S	S	*	*			trans	29.7	107.5	144.2	-77.9	173.9	153.8	146.7	-6.3	116.6	H430 V434	H430-R432 PolarHBondContact O-N 3.04Å; R432-V434 PolarHBondContact O-N 3.38Å; R432-V434 VanDerWaalsContact O-N 3.14Å
433	G	29.3	Very low	33	Very low	80 Å²	80	138 Å²	138	83%	0.825	79%	0.791	S	S	*	*			trans	-55.6	114.9	159.9	0	0	0	0	0	110.7	Q435	G433-Q435 PolarHBondContact O-N 3.17Å
434	V	34.5	Very low	32.9	Very low	136 Å²	136	138 Å²	138	82%	0.824	79%	0.789	S	S	*	*			trans	-79.4	103.7	167.3	176.5	0	0	0	0	106.3	R432 A436	R432-V434 PolarHBondContact O-N 3.38Å; R432-V434 VanDerWaalsContact O-N 3.14Å; V434-A436 PolarHBondContact O-N 3.39Å; V434-A436 VanDerWaalsContact O-N 3.11Å
435	Q	32.6	Very low	32.7	Very low	177 Å²	177	139 Å²	139	83%	0.827	79%	0.794	S	S	*	*			trans	-64.7	108	168.5	-71.1	-175.3	-76.4	0	0	108.1	G433 N437	G433-Q435 PolarHBondContact O-N 3.17Å; Q435-N437 PolarHBondContact O-N 3.44Å
436	A	31.5	Very low	32.6	Very low	83 Å²	83	137.2 Å²	137.2	69%	0.686	79%	0.789	S	S	*	*			trans	-72.2	106.3	169.5	0	0	0	0	0	108.5	V434 L438	V434-A436 PolarHBondContact O-N 3.39Å; V434-A436 VanDerWaalsContact O-N 3.11Å; A436-L438 VanDerWaalsContact C-N 3.34Å; A436-L438 PolarHBondContact O-N 2.82Å
437	N	32.8	Very low	32.3	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	79%	0.793	S	S	*	*			trans	-68.2	90.7	168.8	-72.8	-25	0	0	0	108.9	Q435 S439	Q435-N437 PolarHBondContact O-N 3.44Å; N437-S439 PolarHBondContact O-N 2.86Å
438	L	30.5	Very low	32	Very low	162 Å²	162	140.6 Å²	140.6	85%	0.848	80%	0.799	S	S	*	*			trans	-82.5	93.7	167.3	-77.6	162	0	0	0	108	A436 S440	A436-L438 VanDerWaalsContact C-N 3.34Å; A436-L438 PolarHBondContact O-N 2.82Å; L438-S440 PolarHBondContact O-N 2.87Å; L438-S440 VanDerWaalsContact O-N 3.09Å
439	S	31.1	Very low	32.1	Very low	114 Å²	114	138.1 Å²	138.1	80%	0.797	80%	0.8	S	S	*	*			trans	-61.1	102.8	168.1	52.3	0	0	0	0	109.8	N437 A441	N437-S439 PolarHBondContact O-N 2.86Å; S439-A441 PolarHBondContact O-N 2.84Å
440	S	34.6	Very low	31.6	Very low	106 Å²	106	139.3 Å²	139.3	74%	0.741	80%	0.802	S	S	*	*			trans	-72.4	107.3	164.8	41	0	0	0	0	109	L438 T442	L438-S440 PolarHBondContact O-N 2.87Å; L438-S440 VanDerWaalsContact O-N 3.09Å; S440-T442 PolarHBondContact O-N 2.98Å
441	A	27.9	Very low	31.7	Very low	104 Å²	104	138.5 Å²	138.5	86%	0.86	80%	0.803	S	S	*	*			trans	-72.9	98.2	170.9	0	0	0	0	0	109.4	S439	S439-A441 PolarHBondContact O-N 2.84Å
