G4VG23_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession G4VG23, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 190 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	40	Very low	39.6	Very low	243 Å²	243	143.8 Å²	143.8	100%	1.197	79%	0.786	S	S	*	*				0	108.2	0	-78.3	-170.9	159.7	0	0	106.9	G3	M1-G3 PolarHBondContact O-N 3.46Å
2	S	38.7	Very low	39.9	Very low	128 Å²	128	146.2 Å²	146.2	90%	0.895	78%	0.784	S	S	*	*			trans	-70.2	115.1	-173.8	-47.2	0	0	0	0	110.3
3	G	35.7	Very low	40.1	Very low	73 Å²	73	152.8 Å²	152.8	75%	0.753	79%	0.791	S	S	*	*			trans	-92.8	96.6	168.9	0	0	0	0	0	109.5	M1 V5	M1-G3 PolarHBondContact O-N 3.46Å; G3-V5 PolarHBondContact O-N 3.19Å
4	E	38.6	Very low	39.9	Very low	162 Å²	162	154.1 Å²	154.1	76%	0.757	79%	0.794	S	S	*	*			trans	-83	96.4	163.4	-88.8	-175.1	164.9	0	0	108.4	K6	E4-K6 PolarHBondContact O-N 3.03Å
5	V	44.4	Very low	39.8	Very low	115 Å²	115	155.1 Å²	155.1	70%	0.697	79%	0.794	S	S	*	*			trans	-79.3	97.1	165.3	-179.7	0	0	0	0	106.7	G3 H7	G3-V5 PolarHBondContact O-N 3.19Å; V5-H7 PolarHBondContact O-CD2 3.2Å; V5-H7 PolarHBondContact O-N 3.03Å; V5-H7 VanDerWaalsContact O-N 3.08Å
6	K	41.6	Very low	39.8	Very low	157 Å²	157	160.3 Å²	160.3	68%	0.683	80%	0.801	S	S	*	*			trans	-67.6	105.1	174	-72.7	-176.1	177.5	-179.4	0	109.2	E4 F8	E4-K6 PolarHBondContact O-N 3.03Å; K6-F8 PolarHBondContact O-N 2.94Å; K6-F8 VanDerWaalsContact O-N 3.1Å
7	H	39.4	Very low	40.1	Very low	169 Å²	169	163.9 Å²	163.9	78%	0.782	80%	0.803	S	S	*	*			trans	-65.7	103.6	167.6	-66.6	-83.2	0	0	0	108.8	V5 T9	V5-H7 PolarHBondContact O-CD2 3.2Å; V5-H7 PolarHBondContact O-N 3.03Å; V5-H7 VanDerWaalsContact O-N 3.08Å; H7-T9 PolarHBondContact O-N 2.76Å
8	F	37.7	Very low	40.5	Very low	187 Å²	187	165.7 Å²	165.7	82%	0.82	81%	0.806	S	S	*	*			trans	-79.7	100.8	167	-91	-90	0	0	0	108.1	K6 P10	K6-F8 PolarHBondContact O-N 2.94Å; K6-F8 VanDerWaalsContact O-N 3.1Å; F8-P10 VanDerWaalsContact O-CD 3.26Å; F8-P10 WeakPolarHBondContact O-CD 3.41Å
9	T	38.8	Very low	40.9	Very low	130 Å²	130	163.1 Å²	163.1	80%	0.798	81%	0.806	S	S	*	*			trans	-73	113.8	165.4	-26.3	0	0	0	0	107.6	H7 D11	H7-T9 PolarHBondContact O-N 2.76Å; T9-D11 PolarHBondContact O-N 2.97Å
10	P	41.7	Very low	41	Very low	89 Å²	89	161.4 Å²	161.4	58%	0.578	81%	0.805	S	S	*	*			trans	-68.5	130.2	-178.9	25	-30.1	0	0	0	110.5	F8 F12	F8-P10 VanDerWaalsContact O-CD 3.26Å; F8-P10 WeakPolarHBondContact O-CD 3.41Å; P10-F12 HydrophobicContact CG-CE2 3.93Å; P10-F12 HydrophobicContact CG-CZ 4.48Å; P10-F12 WeakPolarHBondContact O-CD2 3.41Å; P10-F12 PolarHBondContact O-N 3.49Å
11	D	38.8	Very low	41	Very low	129 Å²	129	164.5 Å²	164.5	69%	0.69	81%	0.808	S	S	*	*			trans	-68.3	95.3	179.7	-165.6	-12	0	0	0	110.5	T9 R13	T9-D11 PolarHBondContact O-N 2.97Å; D11-R13 PolarHBondContact O-N 3.06Å
12	F	43	Very low	41.1	Very low	172 Å²	172	162.2 Å²	162.2	75%	0.754	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-2.4	-175.6	-86.8	-84.6	0	0	0	114.4	P10 M14	P10-F12 HydrophobicContact CG-CE2 3.93Å; P10-F12 HydrophobicContact CG-CZ 4.48Å; P10-F12 WeakPolarHBondContact O-CD2 3.41Å; P10-F12 PolarHBondContact O-N 3.49Å; F12-M14 VanDerWaalsContact C-N 3.32Å; F12-M14 PolarHBondContact O-N 2.82Å
13	R	43.1	Very low	41.2	Very low	232 Å²	232	161.3 Å²	161.3	88%	0.875	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-13.8	-178.5	-75.9	-174.1	174.1	-176.4	0.5	115.1	D11	D11-R13 PolarHBondContact O-N 3.06Å
14	M	37.2	Very low	41.5	Very low	171 Å²	171	165.6 Å²	165.6	84%	0.842	79%	0.79	S	S	*	*	S	Bend	trans	-107.7	-5.6	-172.1	-71.8	-150.7	107.2	0	0	117.9	F12 R16	F12-M14 VanDerWaalsContact C-N 3.32Å; F12-M14 PolarHBondContact O-N 2.82Å; M14-R16 VanDerWaalsContact C-N 3.26Å; M14-R16 PolarHBondContact O-N 3Å
15	Q	38.1	Very low	41.4	Very low	170 Å²	170	165.8 Å²	165.8	79%	0.794	80%	0.795	S	S	*	*			trans	-86	67.5	174.6	-80.3	-173.3	-6.2	0	0	112.6	R17	Q15-R17 PolarHBondContact O-N 3.38Å
16	R	39.7	Very low	41.1	Very low	238 Å²	238	167.6 Å²	167.6	90%	0.898	80%	0.799	S	S	*	*			trans	-57.3	97.1	159.3	-106.7	-179.6	162.5	-177	-3.7	108.6	M14 K18	M14-R16 VanDerWaalsContact C-N 3.26Å; M14-R16 PolarHBondContact O-N 3Å; R16-K18 PolarHBondContact O-N 3.26Å
17	R	45.6	Very low	40.7	Very low	222 Å²	222	165.7 Å²	165.7	84%	0.838	80%	0.804	S	S	*	*			trans	-61.1	107.7	171.8	-72.7	-177.6	169.5	179.2	-1.8	109	Q15 S19	Q15-R17 PolarHBondContact O-N 3.38Å; R17-S19 PolarHBondContact O-N 3.09Å; R17-S19 VanDerWaalsContact O-N 3.11Å
18	K	46.3	Very low	40.6	Very low	196 Å²	196	161.5 Å²	161.5	85%	0.852	80%	0.799	S	S	*	*			trans	-65.3	106.5	170.4	-66.5	179	-179.6	176.8	0	107.9	R16 T20	R16-K18 PolarHBondContact O-N 3.26Å; K18-T20 PolarHBondContact O-N 2.94Å
19	S	48.9	Very low	40.7	Very low	115 Å²	115	158.3 Å²	158.3	80%	0.804	80%	0.797	S	S	*	*			trans	-68.1	107.5	174.4	-179.6	0	0	0	0	109.8	R17 R21	R17-S19 PolarHBondContact O-N 3.09Å; R17-S19 VanDerWaalsContact O-N 3.11Å; S19-R21 PolarHBondContact O-N 3.39Å
20	T	42.1	Very low	40.4	Very low	129 Å²	129	158 Å²	158	79%	0.791	80%	0.799	S	S	*	*			trans	-82.6	88.6	174.8	36.5	0	0	0	0	110.1	K18 K22	K18-T20 PolarHBondContact O-N 2.94Å; T20-K22 PolarHBondContact O-N 3.06Å
21	R	42.2	Very low	40.2	Very low	228 Å²	228	161.6 Å²	161.6	86%	0.86	81%	0.812	S	S	*	*			trans	-72	62.6	172.7	-167.6	-173.5	174.5	-169	-1.8	112	S19	S19-R21 PolarHBondContact O-N 3.39Å
22	K	42.6	Very low	40	Very low	194 Å²	194	162 Å²	162	84%	0.843	82%	0.819	S	S	*	*			trans	-147.4	89.9	175.1	-71	-171.4	178.8	-176.9	0	111.3	T20	T20-K22 PolarHBondContact O-N 3.06Å
23	S	40.6	Very low	39.4	Very low	110 Å²	110	162.8 Å²	162.8	77%	0.769	83%	0.826	S	S	*	*			trans	166.4	62.5	146	62.9	0	0	0	0	112.7
24	L	40.3	Very low	38.9	Very low	163 Å²	163	160.3 Å²	160.3	85%	0.853	82%	0.824	S	S	*	*			trans	-141.5	50.6	156.2	-73.8	178.2	0	0	0	108.7
25	L	37.9	Very low	38.5	Very low	165 Å²	165	158.4 Å²	158.4	86%	0.864	82%	0.817	S	S	*	*			trans	-90.7	88.1	158.3	-73	169.5	0	0	0	105.6	C27	L25-C27 VanDerWaalsContact C-N 3.27Å; L25-C27 PolarHBondContact O-N 3.03Å; L25-C27 VanDerWaalsContact O-N 3.07Å
26	I	38.7	Very low	38.2	Very low	153 Å²	153	157.8 Å²	157.8	79%	0.785	82%	0.818	S	S	*	*			trans	-74	93.4	164.1	-61.2	173.4	0	0	0	105.1	A28	I26-A28 PolarHBondContact O-N 2.79Å
27	C	32.6	Very low	37.7	Very low	117 Å²	117	153.1 Å²	153.1	79%	0.791	81%	0.811	S	S	*	*			trans	-66	105.3	163.2	-76.7	0	0	0	0	107.5	L25	L25-C27 VanDerWaalsContact C-N 3.27Å; L25-C27 PolarHBondContact O-N 3.03Å; L25-C27 VanDerWaalsContact O-N 3.07Å
28	A	37.8	Very low	36.9	Very low	82 Å²	82	151.1 Å²	151.1	68%	0.678	81%	0.811	S	S	*	*			trans	-77.3	143	156.6	0	0	0	0	0	108.4	I26	I26-A28 PolarHBondContact O-N 2.79Å
29	P	38.2	Very low	36.2	Very low	120 Å²	120	151 Å²	151	78%	0.779	81%	0.813	S	S	*	*			trans	-69.1	136.3	-166.4	-14.5	29.1	0	0	0	112.5	L31	P29-L31 PolarHBondContact O-N 2.86Å
30	C	33.1	Very low	35.3	Very low	123 Å²	123	150.6 Å²	150.6	83%	0.831	81%	0.808	S	S	*	*			trans	-66.6	105.8	165.9	-70.2	0	0	0	0	109.3
31	L	36.8	Very low	35	Very low	165 Å²	165	153.1 Å²	153.1	86%	0.864	82%	0.816	S	S	*	*			trans	-88.6	105.3	156.2	-74	170	0	0	0	106.8	P29 E33	P29-L31 PolarHBondContact O-N 2.86Å; L31-E33 PolarHBondContact O-N 3.35Å