442	T	32.8	Very low	31.5	Very low	118 Å²	118	139.7 Å²	139.7	72%	0.724	81%	0.806	S	S	*	*			trans	-94.6	108.8	165.5	53	0	0	0	0	107.8	S440 E444	S440-T442 PolarHBondContact O-N 2.98Å; T442-E444 PolarHBondContact O-N 2.71Å
443	S	31.3	Very low	31.2	Very low	121 Å²	121	136.7 Å²	136.7	85%	0.846	80%	0.802	S	S	*	*			trans	-71.2	113.3	173.8	-159.1	0	0	0	0	108.6
444	E	34.5	Very low	31.5	Very low	166 Å²	166	139.3 Å²	139.3	78%	0.776	80%	0.802	S	S	*	*			trans	-77.3	114.7	173	-70.8	178.3	145.2	0	0	109.8	T442	T442-E444 PolarHBondContact O-N 2.71Å
445	D	34.4	Very low	31.2	Very low	164 Å²	164	139.3 Å²	139.3	88%	0.877	80%	0.797	S	S	*	*			trans	-93.6	116	158.9	-94.6	-31.9	0	0	0	109.2	L447	D445-L447 PolarHBondContact O-N 3.46Å
446	T	30.5	Very low	31.1	Very low	116 Å²	116	140.3 Å²	140.3	71%	0.712	80%	0.799	S	S	*	*			trans	-81.8	110.9	-166.6	-57.9	0	0	0	0	110.8
447	L	31.2	Very low	30.7	Very low	174 Å²	174	142.3 Å²	142.3	91%	0.911	80%	0.802	S	S	*	*			trans	-96.9	109.8	162.1	-83.3	168.6	0	0	0	109.9	D445 S449	D445-L447 PolarHBondContact O-N 3.46Å; L447-S449 PolarHBondContact O-N 3.48Å
448	K	27.9	Very low	30.5	Very low	195 Å²	195	141.3 Å²	141.3	85%	0.848	80%	0.802	S	S	*	*			trans	-58.7	117.9	171.8	-75.8	171	173.5	173.4	0	110.8
449	S	32.4	Very low	30.4	Very low	115 Å²	115	140.2 Å²	140.2	80%	0.804	80%	0.797	S	S	*	*			trans	-138.2	115.9	147.9	61.2	0	0	0	0	108.9	L447	L447-S449 PolarHBondContact O-N 3.48Å
450	N	26.3	Very low	30.1	Very low	144 Å²	144	146 Å²	146	77%	0.77	80%	0.802	S	S	*	*			trans	-67.6	139.2	168.6	-58.5	-37.7	0	0	0	107.7
451	N	32.7	Very low	30	Very low	149 Å²	149	147.2 Å²	147.2	80%	0.797	80%	0.799	S	S	*	*			trans	-179.9	111	133.9	-84.4	-21.5	0	0	0	111.3
452	T	31.6	Very low	30.2	Very low	126 Å²	126	150.4 Å²	150.4	77%	0.773	80%	0.797	S	S	*	*			trans	66	105.1	132	-24	0	0	0	0	119.3
453	E	25.2	Very low	29.9	Very low	169 Å²	169	151.6 Å²	151.6	79%	0.79	81%	0.808	S	S	*	*			trans	-44.1	130.8	160.5	-64.8	166.5	126.7	0	0	113.4
454	V	34.9	Very low	29.9	Very low	134 Å²	134	151 Å²	151	81%	0.812	80%	0.804	S	S	*	*			trans	-134	101.6	147.1	179.1	0	0	0	0	107.7	K456	V454-K456 PolarHBondContact O-N 3.48Å
455	N	27.7	Very low	29.8	Very low	137 Å²	137	148.3 Å²	148.3	73%	0.733	80%	0.804	S	S	*	*			trans	-62.7	123.2	169.4	-72.1	-48.1	0	0	0	110.2
456	K	30.5	Very low	29.5	Very low	198 Å²	198	149.1 Å²	149.1	86%	0.861	81%	0.807	S	S	*	*			trans	-142.9	95.9	155.3	-117	177.6	-177.3	179.3	0	109.7	V454	V454-K456 PolarHBondContact O-N 3.48Å