32	T	35.9	Very low	34.5	Very low	137 Å²	137	147.7 Å²	147.7	84%	0.84	81%	0.813	S	S	*	*			trans	-58.2	111	172.2	22.7	0	0	0	0	110.8
33	E	30.5	Very low	34.1	Very low	189 Å²	189	143.4 Å²	143.4	88%	0.883	81%	0.808	S	S	*	*			trans	-77.2	122.4	155.8	-70.5	-175	163.5	0	0	109.2	L31	L31-E33 PolarHBondContact O-N 3.35Å
34	Q	32.3	Very low	33.8	Very low	180 Å²	180	145.1 Å²	145.1	84%	0.841	81%	0.808	S	S	*	*			trans	-142.1	109	148.3	-97	-172.3	-4.7	0	0	108.7
35	N	28.6	Very low	33.7	Very low	130 Å²	130	143.3 Å²	143.3	70%	0.695	80%	0.804	S	S	*	*			trans	65.3	114.8	138.6	-78.6	-32.2	0	0	0	120.8
36	L	31.7	Very low	33.3	Very low	158 Å²	158	144.7 Å²	144.7	83%	0.827	80%	0.802	S	S	*	*				166.7	100.3	106.7	-85.6	156.2	0	0	0	106.8
37	D	28.8	Very low	33.6	Very low	140 Å²	140	141.6 Å²	141.6	75%	0.749	80%	0.795	S	S	*	*				36.9	99.4	88.5	-82.5	-25.4	0	0	0	113.7
38	E	29.4	Very low	34.1	Very low	179 Å²	179	143.3 Å²	143.3	84%	0.836	80%	0.796	S	S	*	*				159.6	109.3	126	-86.6	-178.9	-173.9	0	0	109.3
39	H	31.3	Very low	34.4	Very low	193 Å²	193	145.6 Å²	145.6	89%	0.894	80%	0.797	S	S	*	*			trans	-149.9	133.5	137.9	-103	-62	0	0	0	111.4
40	P	30.8	Very low	34.7	Very low	108 Å²	108	149.1 Å²	149.1	70%	0.701	80%	0.803	S	S	*	*			trans	-90.2	166.6	-168.1	37.2	-34.7	0	0	0	113.4
41	L	35.6	Very low	35.4	Very low	181 Å²	181	148.4 Å²	148.4	95%	0.948	79%	0.789	S	S	*	*			trans	-22.4	124.9	168.2	-67.6	159.9	0	0	0	116.2
42	S	31.3	Very low	35.9	Very low	115 Å²	115	145 Å²	145	80%	0.804	77%	0.772	S	S	*	*			trans	-160.3	118.4	149.3	179.1	0	0	0	0	111.2
43	S	33.7	Very low	36.9	Very low	104 Å²	104	144.4 Å²	144.4	73%	0.727	76%	0.764	S	S	*	*			trans	-51.3	123.9	163.1	48.5	0	0	0	0	112.6
44	D	35.2	Very low	38.4	Very low	145 Å²	145	140.8 Å²	140.8	78%	0.775	75%	0.751	S	S	*	*				166.9	83.8	127.6	-109	-25.9	0	0	0	108.7
45	V	37.3	Very low	39.6	Very low	126 Å²	126	139 Å²	139	76%	0.764	74%	0.743	S	S	*	*			trans	-132.5	79	155.2	-172.4	0	0	0	0	107.1	S47	V45-S47 VanDerWaalsContact C-N 3.26Å; V45-S47 WeakPolarHBondContact CG1-OG 3.29Å; V45-S47 PolarHBondContact O-N 3.38Å
46	K	30.8	Very low	41	Very low	193 Å²	193	137.1 Å²	137.1	84%	0.839	73%	0.732	S	S	*	*			trans	-65	98.5	142.5	-80.3	-177.9	174.8	-179.3	0	106.5
47	S	43.4	Very low	43.1	Very low	89 Å²	89	133.5 Å²	133.5	62%	0.622	72%	0.716	S	S	*	*			trans	-123	97.2	155.7	58.5	0	0	0	0	106.2	V45 N49	V45-S47 VanDerWaalsContact C-N 3.26Å; V45-S47 WeakPolarHBondContact CG1-OG 3.29Å; V45-S47 PolarHBondContact O-N 3.38Å; S47-N49 PolarHBondContact O-N 3.42Å
48	D	43	Very low	45.6	Very low	153 Å²	153	132.6 Å²	132.6	82%	0.818	71%	0.711	S	S	*	*			trans	-47.4	104.6	165	-65.6	-46.4	0	0	0	108.8
49	N	44.5	Very low	48.2	Very low	130 Å²	130	128.8 Å²	128.8	70%	0.695	69%	0.694	S	S	*	*			trans	-165.5	76	151.6	-112.2	16.8	0	0	0	105.1	S47 I51	S47-N49 PolarHBondContact O-N 3.42Å; N49-I51 HydrophobicContact CB-CD1 4.41Å; N49-I51 HydrophobicContact CB-CG1 4.02Å; N49-I51 PolarHBondContact O-N 2.86Å
50	E	45.8	Very low	50.6	Low	194 Å²	194	123.9 Å²	123.9	91%	0.907	67%	0.673	S	S	*	*			trans	-59.7	77.1	154.4	-166.9	172.4	-155.1	0	0	105.9	N52	E50-N52 VanDerWaalsContact C-N 3.33Å; E50-N52 PolarHBondContact O-N 3.35Å
51	I	47.3	Very low	53.2	Low	107 Å²	107	121.3 Å²	121.3	55%	0.549	66%	0.662	S	S	.	*			trans	-68.9	103.5	171.6	-65.6	168.5	0	0	0	103.2	N49 D53 L56	N49-I51 HydrophobicContact CB-CD1 4.41Å; N49-I51 HydrophobicContact CB-CG1 4.02Å; N49-I51 PolarHBondContact O-N 2.86Å; I51-D53 PolarHBondContact O-N 2.97Å; I51-L56 HydrophobicContact CG2-CD1 3.69Å; I51-L56 HydrophobicContact CG2-CG 4.45Å
52	N	47.3	Very low	55.8	Low	94 Å²	94	119.1 Å²	119.1	50%	0.503	64%	0.644	S	S	.	*			trans	-60.7	104.1	-175.1	-160.4	14	0	0	0	108.2	E50 D54 E55	E50-N52 VanDerWaalsContact C-N 3.33Å; E50-N52 PolarHBondContact O-N 3.35Å; N52-D54 PolarHBondContact O-N 3.45Å; N52-E55 WeakPolarHBondContact O-CB 3.47Å; N52-E55 PolarHBondContact O-N 3.26Å
53	D	56.1	Low	58.4	Low	124 Å²	124	120.4 Å²	120.4	66%	0.663	63%	0.631	S	S	*	*	H	α-helix	trans	-54.8	-28.7	-175.1	-83.3	-32.2	0	0	0	112	I51 E55 L56 T57	I51-D53 PolarHBondContact O-N 2.97Å; D53-E55 VanDerWaalsContact C-N 3.31Å; D53-E55 PolarHBondContact O-N 3.42Å; D53-L56 PolarHBondContact O-N 2.98Å; D53-T57 PolarHBondContact O-N 3.48Å; D53-T57 VanDerWaalsContact O-N 3.09Å; D53-T57 PolarHBondContact O-OG1 2.91Å
54	D	61.9	Low	60.9	Low	113 Å²	113	123.4 Å²	123.4	60%	0.604	63%	0.628	S	S	*	*	H	α-helix	trans	-59	-39.1	175.5	-74.3	-17.6	0	0	0	112.4	N52 T57 D58	N52-D54 PolarHBondContact O-N 3.45Å; D54-T57 VanDerWaalsContact CA-OG1 3.29Å; D54-T57 WeakPolarHBondContact CA-OG1 3.34Å; D54-T57 PolarHBondContact O-N 3.06Å; D54-T57 PolarHBondContact O-OG1 2.69Å; D54-D58 PolarHBondContact O-N 3.1Å
55	E	58.3	Low	63.6	Low	144 Å²	144	122.4 Å²	122.4	67%	0.673	62%	0.619	S	S	*	*	H	α-helix	trans	-71.3	-34	-179.4	-161.8	171.9	-164.3	0	0	111.6	N52 D53 D58 E59	N52-E55 WeakPolarHBondContact O-CB 3.47Å; N52-E55 PolarHBondContact O-N 3.26Å; D53-E55 VanDerWaalsContact C-N 3.31Å; D53-E55 PolarHBondContact O-N 3.42Å; E55-D58 PolarHBondContact O-N 3.29Å; E55-E59 WeakPolarHBondContact O-CB 3.25Å; E55-E59 PolarHBondContact O-N 3.11Å
56	L	57.7	Low	66.1	Low	90 Å²	90	119.8 Å²	119.8	47%	0.471	60%	0.6	S	S	.	*	H	α-helix	trans	-68.7	-38.4	174	-90.5	163.7	0	0	0	112.1	I51 D53 L60	I51-L56 HydrophobicContact CG2-CD1 3.69Å; I51-L56 HydrophobicContact CG2-CG 4.45Å; D53-L56 PolarHBondContact O-N 2.98Å; L56-L60 WeakPolarHBondContact O-CB 3.33Å; L56-L60 PolarHBondContact O-N 3.05Å
57	T	74.6	Confident	68.9	Low	81 Å²	81	114.7 Å²	114.7	50%	0.497	58%	0.58	S	S	.	*	H	α-helix	trans	-66	-41.5	173.9	25.1	0	0	0	0	112.5	D53 D54 L60 A61	D53-T57 PolarHBondContact O-N 3.48Å; D53-T57 VanDerWaalsContact O-N 3.09Å; D53-T57 PolarHBondContact O-OG1 2.91Å; D54-T57 VanDerWaalsContact CA-OG1 3.29Å; D54-T57 WeakPolarHBondContact CA-OG1 3.34Å; D54-T57 PolarHBondContact O-N 3.06Å; D54-T57 PolarHBondContact O-OG1 2.69Å; T57-L60 PolarHBondContact O-N 2.97Å; T57-A61 VanDerWaalsContact O-CB 3.29Å; T57-A61 WeakPolarHBondContact O-CB 3.44Å; T57-A61 PolarHBondContact O-N 2.81Å
58	D	81.8	Confident	71	Confident	121 Å²	121	113.5 Å²	113.5	65%	0.647	57%	0.571	S	S	*	*	H	α-helix	trans	-66.7	-40.5	177.7	-87	-4.9	0	0	0	111.8	D54 E55 A61 K62	D54-D58 PolarHBondContact O-N 3.1Å; E55-D58 PolarHBondContact O-N 3.29Å; D58-A61 PolarHBondContact O-N 3.15Å; D58-K62 VanDerWaalsContact O-CB 3.3Å; D58-K62 WeakPolarHBondContact O-CB 3.29Å; D58-K62 PolarHBondContact O-N 2.88Å
59	E	84.2	Confident	73.3	Confident	100 Å²	100	112.8 Å²	112.8	47%	0.467	56%	0.557	S	S	.	*	H	α-helix	trans	-65.1	-42	176.7	-156.4	-165.8	155.2	0	0	111.5	E55 K62 R63	E55-E59 WeakPolarHBondContact O-CB 3.25Å; E55-E59 PolarHBondContact O-N 3.11Å; E59-K62 PolarHBondContact O-N 3.44Å; E59-R63 VanDerWaalsContact CD-NH2 3.26Å; E59-R63 WeakPolarHBondContact O-CG 3.07Å; E59-R63 PolarHBondContact O-N 3.42Å; E59-R63 IonicContact OE1-CZ 2.8Å; E59-R63 IonicContact OE1-NE 2.85Å; E59-R63 IonicContact OE1-NH2 3.89Å; E59-R63 PolarHBondContact OE1-NH2 3Å; E59-R63 IonicContact OE2-NH2 2.56Å
60	L	81.7	Confident	75.4	Confident	89 Å²	89	112 Å²	112	47%	0.466	55%	0.548	S	S	.	.	H	α-helix	trans	-65.1	-45.4	176.7	-172.8	70.6	0	0	0	111.5	L56 T57 K62 R63 Y64	L56-L60 WeakPolarHBondContact O-CB 3.33Å; L56-L60 PolarHBondContact O-N 3.05Å; T57-L60 PolarHBondContact O-N 2.97Å; L60-K62 VanDerWaalsContact C-N 3.3Å; L60-K62 PolarHBondContact O-N 2.82Å; L60-R63 PolarHBondContact O-N 3.37Å; L60-Y64 HydrophobicContact CD1-CD2 4.31Å; L60-Y64 HydrophobicContact CD1-CE2 3.93Å; L60-Y64 HydrophobicContact CD2-CE2 4.23Å; L60-Y64 HydrophobicContact CG-CD2 3.98Å; L60-Y64 HydrophobicContact CG-CE2 3.84Å; L60-Y64 VanDerWaalsContact O-CD2 3.31Å; L60-Y64 WeakPolarHBondContact O-CD2 3.39Å; L60-Y64 PolarHBondContact O-N 3.44Å
61	A	85.3	Confident	77.4	Confident	55 Å²	55	110.3 Å²	110.3	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-59.8	-43	177.5	0	0	0	0	0	111.2	T57 D58 Y64 Q65	T57-A61 VanDerWaalsContact O-CB 3.29Å; T57-A61 WeakPolarHBondContact O-CB 3.44Å; T57-A61 PolarHBondContact O-N 2.81Å; D58-A61 PolarHBondContact O-N 3.15Å; A61-Y64 PolarHBondContact O-N 3.26Å; A61-Q65 PolarHBondContact O-N 2.95Å
62	K	89.7	Confident	79.3	Confident	135 Å²	135	110 Å²	110	59%	0.587	53%	0.532	S	S	*	.	H	α-helix	trans	-62.1	-43.6	175.8	-170.3	177.6	179.7	-177.6	0	112.1	D58 E59 L60 Y64 Q65 D66	D58-K62 VanDerWaalsContact O-CB 3.3Å; D58-K62 WeakPolarHBondContact O-CB 3.29Å; D58-K62 PolarHBondContact O-N 2.88Å; E59-K62 PolarHBondContact O-N 3.44Å; L60-K62 VanDerWaalsContact C-N 3.3Å; L60-K62 PolarHBondContact O-N 2.82Å; K62-Y64 VanDerWaalsContact C-N 3.34Å; K62-Y64 PolarHBondContact O-N 2.93Å; K62-Q65 PolarHBondContact O-N 2.56Å; K62-D66 PolarHBondContact O-N 2.71Å
63	R	87.5	Confident	81.2	Confident	141 Å²	141	111 Å²	111	53%	0.532	53%	0.534	S	S	.	.	H	α-helix	trans	-60.2	-42.4	174.7	-71.9	-177.2	-153.3	162.9	6.8	112.1	E59 L60 Q65 D66 E67	E59-R63 VanDerWaalsContact CD-NH2 3.26Å; E59-R63 WeakPolarHBondContact O-CG 3.07Å; E59-R63 PolarHBondContact O-N 3.42Å; E59-R63 IonicContact OE1-CZ 2.8Å; E59-R63 IonicContact OE1-NE 2.85Å; E59-R63 IonicContact OE1-NH2 3.89Å; E59-R63 PolarHBondContact OE1-NH2 3Å; E59-R63 IonicContact OE2-NH2 2.56Å; L60-R63 PolarHBondContact O-N 3.37Å; R63-Q65 VanDerWaalsContact C-N 3.35Å; R63-D66 PolarHBondContact O-N 3.38Å; R63-E67 WeakPolarHBondContact O-CB 3.43Å; R63-E67 PolarHBondContact O-N 3.05Å
64	Y	86	Confident	82.4	Confident	167 Å²	167	109.5 Å²	109.5	66%	0.655	53%	0.526	S	S	*	.	H	α-helix	trans	-64	-40.5	176.2	-88.4	-71.7	0	0	0	112.2	L60 A61 K62 E67 S68	L60-Y64 HydrophobicContact CD1-CD2 4.31Å; L60-Y64 HydrophobicContact CD1-CE2 3.93Å; L60-Y64 HydrophobicContact CD2-CE2 4.23Å; L60-Y64 HydrophobicContact CG-CD2 3.98Å; L60-Y64 HydrophobicContact CG-CE2 3.84Å; L60-Y64 VanDerWaalsContact O-CD2 3.31Å; L60-Y64 WeakPolarHBondContact O-CD2 3.39Å; L60-Y64 PolarHBondContact O-N 3.44Å; A61-Y64 PolarHBondContact O-N 3.26Å; K62-Y64 VanDerWaalsContact C-N 3.34Å; K62-Y64 PolarHBondContact O-N 2.93Å; Y64-E67 PolarHBondContact O-N 3.09Å; Y64-S68 WeakPolarHBondContact O-CB 3.49Å; Y64-S68 PolarHBondContact O-N 2.8Å
65	Q	90.4	Very high	83.3	Confident	124 Å²	124	107.8 Å²	107.8	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-66.8	-41.8	178.5	-165.6	178.9	11.2	0	0	111.9	A61 K62 R63 S68 R69	A61-Q65 PolarHBondContact O-N 2.95Å; K62-Q65 PolarHBondContact O-N 2.56Å; R63-Q65 VanDerWaalsContact C-N 3.35Å; Q65-S68 PolarHBondContact O-N 3.37Å; Q65-R69 PolarHBondContact O-N 2.68Å; Q65-R69 VanDerWaalsContact O-N 3.08Å
66	D	90.6	Very high	84.4	Confident	71 Å²	71	107 Å²	107	38%	0.38	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-41.1	175.7	-73.4	-21.5	0	0	0	111.3	K62 R63 R69 K70	K62-D66 PolarHBondContact O-N 2.71Å; R63-D66 PolarHBondContact O-N 3.38Å; D66-R69 PolarHBondContact O-N 2.99Å; D66-K70 WeakPolarHBondContact O-CG 3.29Å; D66-K70 PolarHBondContact O-N 3.42Å; D66-K70 VanDerWaalsContact O-N 3.13Å
67	E	89.6	Confident	85.5	Confident	87 Å²	87	107.1 Å²	107.1	41%	0.407	51%	0.514	S	S	.	.	H	α-helix	trans	-68.7	-41.8	178.4	-160.7	64.8	-165.4	0	0	111.6	R63 Y64 R69 K70 W71	R63-E67 WeakPolarHBondContact O-CB 3.43Å; R63-E67 PolarHBondContact O-N 3.05Å; Y64-E67 PolarHBondContact O-N 3.09Å; E67-R69 VanDerWaalsContact C-N 3.29Å; E67-R69 PolarHBondContact O-N 3.16Å; E67-K70 WeakPolarHBondContact O-CB 3.43Å; E67-K70 PolarHBondContact O-N 2.72Å; E67-K70 VanDerWaalsContact O-N 3.16Å; E67-K70 IonicContact OE2-NZ 3.37Å; E67-K70 PolarHBondContact OE2-NZ 3.44Å; E67-W71 PolarHBondContact O-N 3.42Å
68	S	87.8	Confident	85.3	Confident	63 Å²	63	110.2 Å²	110.2	44%	0.441	52%	0.517	S	S	.	.	H	α-helix	trans	-57.2	-43.8	173.5	-169.1	0	0	0	0	111.5	Y64 Q65 K70 W71 D72	Y64-S68 WeakPolarHBondContact O-CB 3.49Å; Y64-S68 PolarHBondContact O-N 2.8Å; Q65-S68 PolarHBondContact O-N 3.37Å; S68-K70 VanDerWaalsContact C-N 3.32Å; S68-K70 PolarHBondContact O-N 3.04Å; S68-W71 WeakPolarHBondContact O-CB 3.35Å; S68-W71 PolarHBondContact O-N 3.47Å; S68-W71 VanDerWaalsContact O-N 3.14Å; S68-D72 PolarHBondContact O-N 3.48Å
69	R	90.4	Very high	85	Confident	138 Å²	138	110 Å²	110	52%	0.521	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-37.1	178.1	-172.4	-177.9	-65.1	175.6	2.1	112.3	Q65 D66 E67 W71 D72 Q73	Q65-R69 PolarHBondContact O-N 2.68Å; Q65-R69 VanDerWaalsContact O-N 3.08Å; D66-R69 PolarHBondContact O-N 2.99Å; E67-R69 VanDerWaalsContact C-N 3.29Å; E67-R69 PolarHBondContact O-N 3.16Å; R69-W71 VanDerWaalsContact C-N 3.35Å; R69-D72 PolarHBondContact O-N 3.38Å; R69-Q73 WeakPolarHBondContact O-CG 3.09Å; R69-Q73 PolarHBondContact O-N 2.91Å
70	K	89.3	Confident	84.5	Confident	114 Å²	114	109.2 Å²	109.2	50%	0.496	51%	0.514	S	S	.	.	H	α-helix	trans	-64.7	-40.5	174.1	-69	177.5	-159.3	156.4	0	111.5	D66 E67 S68 Q73 L74	D66-K70 WeakPolarHBondContact O-CG 3.29Å; D66-K70 PolarHBondContact O-N 3.42Å; D66-K70 VanDerWaalsContact O-N 3.13Å; E67-K70 WeakPolarHBondContact O-CB 3.43Å; E67-K70 PolarHBondContact O-N 2.72Å; E67-K70 VanDerWaalsContact O-N 3.16Å; E67-K70 IonicContact OE2-NZ 3.37Å; E67-K70 PolarHBondContact OE2-NZ 3.44Å; S68-K70 VanDerWaalsContact C-N 3.32Å; S68-K70 PolarHBondContact O-N 3.04Å; K70-Q73 PolarHBondContact O-N 3.36Å; K70-L74 WeakPolarHBondContact O-CB 3.3Å; K70-L74 PolarHBondContact O-N 2.88Å
71	W	87	Confident	83.7	Confident	158 Å²	158	112.5 Å²	112.5	60%	0.598	52%	0.521	S	S	*	.	H	α-helix	trans	-62.5	-44.5	175.4	-78.1	105.8	0	0	0	111.6	E67 S68 R69 Q73 L74 V75	E67-W71 PolarHBondContact O-N 3.42Å; S68-W71 WeakPolarHBondContact O-CB 3.35Å; S68-W71 PolarHBondContact O-N 3.47Å; S68-W71 VanDerWaalsContact O-N 3.14Å; R69-W71 VanDerWaalsContact C-N 3.35Å; W71-Q73 VanDerWaalsContact C-N 3.34Å; W71-Q73 PolarHBondContact O-N 3.21Å; W71-L74 PolarHBondContact O-N 3.28Å; W71-V75 WeakPolarHBondContact O-CG2 3.4Å; W71-V75 PolarHBondContact O-N 2.85Å
72	D	89.1	Confident	82.5	Confident	101 Å²	101	115.9 Å²	115.9	54%	0.54	53%	0.53	S	S	.	.	H	α-helix	trans	-60.4	-43.4	176.5	-64.1	-30	0	0	0	111.5	S68 R69 L74 V75 E76	S68-D72 PolarHBondContact O-N 3.48Å; R69-D72 PolarHBondContact O-N 3.38Å; D72-L74 VanDerWaalsContact C-N 3.33Å; D72-L74 PolarHBondContact O-N 2.9Å; D72-V75 PolarHBondContact O-N 3.44Å; D72-E76 PolarHBondContact O-N 3.49Å