457	T	24.9	Very low	29.6	Very low	124 Å²	124	148.9 Å²	148.9	76%	0.761	81%	0.809	S	S	*	*			trans	-71.3	132.6	162.1	44.4	0	0	0	0	108.9
458	T	28	Very low	29.5	Very low	131 Å²	131	149.9 Å²	149.9	80%	0.804	81%	0.809	S	S	*	*			trans	176.7	138.6	137.3	29	0	0	0	0	111.9
459	N	28.6	Very low	29.8	Very low	139 Å²	139	146.8 Å²	146.8	74%	0.743	81%	0.807	S	S	*	*			trans	73.6	85.3	158.7	-68.8	-0.2	0	0	0	119.4
460	R	24.2	Very low	29.7	Very low	237 Å²	237	147.1 Å²	147.1	89%	0.894	81%	0.806	S	S	*	*				-53.8	131.5	128.1	-85.7	174	155.1	149.8	-5.4	108.5
461	D	32.7	Very low	29.8	Very low	130 Å²	130	148.7 Å²	148.7	70%	0.695	81%	0.813	S	S	*	*			trans	-161.1	118.8	141.2	-83	-32.8	0	0	0	109.8
462	E	31.1	Very low	29.9	Very low	171 Å²	171	150.7 Å²	150.7	80%	0.799	82%	0.815	S	S	*	*			trans	62.5	78.8	138	-54	-173.3	163.3	0	0	120.3	S464	E462-S464 PolarHBondContact O-N 3.4Å
463	C	26.5	Very low	30.1	Very low	143 Å²	143	152.7 Å²	152.7	97%	0.966	82%	0.816	S	S	*	*			trans	-79.9	94.3	148.6	-82.5	0	0	0	0	109.2
464	S	32.2	Very low	30.4	Very low	109 Å²	109	151.7 Å²	151.7	76%	0.762	82%	0.816	S	S	*	*			trans	-78.3	120.3	168.4	29.6	0	0	0	0	110.2	E462 L466	E462-S464 PolarHBondContact O-N 3.4Å; S464-L466 PolarHBondContact O-N 3.49Å
465	S	31.8	Very low	30.1	Very low	110 Å²	110	156 Å²	156	77%	0.769	82%	0.817	S	S	*	*			trans	-61.1	112.2	174	55.4	0	0	0	0	111.4
466	L	28.9	Very low	30.4	Very low	181 Å²	181	158.4 Å²	158.4	95%	0.948	82%	0.822	S	S	*	*			trans	-85.8	115.2	171.2	-151.1	77.3	0	0	0	109	S464	S464-L466 PolarHBondContact O-N 3.49Å
467	C	31.9	Very low	30.6	Very low	111 Å²	111	158 Å²	158	75%	0.75	82%	0.823	S	S	*	*			trans	-65.6	142.7	-172	-58.1	0	0	0	0	114
468	Q	29.9	Very low	31.1	Very low	194 Å²	194	161 Å²	161	91%	0.907	83%	0.828	S	S	*	*			trans	-58.8	131.1	165.7	-77.3	162.6	-30	0	0	111.3
469	T	33.5	Very low	31.4	Very low	131 Å²	131	163.7 Å²	163.7	80%	0.804	83%	0.831	S	S	*	*			trans	-108.6	123.1	163	39.7	0	0	0	0	109.3
470	P	31	Very low	31.7	Very low	122 Å²	122	162.6 Å²	162.6	79%	0.792	84%	0.835	S	S	*	*			trans	-78	123.3	177.4	26.5	-29	0	0	0	111.2	K472	P470-K472 PolarHBondContact O-N 3.43Å
471	L	29	Very low	32.4	Very low	176 Å²	176	157.7 Å²	157.7	92%	0.921	83%	0.831	S	S	*	*			trans	-63.7	110.8	176.8	-76.7	159.9	0	0	0	110.9	Q473	L471-Q473 PolarHBondContact O-N 2.76Å
472	K	34.3	Very low	32.5	Very low	192 Å²	192	155 Å²	155	84%	0.835	83%	0.833	S	S	*	*			trans	-71.3	120.9	169	-78.9	-176.7	173.6	-179.5	0	110.5	P470 N474	P470-K472 PolarHBondContact O-N 3.43Å; K472-N474 PolarHBondContact O-N 3.33Å