73	Q	87	Confident	80.5	Confident	116 Å²	116	116.3 Å²	116.3	54%	0.542	54%	0.538	S	S	.	.	H	α-helix	trans	-62	-39.3	174.9	-75.6	175.1	-3.9	0	0	112.7	R69 K70 W71 V75 E76 E77	R69-Q73 WeakPolarHBondContact O-CG 3.09Å; R69-Q73 PolarHBondContact O-N 2.91Å; K70-Q73 PolarHBondContact O-N 3.36Å; W71-Q73 VanDerWaalsContact C-N 3.34Å; W71-Q73 PolarHBondContact O-N 3.21Å; Q73-V75 VanDerWaalsContact C-N 3.33Å; Q73-E76 PolarHBondContact O-N 2.9Å; Q73-E77 WeakPolarHBondContact O-CB 3.48Å; Q73-E77 PolarHBondContact O-N 3Å
74	L	81.4	Confident	78.7	Confident	92 Å²	92	113.1 Å²	113.1	48%	0.482	54%	0.535	S	S	.	.	H	α-helix	trans	-68.4	-36.9	179.9	-144.8	155	0	0	0	110.9	K70 W71 D72 Y78	K70-L74 WeakPolarHBondContact O-CB 3.3Å; K70-L74 PolarHBondContact O-N 2.88Å; W71-L74 PolarHBondContact O-N 3.28Å; D72-L74 VanDerWaalsContact C-N 3.33Å; D72-L74 PolarHBondContact O-N 2.9Å; L74-Y78 WeakPolarHBondContact O-CB 3.48Å; L74-Y78 PolarHBondContact O-N 3.3Å
75	V	80.3	Confident	77.3	Confident	77 Å²	77	110.5 Å²	110.5	47%	0.467	55%	0.548	S	S	.	.	H	α-helix	trans	-65.6	-47.2	172.8	173	0	0	0	0	110.6	W71 D72 Q73 E77 Y78 E79	W71-V75 WeakPolarHBondContact O-CG2 3.4Å; W71-V75 PolarHBondContact O-N 2.85Å; D72-V75 PolarHBondContact O-N 3.44Å; Q73-V75 VanDerWaalsContact C-N 3.33Å; V75-E77 PolarHBondContact O-N 3.19Å; V75-Y78 CarbonylContact O-C 3.58Å; V75-Y78 WeakPolarHBondContact O-CB 3.27Å; V75-Y78 PolarHBondContact O-N 2.85Å; V75-Y78 VanDerWaalsContact O-N 3.1Å; V75-E79 HydrophobicContact CG1-CG 4.43Å; V75-E79 WeakPolarHBondContact O-CG 3.49Å; V75-E79 PolarHBondContact O-N 3.39Å
76	E	81.9	Confident	75.4	Confident	126 Å²	126	111.5 Å²	111.5	59%	0.589	56%	0.557	S	S	*	*	H	α-helix	trans	-63.2	-39.7	178.1	-168.7	178.8	-170.7	0	0	112.1	D72 Q73 Y78 E79 T80	D72-E76 PolarHBondContact O-N 3.49Å; Q73-E76 PolarHBondContact O-N 2.9Å; E76-Y78 VanDerWaalsContact C-N 3.3Å; E76-Y78 PolarHBondContact O-N 2.74Å; E76-E79 PolarHBondContact O-N 3.5Å; E76-T80 WeakPolarHBondContact O-CB 3.31Å; E76-T80 WeakPolarHBondContact O-CG2 3.35Å; E76-T80 PolarHBondContact O-N 3.43Å; E76-T80 PolarHBondContact O-OG1 3.44Å
77	E	79.8	Confident	73.4	Confident	94 Å²	94	115.1 Å²	115.1	44%	0.439	58%	0.577	S	S	.	*	H	α-helix	trans	-62.7	-38.2	172.9	-170.1	-176.5	172.3	0	0	111.4	Q73 V75 T80 R81	Q73-E77 WeakPolarHBondContact O-CB 3.48Å; Q73-E77 PolarHBondContact O-N 3Å; V75-E77 PolarHBondContact O-N 3.19Å; E77-T80 WeakPolarHBondContact CA-OG1 2.78Å; E77-T80 PolarHBondContact O-OG1 2.91Å; E77-R81 WeakPolarHBondContact O-CB 3.37Å; E77-R81 WeakPolarHBondContact O-CG 3.44Å; E77-R81 PolarHBondContact O-N 3.22Å; E77-R81 IonicContact OE1-CZ 2.69Å; E77-R81 IonicContact OE1-NE 3.95Å; E77-R81 PolarHBondContact OE1-NE 3.24Å; E77-R81 IonicContact OE1-NH2 2.7Å; E77-R81 PolarHBondContact OE1-NH2 3.44Å
78	Y	71.4	Confident	71.6	Confident	145 Å²	145	121.6 Å²	121.6	57%	0.569	60%	0.597	S	S	*	*	H	α-helix	trans	-70.4	-41.2	176.5	-137.1	-94.3	0	0	0	111.9	L74 V75 E76 R81 L82	L74-Y78 WeakPolarHBondContact O-CB 3.48Å; L74-Y78 PolarHBondContact O-N 3.3Å; V75-Y78 CarbonylContact O-C 3.58Å; V75-Y78 WeakPolarHBondContact O-CB 3.27Å; V75-Y78 PolarHBondContact O-N 2.85Å; V75-Y78 VanDerWaalsContact O-N 3.1Å; E76-Y78 VanDerWaalsContact C-N 3.3Å; E76-Y78 PolarHBondContact O-N 2.74Å; Y78-R81 PolarHBondContact O-N 3.08Å; Y78-L82 HydrophobicContact CD1-CD1 3.94Å; Y78-L82 HydrophobicContact CD1-CG 4.35Å; Y78-L82 WeakPolarHBondContact O-CB 3.2Å; Y78-L82 VanDerWaalsContact O-CG 3.25Å; Y78-L82 WeakPolarHBondContact O-CG 3.42Å; Y78-L82 PolarHBondContact O-N 3.38Å
79	E	75.3	Confident	70.2	Confident	116 Å²	116	124.8 Å²	124.8	54%	0.542	61%	0.608	S	S	.	*	H	α-helix	trans	-64.2	-42.9	176	-75	-175.4	172.1	0	0	111.6	V75 E76 R81 L82 I83	V75-E79 HydrophobicContact CG1-CG 4.43Å; V75-E79 WeakPolarHBondContact O-CG 3.49Å; V75-E79 PolarHBondContact O-N 3.39Å; E76-E79 PolarHBondContact O-N 3.5Å; E79-R81 VanDerWaalsContact C-N 3.35Å; E79-R81 PolarHBondContact O-N 3.48Å; E79-L82 CarbonylContact O-C 3.58Å; E79-L82 WeakPolarHBondContact O-CA 3.16Å; E79-L82 WeakPolarHBondContact O-CB 3.49Å; E79-L82 PolarHBondContact O-N 2.95Å; E79-L82 VanDerWaalsContact O-N 3.08Å; E79-I83 WeakPolarHBondContact O-CG1 3.31Å; E79-I83 PolarHBondContact O-N 3.28Å; E79-I83 VanDerWaalsContact O-N 3.15Å
80	T	72.8	Confident	69	Low	84 Å²	84	125.6 Å²	125.6	52%	0.515	62%	0.623	S	S	.	*	H	α-helix	trans	-65.6	-36.7	175.1	50.8	0	0	0	0	112.2	E76 E77 L82 I83	E76-T80 WeakPolarHBondContact O-CB 3.31Å; E76-T80 WeakPolarHBondContact O-CG2 3.35Å; E76-T80 PolarHBondContact O-N 3.43Å; E76-T80 PolarHBondContact O-OG1 3.44Å; E77-T80 WeakPolarHBondContact CA-OG1 2.78Å; E77-T80 PolarHBondContact O-OG1 2.91Å; T80-L82 VanDerWaalsContact C-N 3.28Å; T80-L82 PolarHBondContact O-N 3Å; T80-I83 CarbonylContact O-C 3.52Å; T80-I83 PolarHBondContact O-N 2.95Å
81	R	65.6	Low	67.9	Low	159 Å²	159	125.8 Å²	125.8	60%	0.6	63%	0.627	S	S	*	*	H	α-helix	trans	-67.6	-25.7	170.4	-74.8	173.7	-177.3	-168.5	0.9	113.5	E77 Y78 E79 I83 P84	E77-R81 WeakPolarHBondContact O-CB 3.37Å; E77-R81 WeakPolarHBondContact O-CG 3.44Å; E77-R81 PolarHBondContact O-N 3.22Å; E77-R81 IonicContact OE1-CZ 2.69Å; E77-R81 IonicContact OE1-NE 3.95Å; E77-R81 PolarHBondContact OE1-NE 3.24Å; E77-R81 IonicContact OE1-NH2 2.7Å; E77-R81 PolarHBondContact OE1-NH2 3.44Å; Y78-R81 PolarHBondContact O-N 3.08Å; E79-R81 VanDerWaalsContact C-N 3.35Å; E79-R81 PolarHBondContact O-N 3.48Å; R81-I83 VanDerWaalsContact C-N 3.3Å; R81-P84 VanDerWaalsContact O-CD 3.24Å; R81-P84 WeakPolarHBondContact O-CD 3.36Å; R81-P84 WeakPolarHBondContact O-CG 3.38Å
82	L	58.9	Low	67.1	Low	126 Å²	126	120.5 Å²	120.5	66%	0.66	61%	0.613	S	S	*	*	H	α-helix	trans	-80.4	-11.1	174.1	-74.9	165.7	0	0	0	112.8	Y78 E79 T80 P84	Y78-L82 HydrophobicContact CD1-CD1 3.94Å; Y78-L82 HydrophobicContact CD1-CG 4.35Å; Y78-L82 WeakPolarHBondContact O-CB 3.2Å; Y78-L82 VanDerWaalsContact O-CG 3.25Å; Y78-L82 WeakPolarHBondContact O-CG 3.42Å; Y78-L82 PolarHBondContact O-N 3.38Å; E79-L82 CarbonylContact O-C 3.58Å; E79-L82 WeakPolarHBondContact O-CA 3.16Å; E79-L82 WeakPolarHBondContact O-CB 3.49Å; E79-L82 PolarHBondContact O-N 2.95Å; E79-L82 VanDerWaalsContact O-N 3.08Å; T80-L82 VanDerWaalsContact C-N 3.28Å; T80-L82 PolarHBondContact O-N 3Å; L82-P84 WeakPolarHBondContact O-CD 3.48Å
83	I	49.1	Very low	66.7	Low	144 Å²	144	119 Å²	119	74%	0.738	61%	0.611	S	S	*	*			trans	-110.6	73.7	170.2	-48.4	167.8	0	0	0	111.1	E79 T80 R81	E79-I83 WeakPolarHBondContact O-CG1 3.31Å; E79-I83 PolarHBondContact O-N 3.28Å; E79-I83 VanDerWaalsContact O-N 3.15Å; T80-I83 CarbonylContact O-C 3.52Å; T80-I83 PolarHBondContact O-N 2.95Å; R81-I83 VanDerWaalsContact C-N 3.3Å
84	P	50	Low	66.2	Low	74 Å²	74	117.8 Å²	117.8	48%	0.481	61%	0.605	S	S	.	*			trans	-107.3	130.6	159.8	6.5	16	0	0	0	110.9	R81 L82 D86	R81-P84 VanDerWaalsContact O-CD 3.24Å; R81-P84 WeakPolarHBondContact O-CD 3.36Å; R81-P84 WeakPolarHBondContact O-CG 3.38Å; L82-P84 WeakPolarHBondContact O-CD 3.48Å; P84-D86 PolarHBondContact O-N 2.91Å
85	A	55.6	Low	66.3	Low	112 Å²	112	120.7 Å²	120.7	93%	0.926	62%	0.616	S	S	*	*	S	Bend	trans	-70.7	14.1	178.9	0	0	0	0	0	115.1
86	D	50.2	Low	66.3	Low	145 Å²	145	123 Å²	123	78%	0.775	62%	0.616	S	S	*	*	S	Bend	trans	-137.6	87.6	-179.1	-124	-20.8	0	0	0	108.5	P84 R88	P84-D86 PolarHBondContact O-N 2.91Å; D86-R88 PolarHBondContact O-N 3.31Å
87	N	48.4	Very low	66.2	Low	146 Å²	146	117.1 Å²	117.1	78%	0.781	59%	0.589	S	S	*	*			trans	-68.5	63.9	-173.3	-84.2	-19.1	0	0	0	113	I89	N87-I89 PolarHBondContact O-N 3.09Å
88	R	52.9	Low	66.1	Low	224 Å²	224	117.3 Å²	117.3	85%	0.845	59%	0.588	S	S	*	*			trans	-89.7	87.5	150.3	-66.2	-170.8	-178.8	-164.4	0.5	106.1	D86 D90	D86-R88 PolarHBondContact O-N 3.31Å; R88-D90 PolarHBondContact O-N 3.29Å
89	I	57.8	Low	66.6	Low	129 Å²	129	115.8 Å²	115.8	66%	0.662	59%	0.594	S	S	*	*			trans	-57.3	114.6	162.9	-61.5	169.7	0	0	0	104.7	N87 M91	N87-I89 PolarHBondContact O-N 3.09Å; I89-M91 HydrophobicContact CG2-CE 3.71Å; I89-M91 PolarHBondContact O-N 3.45Å
90	D	66.4	Low	66.8	Low	155 Å²	155	112.7 Å²	112.7	83%	0.829	58%	0.581	S	S	*	*			trans	-65.2	83.3	171.6	-79.6	-27.2	0	0	0	107.4	R88	R88-D90 PolarHBondContact O-N 3.29Å
91	M	64.4	Low	67.1	Low	118 Å²	118	119.6 Å²	119.6	58%	0.581	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-61.3	134.1	171.7	-94.5	-66.6	103.4	0	0	108.1	I89 I110	I89-M91 HydrophobicContact CG2-CE 3.71Å; I89-M91 PolarHBondContact O-N 3.45Å; M91-I110 HydrophobicContact SD-CG2 3.97Å
92	P	71.9	Confident	67.5	Low	48 Å²	48	116.7 Å²	116.7	31%	0.312	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-55.6	148.8	171.8	23.5	-32.2	0	0	0	109.7	W96 I97	P92-W96 HydrophobicContact CB-CB 4.38Å; P92-W96 HydrophobicContact CB-CD2 3.92Å; P92-W96 HydrophobicContact CB-CE3 3.32Å; P92-W96 HydrophobicContact CB-CG 4.38Å; P92-W96 HydrophobicContact CB-CZ3 3.83Å; P92-W96 HydrophobicContact CG-CE3 3.76Å; P92-W96 HydrophobicContact CG-CZ3 3.86Å; P92-I97 HydrophobicContact CB-CG1 4.36Å; P92-I97 HydrophobicContact CG-CD1 4.18Å; P92-I97 HydrophobicContact CG-CG1 3.91Å
93	S	79.4	Confident	68.3	Low	70 Å²	70	112 Å²	112	49%	0.49	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-58.5	149.9	177.8	67.4	0	0	0	0	110.6	E95 W96 I97	S93-E95 PolarHBondContact O-N 2.89Å; S93-W96 WeakPolarHBondContact O-CA 3.34Å; S93-W96 WeakPolarHBondContact O-CB 3.48Å; S93-W96 PolarHBondContact O-N 2.93Å; S93-W96 WeakPolarHBondContact OG-CB 3.45Å; S93-W96 PolarHBondContact OG-N 3.09Å; S93-I97 PolarHBondContact O-N 2.87Å
94	E	76.9	Confident	69.6	Low	89 Å²	89	113 Å²	113	42%	0.416	57%	0.569	S	S	.	*	H	α-helix	trans	-55.6	-37.4	178.2	-164.7	-164.8	141.1	0	0	112.4	W96 I97 K98 K114	E94-W96 VanDerWaalsContact C-N 3.31Å; E94-W96 PolarHBondContact O-N 2.94Å; E94-I97 PolarHBondContact O-N 3.2Å; E94-K98 WeakPolarHBondContact O-CG 3.26Å; E94-K98 PolarHBondContact O-N 2.66Å; E94-K98 VanDerWaalsContact OE1-CE 3.3Å; E94-K98 WeakPolarHBondContact OE1-CE 3.49Å; E94-K98 IonicContact OE1-NZ 3.54Å; E94-K98 PolarHBondContact OE1-NZ 2.81Å; E94-K114 VanDerWaalsContact CG-CE 3.48Å; E94-K114 WeakPolarHBondContact OE1-CE 3.43Å; E94-K114 IonicContact OE1-NZ 3.54Å; E94-K114 PolarHBondContact OE1-NZ 3.42Å; E94-K114 IonicContact OE2-NZ 3.56Å
95	E	82.8	Confident	70.9	Confident	154 Å²	154	115 Å²	115	72%	0.72	57%	0.57	S	S	*	*	H	α-helix	trans	-63	-37.3	175.7	-62.8	179.3	171.6	0	0	112.1	S93 K98 T99	S93-E95 PolarHBondContact O-N 2.89Å; E95-K98 PolarHBondContact O-N 3.43Å; E95-T99 WeakPolarHBondContact O-CG2 3.34Å; E95-T99 PolarHBondContact O-N 3.45Å; E95-T99 VanDerWaalsContact O-N 3.17Å; E95-T99 PolarHBondContact O-OG1 3.22Å
96	W	81.3	Confident	71.8	Confident	125 Å²	125	113 Å²	113	47%	0.473	54%	0.539	S	S	.	.	H	α-helix	trans	-68.6	-43.5	176	-173.3	89.8	0	0	0	111.4	P92 S93 E94 K98 T99 D100 T103	P92-W96 HydrophobicContact CB-CB 4.38Å; P92-W96 HydrophobicContact CB-CD2 3.92Å; P92-W96 HydrophobicContact CB-CE3 3.32Å; P92-W96 HydrophobicContact CB-CG 4.38Å; P92-W96 HydrophobicContact CB-CZ3 3.83Å; P92-W96 HydrophobicContact CG-CE3 3.76Å; P92-W96 HydrophobicContact CG-CZ3 3.86Å; S93-W96 WeakPolarHBondContact O-CA 3.34Å; S93-W96 WeakPolarHBondContact O-CB 3.48Å; S93-W96 PolarHBondContact O-N 2.93Å; S93-W96 WeakPolarHBondContact OG-CB 3.45Å; S93-W96 PolarHBondContact OG-N 3.09Å; E94-W96 VanDerWaalsContact C-N 3.31Å; E94-W96 PolarHBondContact O-N 2.94Å; W96-K98 VanDerWaalsContact C-N 3.26Å; W96-K98 PolarHBondContact O-N 2.79Å; W96-T99 WeakPolarHBondContact CA-OG1 3.18Å; W96-T99 PolarHBondContact O-N 3.39Å; W96-T99 VanDerWaalsContact O-N 3.12Å; W96-T99 PolarHBondContact O-OG1 3.5Å; W96-D100 HydrophobicContact CH2-CB 4.39Å; W96-D100 HydrophobicContact CZ2-CB 4.38Å; W96-D100 HydrophobicContact CZ3-CB 4.49Å; W96-D100 PolarHBondContact O-N 3.31Å; W96-T103 HydrophobicContact CH2-CG2 4.02Å; W96-T103 HydrophobicContact CZ3-CG2 3.62Å
97	I	78.4	Confident	73.1	Confident	2 Å²	2	107.6 Å²	107.6	1%	0.01	51%	0.509	C	S	.	.	H	α-helix	trans	-59.4	-39.6	177	-63.3	164.8	0	0	0	110.9	P92 S93 E94 T99 T103 R104 E107 I110	P92-I97 HydrophobicContact CB-CG1 4.36Å; P92-I97 HydrophobicContact CG-CD1 4.18Å; P92-I97 HydrophobicContact CG-CG1 3.91Å; S93-I97 PolarHBondContact O-N 2.87Å; E94-I97 PolarHBondContact O-N 3.2Å; I97-T99 PolarHBondContact O-N 3Å; I97-T103 PolarHBondContact O-OG1 3.06Å; I97-R104 WeakPolarHBondContact O-CA 3.41Å; I97-R104 PolarHBondContact O-N 3.4Å; I97-E107 HydrophobicContact CG2-CB 4.17Å; I97-E107 HydrophobicContact CG2-CG 4.08Å; I97-I110 HydrophobicContact CD1-CG2 3.57Å; I97-I110 HydrophobicContact CG1-CG2 4.48Å; I97-I110 HydrophobicContact CG2-CD1 4.38Å
98	K	78.6	Confident	74.2	Confident	98 Å²	98	104.7 Å²	104.7	43%	0.426	49%	0.494	S	S	.	.	H	α-helix	trans	-68.8	-30.7	177.9	-77.5	171.6	167.4	168.5	0	113.8	E94 E95 W96 E107	E94-K98 WeakPolarHBondContact O-CG 3.26Å; E94-K98 PolarHBondContact O-N 2.66Å; E94-K98 VanDerWaalsContact OE1-CE 3.3Å; E94-K98 WeakPolarHBondContact OE1-CE 3.49Å; E94-K98 IonicContact OE1-NZ 3.54Å; E94-K98 PolarHBondContact OE1-NZ 2.81Å; E95-K98 PolarHBondContact O-N 3.43Å; W96-K98 VanDerWaalsContact C-N 3.26Å; W96-K98 PolarHBondContact O-N 2.79Å; K98-E107 VanDerWaalsContact CE-OE1 3.32Å; K98-E107 WeakPolarHBondContact CE-OE1 3.42Å
99	T	82.7	Confident	75.1	Confident	114 Å²	114	96.2 Å²	96.2	70%	0.699	47%	0.465	S	S	*	.	H	α-helix	trans	-87.4	-30.9	-176.9	48.8	0	0	0	0	112.8	E95 W96 I97	E95-T99 WeakPolarHBondContact O-CG2 3.34Å; E95-T99 PolarHBondContact O-N 3.45Å; E95-T99 VanDerWaalsContact O-N 3.17Å; E95-T99 PolarHBondContact O-OG1 3.22Å; W96-T99 WeakPolarHBondContact CA-OG1 3.18Å; W96-T99 PolarHBondContact O-N 3.39Å; W96-T99 VanDerWaalsContact O-N 3.12Å; W96-T99 PolarHBondContact O-OG1 3.5Å; I97-T99 PolarHBondContact O-N 3Å
100	D	79.2	Confident	75.7	Confident	51 Å²	51	92.9 Å²	92.9	27%	0.273	45%	0.447	S	S	.	.			trans	-77.5	132.5	177.4	177.9	72.1	0	0	0	112.4	W96 V102 T103 R104	W96-D100 HydrophobicContact CH2-CB 4.39Å; W96-D100 HydrophobicContact CZ2-CB 4.38Å; W96-D100 HydrophobicContact CZ3-CB 4.49Å; W96-D100 PolarHBondContact O-N 3.31Å; D100-V102 VanDerWaalsContact C-N 3.31Å; D100-V102 PolarHBondContact O-N 2.94Å; D100-V102 WeakPolarHBondContact OD2-CA 3.36Å; D100-V102 WeakPolarHBondContact OD2-CB 3.38Å; D100-V102 PolarHBondContact OD2-N 3.43Å; D100-T103 WeakPolarHBondContact CB-OG1 3.42Å; D100-T103 PolarHBondContact OD2-N 2.95Å; D100-T103 PolarHBondContact OD2-OG1 3.44Å; D100-R104 WeakPolarHBondContact O-CB 3.14Å; D100-R104 PolarHBondContact O-N 3.16Å