473	Q	35.3	Very low	32.5	Very low	167 Å²	167	154.5 Å²	154.5	78%	0.78	83%	0.834	S	S	*	*			trans	-78.7	111.7	168.4	-81.3	175.2	-46.2	0	0	110.3	L471	L471-Q473 PolarHBondContact O-N 2.76Å
474	N	32.1	Very low	33	Very low	149 Å²	149	159.8 Å²	159.8	80%	0.797	84%	0.844	S	S	*	*			trans	-96.2	100.5	170.4	-77.9	-38.1	0	0	0	109.4	K472 K476	K472-N474 PolarHBondContact O-N 3.33Å; N474-K476 PolarHBondContact O-N 3.44Å
475	W	27.3	Very low	33	Very low	223 Å²	223	162.4 Å²	162.4	85%	0.845	85%	0.848	S	S	*	*			trans	-87.1	99.9	162.6	-71.2	92.1	0	0	0	108.3
476	K	35.6	Very low	33.1	Very low	189 Å²	189	165.1 Å²	165.1	82%	0.822	85%	0.853	S	S	*	*			trans	-78.8	118.8	168.1	-88.8	-175.2	172.5	-175.4	0	108.7	N474 H478	N474-K476 PolarHBondContact O-N 3.44Å; K476-H478 PolarHBondContact O-N 3.46Å
477	Q	34.1	Very low	33.4	Very low	189 Å²	189	164.2 Å²	164.2	88%	0.883	85%	0.847	S	S	*	*			trans	-63.4	124.3	170	-71.9	172.7	-32.6	0	0	108.9	E479	Q477-E479 PolarHBondContact O-N 3.35Å
478	H	34.8	Very low	33.4	Very low	188 Å²	188	167.4 Å²	167.4	87%	0.87	85%	0.853	S	S	*	*			trans	-72.9	110.8	171.3	-83.7	-103.6	0	0	0	108.6	K476 S480	K476-H478 PolarHBondContact O-N 3.46Å; H478-S480 PolarHBondContact O-N 3.13Å
479	E	35	Very low	33.7	Very low	187 Å²	187	165.7 Å²	165.7	87%	0.874	85%	0.85	S	S	*	*			trans	-61.9	130.6	167.4	-73.1	177.3	161.3	0	0	109.6	Q477	Q477-E479 PolarHBondContact O-N 3.35Å
480	S	35	Very low	33.7	Very low	116 Å²	116	168 Å²	168	81%	0.811	85%	0.853	S	S	*	*			trans	-78.3	117.4	177.4	23.7	0	0	0	0	108.7	H478 G482	H478-S480 PolarHBondContact O-N 3.13Å; S480-G482 PolarHBondContact O-N 2.95Å
481	V	38.1	Very low	33.9	Very low	134 Å²	134	171.3 Å²	171.3	81%	0.812	86%	0.857	S	S	*	*			trans	-69	101.8	170.7	177.7	0	0	0	0	107.7	I483	V481-I483 PolarHBondContact O-N 2.95Å
482	G	35.3	Very low	34.2	Very low	72 Å²	72	170.9 Å²	170.9	74%	0.742	85%	0.852	S	S	*	*			trans	-68.1	114.6	169.1	0	0	0	0	0	109.6	S480	S480-G482 PolarHBondContact O-N 2.95Å
483	I	30.3	Very low	34.2	Very low	162 Å²	162	169.2 Å²	169.2	83%	0.831	85%	0.854	S	S	*	*			trans	-82.5	114.9	164.8	-62.1	165.9	0	0	0	105.6	V481	V481-I483 PolarHBondContact O-N 2.95Å
484	H	37.8	Very low	34.1	Very low	254 Å²	254	169.4 Å²	169.4	100%	1.176	86%	0.86	S	S	*	*			trans	-142.6	0	156.8	-132.8	-37.9	0	0	0	111.8

Retrieved 484 of 484 residues in 548.8 ms (Link to these results)

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