101	R	78.7	Confident	76	Confident	229 Å²	229	86.8 Å²	86.8	86%	0.864	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-28.9	-173.6	-174.9	178.8	175.6	-169.7	0.5	112.7
102	V	74.2	Confident	76.1	Confident	97 Å²	97	82.7 Å²	82.7	59%	0.588	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-49.9	-175.9	-179.4	0	0	0	0	109.4	D100 K105 Y106	D100-V102 VanDerWaalsContact C-N 3.31Å; D100-V102 PolarHBondContact O-N 2.94Å; D100-V102 WeakPolarHBondContact OD2-CA 3.36Å; D100-V102 WeakPolarHBondContact OD2-CB 3.38Å; D100-V102 PolarHBondContact OD2-N 3.43Å; V102-K105 WeakPolarHBondContact O-CB 3.46Å; V102-K105 PolarHBondContact O-N 3.13Å; V102-Y106 VanDerWaalsContact O-CD2 3.27Å; V102-Y106 WeakPolarHBondContact O-CD2 3.47Å
103	T	76.1	Confident	75.8	Confident	28 Å²	28	87.5 Å²	87.5	17%	0.172	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-71.5	-32.9	-178.2	61.8	0	0	0	0	112.5	W96 I97 D100 K105 Y106 E107	W96-T103 HydrophobicContact CH2-CG2 4.02Å; W96-T103 HydrophobicContact CZ3-CG2 3.62Å; I97-T103 PolarHBondContact O-OG1 3.06Å; D100-T103 WeakPolarHBondContact CB-OG1 3.42Å; D100-T103 PolarHBondContact OD2-N 2.95Å; D100-T103 PolarHBondContact OD2-OG1 3.44Å; T103-K105 PolarHBondContact O-N 2.82Å; T103-Y106 CarbonylContact O-C 3.3Å; T103-Y106 VanDerWaalsContact O-C 3.3Å; T103-Y106 WeakPolarHBondContact O-CA 3.34Å; T103-Y106 PolarHBondContact O-N 3.18Å; T103-E107 PolarHBondContact O-N 3.14Å; T103-E107 VanDerWaalsContact O-N 3.1Å
104	R	76.1	Confident	75.1	Confident	166 Å²	166	87.4 Å²	87.4	63%	0.626	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-55	-34	171	-177.3	178.9	177.1	-175.6	1	113.3	I97 D100 Y106 E107	I97-R104 WeakPolarHBondContact O-CA 3.41Å; I97-R104 PolarHBondContact O-N 3.4Å; D100-R104 WeakPolarHBondContact O-CB 3.14Å; D100-R104 PolarHBondContact O-N 3.16Å; R104-Y106 PolarHBondContact O-N 2.98Å; R104-E107 WeakPolarHBondContact O-CB 3.34Å; R104-E107 PolarHBondContact O-N 2.83Å
105	K	76.4	Confident	74.4	Confident	116 Å²	116	87.6 Å²	87.6	50%	0.504	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-61.3	-28.8	176.5	-170.4	-161.1	159.6	-143.2	0	111.2	V102 T103 E139	V102-K105 WeakPolarHBondContact O-CB 3.46Å; V102-K105 PolarHBondContact O-N 3.13Å; T103-K105 PolarHBondContact O-N 2.82Å; K105-E139 IonicContact NZ-OE1 2.65Å; K105-E139 PolarHBondContact NZ-OE1 3.03Å; K105-E139 VanDerWaalsContact NZ-OE1 3.07Å
106	Y	74.2	Confident	73.6	Confident	70 Å²	70	83 Å²	83	28%	0.275	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-111.7	19.3	-176.2	-53.9	-71.3	0	0	0	111.7	V102 T103 R104 D108 I109 I110 E139	V102-Y106 VanDerWaalsContact O-CD2 3.27Å; V102-Y106 WeakPolarHBondContact O-CD2 3.47Å; T103-Y106 CarbonylContact O-C 3.3Å; T103-Y106 VanDerWaalsContact O-C 3.3Å; T103-Y106 WeakPolarHBondContact O-CA 3.34Å; T103-Y106 PolarHBondContact O-N 3.18Å; R104-Y106 PolarHBondContact O-N 2.98Å; Y106-D108 PolarHBondContact O-N 3.35Å; Y106-I109 HydrophobicContact CD1-CD1 4.19Å; Y106-I109 WeakPolarHBondContact O-CB 3.43Å; Y106-I109 PolarHBondContact O-N 3.37Å; Y106-I110 VanDerWaalsContact O-CG1 3.26Å; Y106-I110 WeakPolarHBondContact O-CG1 3.47Å; Y106-I110 PolarHBondContact O-N 3.17Å; Y106-E139 HydrophobicContact CE1-CG 4.14Å
107	E	78.2	Confident	73.1	Confident	30 Å²	30	84.6 Å²	84.6	14%	0.14	40%	0.401	C	S	.	.	H	α-helix	trans	-56.5	-40.4	-177.7	-176.5	176.8	-179.6	0	0	111.7	I97 K98 T103 R104 I109 I110 C111 K114	I97-E107 HydrophobicContact CG2-CB 4.17Å; I97-E107 HydrophobicContact CG2-CG 4.08Å; K98-E107 VanDerWaalsContact CE-OE1 3.32Å; K98-E107 WeakPolarHBondContact CE-OE1 3.42Å; T103-E107 PolarHBondContact O-N 3.14Å; T103-E107 VanDerWaalsContact O-N 3.1Å; R104-E107 WeakPolarHBondContact O-CB 3.34Å; R104-E107 PolarHBondContact O-N 2.83Å; E107-I109 PolarHBondContact O-N 3.37Å; E107-I110 PolarHBondContact O-N 3.26Å; E107-C111 PolarHBondContact O-N 2.86Å; E107-K114 IonicContact OE1-NZ 3.92Å; E107-K114 PolarHBondContact OE1-NZ 2.9Å
108	D	71.1	Confident	72.7	Confident	86 Å²	86	88.2 Å²	88.2	46%	0.46	43%	0.426	S	S	.	.	H	α-helix	trans	-65	-30.6	179.7	-56.5	-27.3	0	0	0	112.7	Y106 P112 Y115	Y106-D108 PolarHBondContact O-N 3.35Å; D108-P112 WeakPolarHBondContact O-CA 3.39Å; D108-Y115 HydrophobicContact CB-CE2 4.13Å; D108-Y115 WeakPolarHBondContact OD1-CE2 3.41Å; D108-Y115 VanDerWaalsContact OD1-CZ 3.24Å; D108-Y115 PolarHBondContact OD1-OH 3.11Å
109	I	71.1	Confident	72.3	Confident	46 Å²	46	86.9 Å²	86.9	24%	0.236	42%	0.419	C	S	.	.	H	α-helix	trans	-79	-40.1	176.1	-74.5	174.1	0	0	0	111.2	Y106 E107 T132 D135 I136	Y106-I109 HydrophobicContact CD1-CD1 4.19Å; Y106-I109 WeakPolarHBondContact O-CB 3.43Å; Y106-I109 PolarHBondContact O-N 3.37Å; E107-I109 PolarHBondContact O-N 3.37Å; I109-T132 HydrophobicContact CG1-CG2 4.42Å; I109-D135 HydrophobicContact CD1-CB 4.27Å; I109-I136 HydrophobicContact CB-CG1 4.2Å; I109-I136 HydrophobicContact CD1-CG1 4.19Å; I109-I136 HydrophobicContact CG1-CG1 4Å; I109-I136 HydrophobicContact CG2-CD1 3.84Å; I109-I136 HydrophobicContact CG2-CG1 3.36Å
110	I	72.2	Confident	72.1	Confident	59 Å²	59	89.6 Å²	89.6	30%	0.303	43%	0.429	S	S	.	.	H	α-helix	trans	-78.2	-35.4	-175.5	-61.9	163.2	0	0	0	110.9	M91 I97 Y106 E107 P112	M91-I110 HydrophobicContact SD-CG2 3.97Å; I97-I110 HydrophobicContact CD1-CG2 3.57Å; I97-I110 HydrophobicContact CG1-CG2 4.48Å; I97-I110 HydrophobicContact CG2-CD1 4.38Å; Y106-I110 VanDerWaalsContact O-CG1 3.26Å; Y106-I110 WeakPolarHBondContact O-CG1 3.47Å; Y106-I110 PolarHBondContact O-N 3.17Å; E107-I110 PolarHBondContact O-N 3.26Å; I110-P112 VanDerWaalsContact C-CD 3.46Å
111	C	71.6	Confident	72.2	Confident	26 Å²	26	89.7 Å²	89.7	18%	0.176	43%	0.434	C	S	.	.			trans	-127.1	59.2	-177	-62.7	0	0	0	0	112.5	E107 Q113 K114	E107-C111 PolarHBondContact O-N 2.86Å; C111-Q113 PolarHBondContact O-N 3.35Å; C111-Q113 VanDerWaalsContact O-N 3.13Å; C111-K114 HydrophobicContact CB-CD 4.22Å; C111-K114 HydrophobicContact CB-CG 4.46Å; C111-K114 PolarHBondContact O-N 3.3Å
112	P	66.7	Low	72.3	Confident	32 Å²	32	85.3 Å²	85.3	21%	0.208	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.8	-178.4	27.3	-35	0	0	0	112.2	D108 I110 K114 Y115 F116	D108-P112 WeakPolarHBondContact O-CA 3.39Å; I110-P112 VanDerWaalsContact C-CD 3.46Å; P112-K114 PolarHBondContact O-N 3.17Å; P112-K114 VanDerWaalsContact O-N 3.09Å; P112-Y115 PolarHBondContact O-N 3.38Å; P112-F116 HydrophobicContact CB-CE1 4.22Å; P112-F116 HydrophobicContact CB-CE2 4.49Å; P112-F116 HydrophobicContact CB-CZ 3.81Å; P112-F116 HydrophobicContact CG-CZ 4.14Å
113	Q	66.1	Low	72.8	Confident	150 Å²	150	86.4 Å²	86.4	70%	0.701	43%	0.43	S	S	*	.	H	α-helix	trans	-54.4	-29.9	-179.8	-73.5	-179	-10.5	0	0	114.6	C111 Y115 F116	C111-Q113 PolarHBondContact O-N 3.35Å; C111-Q113 VanDerWaalsContact O-N 3.13Å; Q113-Y115 PolarHBondContact O-N 3.09Å; Q113-Y115 VanDerWaalsContact O-N 3.16Å; Q113-F116 VanDerWaalsContact CA-CD2 3.41Å; Q113-F116 HydrophobicContact CB-CD2 4.07Å; Q113-F116 HydrophobicContact CB-CE2 4.27Å; Q113-F116 HydrophobicContact CG-CD2 3.77Å; Q113-F116 HydrophobicContact CG-CE2 3.66Å; Q113-F116 PolarHBondContact O-N 3.49Å; Q113-F116 VanDerWaalsContact O-N 3.1Å
114	K	65.3	Low	73	Confident	68 Å²	68	86.8 Å²	86.8	30%	0.296	43%	0.433	S	S	.	.	H	α-helix	trans	-61.2	-25.1	177.9	-68.5	176.8	-177.3	175.6	0	113.5	E94 E107 C111 P112	E94-K114 VanDerWaalsContact CG-CE 3.48Å; E94-K114 WeakPolarHBondContact OE1-CE 3.43Å; E94-K114 IonicContact OE1-NZ 3.54Å; E94-K114 PolarHBondContact OE1-NZ 3.42Å; E94-K114 IonicContact OE2-NZ 3.56Å; E107-K114 IonicContact OE1-NZ 3.92Å; E107-K114 PolarHBondContact OE1-NZ 2.9Å; C111-K114 HydrophobicContact CB-CD 4.22Å; C111-K114 HydrophobicContact CB-CG 4.46Å; C111-K114 PolarHBondContact O-N 3.3Å; P112-K114 PolarHBondContact O-N 3.17Å; P112-K114 VanDerWaalsContact O-N 3.09Å
115	Y	62.2	Low	73	Confident	92 Å²	92	80.7 Å²	80.7	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-97	-11.7	-179.5	-54.6	-69.1	0	0	0	112.2	D108 P112 Q113 D117 S118 Y119	D108-Y115 HydrophobicContact CB-CE2 4.13Å; D108-Y115 WeakPolarHBondContact OD1-CE2 3.41Å; D108-Y115 VanDerWaalsContact OD1-CZ 3.24Å; D108-Y115 PolarHBondContact OD1-OH 3.11Å; P112-Y115 PolarHBondContact O-N 3.38Å; Q113-Y115 PolarHBondContact O-N 3.09Å; Q113-Y115 VanDerWaalsContact O-N 3.16Å; Y115-D117 VanDerWaalsContact C-N 3.3Å; Y115-D117 PolarHBondContact O-N 2.81Å; Y115-S118 PolarHBondContact O-N 3.16Å; Y115-S118 PolarHBondContact O-OG 2.84Å; Y115-Y119 WeakPolarHBondContact O-CD2 3.46Å; Y115-Y119 WeakPolarHBondContact O-CE2 3.38Å
116	F	66.2	Low	73.2	Confident	57 Å²	57	77.6 Å²	77.6	25%	0.25	41%	0.409	C	S	.	.	H	α-helix	trans	-64.4	-35.3	-178.8	-65.6	-22.8	0	0	0	113.1	P112 Q113 S118 Y119 L125 L129	P112-F116 HydrophobicContact CB-CE1 4.22Å; P112-F116 HydrophobicContact CB-CE2 4.49Å; P112-F116 HydrophobicContact CB-CZ 3.81Å; P112-F116 HydrophobicContact CG-CZ 4.14Å; Q113-F116 VanDerWaalsContact CA-CD2 3.41Å; Q113-F116 HydrophobicContact CB-CD2 4.07Å; Q113-F116 HydrophobicContact CB-CE2 4.27Å; Q113-F116 HydrophobicContact CG-CD2 3.77Å; Q113-F116 HydrophobicContact CG-CE2 3.66Å; Q113-F116 PolarHBondContact O-N 3.49Å; Q113-F116 VanDerWaalsContact O-N 3.1Å; F116-S118 PolarHBondContact O-N 2.82Å; F116-Y119 HydrophobicContact CD1-CD2 4.38Å; F116-Y119 HydrophobicContact CD1-CE2 4.08Å; F116-L125 HydrophobicContact CB-CD1 4.21Å; F116-L125 HydrophobicContact CD1-CD1 2.97Å; F116-L125 HydrophobicContact CD1-CG 4.44Å; F116-L125 HydrophobicContact CE1-CD1 3.37Å; F116-L125 HydrophobicContact CG-CD1 3.7Å; F116-L125 HydrophobicContact CZ-CD1 4.39Å; F116-L129 HydrophobicContact CE1-CD1 4.45Å; F116-L129 HydrophobicContact CE1-CD2 3.62Å; F116-L129 HydrophobicContact CE1-CG 3.87Å; F116-L129 HydrophobicContact CZ-CD2 3.39Å; F116-L129 HydrophobicContact CZ-CG 4.11Å
117	D	69	Low	73.5	Confident	160 Å²	160	79.1 Å²	79.1	86%	0.856	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-12.8	177.1	-66.5	-22.9	0	0	0	113.1	Y115	Y115-D117 VanDerWaalsContact C-N 3.3Å; Y115-D117 PolarHBondContact O-N 2.81Å
118	S	70.6	Confident	73.5	Confident	77 Å²	77	78.8 Å²	78.8	54%	0.538	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-1.4	-178.4	65.6	0	0	0	0	114.9	Y115 F116	Y115-S118 PolarHBondContact O-N 3.16Å; Y115-S118 PolarHBondContact O-OG 2.84Å; F116-S118 PolarHBondContact O-N 2.82Å
119	Y	69.6	Low	73.9	Confident	70 Å²	70	78.5 Å²	78.5	28%	0.275	42%	0.421	S	S	.	.			trans	-90.7	126.7	-176.6	-68.2	-62.9	0	0	0	112.4	Y115 F116 S121 L125 S128	Y115-Y119 WeakPolarHBondContact O-CD2 3.46Å; Y115-Y119 WeakPolarHBondContact O-CE2 3.38Å; F116-Y119 HydrophobicContact CD1-CD2 4.38Å; F116-Y119 HydrophobicContact CD1-CE2 4.08Å; Y119-S121 PolarHBondContact O-N 3.35Å; Y119-L125 HydrophobicContact CD2-CB 4.08Å; Y119-L125 HydrophobicContact CD2-CD1 3.77Å; Y119-L125 HydrophobicContact CE2-CD1 4.1Å; Y119-L125 HydrophobicContact CG-CB 4.24Å; Y119-S128 VanDerWaalsContact CZ-CB 3.41Å; Y119-S128 WeakPolarHBondContact OH-CB 3.43Å; Y119-S128 PolarHBondContact OH-OG 3.12Å
120	D	79.9	Confident	74.4	Confident	171 Å²	171	80.9 Å²	80.9	91%	0.914	43%	0.434	S	S	*	.	S	Bend	trans	-69.7	-19	179.1	-66.2	-36.8	0	0	0	113
121	S	81.5	Confident	74.8	Confident	54 Å²	54	82.9 Å²	82.9	38%	0.378	45%	0.445	S	S	.	.	S	Bend	trans	-148.9	158.6	-175.5	73.3	0	0	0	0	113.5	Y119 D123 S124 L125	Y119-S121 PolarHBondContact O-N 3.35Å; S121-D123 VanDerWaalsContact C-N 3.27Å; S121-D123 PolarHBondContact O-N 3.46Å; S121-S124 PolarHBondContact N-OG 2.96Å; S121-S124 PolarHBondContact O-N 3.02Å; S121-S124 PolarHBondContact O-OG 3.38Å; S121-S124 PolarHBondContact OG-N 3.17Å; S121-S124 VanDerWaalsContact OG-N 3.11Å; S121-S124 PolarHBondContact OG-OG 3.1Å; S121-L125 PolarHBondContact O-N 2.85Å
122	L	80.7	Confident	75.1	Confident	136 Å²	136	82.7 Å²	82.7	71%	0.712	44%	0.443	S	S	*	.	H	α-helix	trans	-63.6	-34	173.5	-172.1	66.6	0	0	0	111.9	L125 A126	L122-L125 HydrophobicContact CD1-CD2 4.22Å; L122-L125 WeakPolarHBondContact O-CB 3.45Å; L122-L125 PolarHBondContact O-N 2.89Å; L122-A126 WeakPolarHBondContact O-CB 3.46Å; L122-A126 PolarHBondContact O-N 3.21Å
123	D	83.1	Confident	75.7	Confident	120 Å²	120	86.5 Å²	86.5	64%	0.642	46%	0.458	S	S	*	.	H	α-helix	trans	-66.6	-45.5	178.8	-64.4	-27.2	0	0	0	110.8	S121 L125 A126 D127	S121-D123 VanDerWaalsContact C-N 3.27Å; S121-D123 PolarHBondContact O-N 3.46Å; D123-L125 VanDerWaalsContact C-N 3.26Å; D123-L125 PolarHBondContact O-N 2.97Å; D123-A126 PolarHBondContact O-N 3.07Å; D123-A126 VanDerWaalsContact O-N 3.11Å; D123-D127 PolarHBondContact O-N 3.01Å
124	S	80.6	Confident	76.6	Confident	36 Å²	36	83 Å²	83	25%	0.252	44%	0.444	S	S	.	.	H	α-helix	trans	-61.9	-34.2	174.7	50.4	0	0	0	0	113.2	S121 S128	S121-S124 PolarHBondContact N-OG 2.96Å; S121-S124 PolarHBondContact O-N 3.02Å; S121-S124 PolarHBondContact O-OG 3.38Å; S121-S124 PolarHBondContact OG-N 3.17Å; S121-S124 VanDerWaalsContact OG-N 3.11Å; S121-S124 PolarHBondContact OG-OG 3.1Å; S124-S128 WeakPolarHBondContact O-CB 3.4Å; S124-S128 PolarHBondContact O-N 3.35Å; S124-S128 VanDerWaalsContact O-N 3.08Å
125	L	77.2	Confident	77.3	Confident	39 Å²	39	84.2 Å²	84.2	20%	0.204	45%	0.454	C	S	.	.	H	α-helix	trans	-66.9	-43.8	174	170.6	61.3	0	0	0	111.1	F116 Y119 S121 L122 D123 S128 L129	F116-L125 HydrophobicContact CB-CD1 4.21Å; F116-L125 HydrophobicContact CD1-CD1 2.97Å; F116-L125 HydrophobicContact CD1-CG 4.44Å; F116-L125 HydrophobicContact CE1-CD1 3.37Å; F116-L125 HydrophobicContact CG-CD1 3.7Å; F116-L125 HydrophobicContact CZ-CD1 4.39Å; Y119-L125 HydrophobicContact CD2-CB 4.08Å; Y119-L125 HydrophobicContact CD2-CD1 3.77Å; Y119-L125 HydrophobicContact CE2-CD1 4.1Å; Y119-L125 HydrophobicContact CG-CB 4.24Å; S121-L125 PolarHBondContact O-N 2.85Å; L122-L125 HydrophobicContact CD1-CD2 4.22Å; L122-L125 WeakPolarHBondContact O-CB 3.45Å; L122-L125 PolarHBondContact O-N 2.89Å; D123-L125 VanDerWaalsContact C-N 3.26Å; D123-L125 PolarHBondContact O-N 2.97Å; L125-S128 PolarHBondContact O-N 2.95Å; L125-L129 HydrophobicContact CD1-CD1 4.03Å; L125-L129 HydrophobicContact CD1-CG 4.22Å; L125-L129 HydrophobicContact CG-CD1 4.06Å; L125-L129 WeakPolarHBondContact O-CB 3.46Å; L125-L129 WeakPolarHBondContact O-CG 3.38Å; L125-L129 PolarHBondContact O-N 2.86Å
126	A	79.5	Confident	78.1	Confident	51 Å²	51	82.5 Å²	82.5	42%	0.421	45%	0.45	S	S	.	.	H	α-helix	trans	-63.9	-42.6	178.1	0	0	0	0	0	112.1	L122 D123 L129 L130	L122-A126 WeakPolarHBondContact O-CB 3.46Å; L122-A126 PolarHBondContact O-N 3.21Å; D123-A126 PolarHBondContact O-N 3.07Å; D123-A126 VanDerWaalsContact O-N 3.11Å; A126-L129 PolarHBondContact O-N 3.37Å; A126-L130 WeakPolarHBondContact O-CB 3.33Å; A126-L130 PolarHBondContact O-N 3.09Å
127	D	80.7	Confident	78.8	Confident	102 Å²	102	85.8 Å²	85.8	55%	0.545	47%	0.465	S	S	.	.	H	α-helix	trans	-63	-45.5	176.1	-72.9	-21.4	0	0	0	111.2	D123 L129 L130 D131	D123-D127 PolarHBondContact O-N 3.01Å; D127-L129 PolarHBondContact O-N 3.09Å; D127-L130 WeakPolarHBondContact O-CB 3.35Å; D127-L130 PolarHBondContact O-N 3.24Å; D127-D131 PolarHBondContact O-N 2.91Å
128	S	78.3	Confident	79.3	Confident	23 Å²	23	83 Å²	83	16%	0.161	45%	0.445	C	S	.	.	H	α-helix	trans	-62.5	-40.8	175.6	168.6	0	0	0	0	112.8	Y119 S124 L125 L130 D131 T132	Y119-S128 VanDerWaalsContact CZ-CB 3.41Å; Y119-S128 WeakPolarHBondContact OH-CB 3.43Å; Y119-S128 PolarHBondContact OH-OG 3.12Å; S124-S128 WeakPolarHBondContact O-CB 3.4Å; S124-S128 PolarHBondContact O-N 3.35Å; S124-S128 VanDerWaalsContact O-N 3.08Å; L125-S128 PolarHBondContact O-N 2.95Å; S128-L130 VanDerWaalsContact C-N 3.3Å; S128-L130 PolarHBondContact O-N 2.86Å; S128-D131 PolarHBondContact O-N 3.44Å; S128-T132 WeakPolarHBondContact O-CB 3.33Å; S128-T132 PolarHBondContact O-N 3.15Å; S128-T132 PolarHBondContact O-OG1 3.08Å
129	L	79.4	Confident	79.7	Confident	79 Å²	79	82.4 Å²	82.4	41%	0.414	43%	0.434	S	S	.	.	H	α-helix	trans	-62.4	-40.4	175.8	-82.6	168.5	0	0	0	111.3	F116 L125 A126 D127 T132 H133	F116-L129 HydrophobicContact CE1-CD1 4.45Å; F116-L129 HydrophobicContact CE1-CD2 3.62Å; F116-L129 HydrophobicContact CE1-CG 3.87Å; F116-L129 HydrophobicContact CZ-CD2 3.39Å; F116-L129 HydrophobicContact CZ-CG 4.11Å; L125-L129 HydrophobicContact CD1-CD1 4.03Å; L125-L129 HydrophobicContact CD1-CG 4.22Å; L125-L129 HydrophobicContact CG-CD1 4.06Å; L125-L129 WeakPolarHBondContact O-CB 3.46Å; L125-L129 WeakPolarHBondContact O-CG 3.38Å; L125-L129 PolarHBondContact O-N 2.86Å; A126-L129 PolarHBondContact O-N 3.37Å; D127-L129 PolarHBondContact O-N 3.09Å; L129-T132 PolarHBondContact O-N 3.47Å; L129-H133 VanDerWaalsContact O-CB 3.31Å; L129-H133 WeakPolarHBondContact O-CB 3.11Å; L129-H133 PolarHBondContact O-N 3.48Å
130	L	81.1	Confident	80.2	Confident	97 Å²	97	84 Å²	84	51%	0.508	45%	0.447	S	S	.	.	H	α-helix	trans	-65.8	-44.4	177.2	-175.9	65.3	0	0	0	111.5	A126 D127 S128 H133 N134	A126-L130 WeakPolarHBondContact O-CB 3.33Å; A126-L130 PolarHBondContact O-N 3.09Å; D127-L130 WeakPolarHBondContact O-CB 3.35Å; D127-L130 PolarHBondContact O-N 3.24Å; S128-L130 VanDerWaalsContact C-N 3.3Å; S128-L130 PolarHBondContact O-N 2.86Å; L130-H133 WeakPolarHBondContact O-CB 3.46Å; L130-H133 PolarHBondContact O-N 3.33Å; L130-N134 PolarHBondContact O-N 2.94Å; L130-N134 PolarHBondContact O-ND2 3.47Å; L130-N134 VanDerWaalsContact O-ND2 3.16Å
131	D	81.4	Confident	80.3	Confident	100 Å²	100	81.2 Å²	81.2	54%	0.535	43%	0.428	S	S	.	.	H	α-helix	trans	-60.7	-46.7	174.8	-75.9	-16.8	0	0	0	111.2	D127 S128 H133 N134 D135	D127-D131 PolarHBondContact O-N 2.91Å; S128-D131 PolarHBondContact O-N 3.44Å; D131-H133 VanDerWaalsContact C-N 3.32Å; D131-H133 PolarHBondContact O-N 3.21Å; D131-N134 PolarHBondContact O-N 2.6Å; D131-N134 VanDerWaalsContact O-N 3.15Å; D131-D135 PolarHBondContact O-N 3.2Å
132	T	78.9	Confident	80.2	Confident	22 Å²	22	83.1 Å²	83.1	14%	0.135	43%	0.43	C	S	.	.	H	α-helix	trans	-59.6	-43.3	176.2	-51.6	0	0	0	0	111.4	I109 S128 L129 D135 I136	I109-T132 HydrophobicContact CG1-CG2 4.42Å; S128-T132 WeakPolarHBondContact O-CB 3.33Å; S128-T132 PolarHBondContact O-N 3.15Å; S128-T132 PolarHBondContact O-OG1 3.08Å; L129-T132 PolarHBondContact O-N 3.47Å; T132-D135 PolarHBondContact O-N 2.89Å; T132-I136 HydrophobicContact CG2-CD1 3.99Å; T132-I136 WeakPolarHBondContact O-CB 3.5Å; T132-I136 WeakPolarHBondContact O-CD1 3.49Å; T132-I136 WeakPolarHBondContact O-CG1 3.37Å; T132-I136 PolarHBondContact O-N 3.34Å
133	H	79.5	Confident	80.2	Confident	112 Å²	112	80.5 Å²	80.5	52%	0.519	42%	0.416	S	S	.	.	H	α-helix	trans	-61	-43.8	175.8	171	-83.3	0	0	0	111.8	L129 L130 D131 I136 F137	L129-H133 VanDerWaalsContact O-CB 3.31Å; L129-H133 WeakPolarHBondContact O-CB 3.11Å; L129-H133 PolarHBondContact O-N 3.48Å; L130-H133 WeakPolarHBondContact O-CB 3.46Å; L130-H133 PolarHBondContact O-N 3.33Å; D131-H133 VanDerWaalsContact C-N 3.32Å; D131-H133 PolarHBondContact O-N 3.21Å; H133-I136 PolarHBondContact O-N 3.01Å; H133-F137 WeakPolarHBondContact O-CB 3.25Å; H133-F137 PolarHBondContact O-N 3.28Å
134	N	83.2	Confident	80.2	Confident	76 Å²	76	78.6 Å²	78.6	41%	0.406	41%	0.41	S	S	.	.	H	α-helix	trans	-65.9	-39.9	178.7	-69.1	-29.3	0	0	0	111.9	L130 D131 F137 F138	L130-N134 PolarHBondContact O-N 2.94Å; L130-N134 PolarHBondContact O-ND2 3.47Å; L130-N134 VanDerWaalsContact O-ND2 3.16Å; D131-N134 PolarHBondContact O-N 2.6Å; D131-N134 VanDerWaalsContact O-N 3.15Å; N134-F137 PolarHBondContact O-N 3.3Å; N134-F138 VanDerWaalsContact O-CB 3.27Å; N134-F138 WeakPolarHBondContact O-CB 3.44Å; N134-F138 PolarHBondContact O-N 2.84Å
135	D	80.8	Confident	80.2	Confident	94 Å²	94	82.5 Å²	82.5	50%	0.503	42%	0.424	S	S	.	.	H	α-helix	trans	-65.5	-42.9	176	-79.3	-15.3	0	0	0	111.8	I109 D131 T132 F138 E139	I109-D135 HydrophobicContact CD1-CB 4.27Å; D131-D135 PolarHBondContact O-N 3.2Å; T132-D135 PolarHBondContact O-N 2.89Å; D135-F138 PolarHBondContact O-N 3.39Å; D135-E139 PolarHBondContact O-N 3Å
136	I	80	Confident	80.3	Confident	57 Å²	57	84.3 Å²	84.3	29%	0.292	43%	0.434	S	S	.	.	H	α-helix	trans	-57.4	-52.1	172.5	-72.1	164.9	0	0	0	110.1	I109 T132 H133 F138 E139 L140	I109-I136 HydrophobicContact CB-CG1 4.2Å; I109-I136 HydrophobicContact CD1-CG1 4.19Å; I109-I136 HydrophobicContact CG1-CG1 4Å; I109-I136 HydrophobicContact CG2-CD1 3.84Å; I109-I136 HydrophobicContact CG2-CG1 3.36Å; T132-I136 HydrophobicContact CG2-CD1 3.99Å; T132-I136 WeakPolarHBondContact O-CB 3.5Å; T132-I136 WeakPolarHBondContact O-CD1 3.49Å; T132-I136 WeakPolarHBondContact O-CG1 3.37Å; T132-I136 PolarHBondContact O-N 3.34Å; H133-I136 PolarHBondContact O-N 3.01Å; I136-F138 VanDerWaalsContact C-N 3.31Å; I136-F138 PolarHBondContact O-N 2.9Å; I136-E139 PolarHBondContact O-N 2.96Å; I136-L140 HydrophobicContact CG2-CD1 3.63Å; I136-L140 HydrophobicContact CG2-CG 4.22Å; I136-L140 WeakPolarHBondContact O-CB 3.46Å; I136-L140 VanDerWaalsContact O-CG 3.28Å; I136-L140 WeakPolarHBondContact O-CG 3.32Å; I136-L140 PolarHBondContact O-N 3.19Å
137	F	78.9	Confident	80.4	Confident	126 Å²	126	86.3 Å²	86.3	55%	0.553	44%	0.436	S	S	*	.	H	α-helix	trans	-59.6	-44.1	-177.7	-174.4	-92.9	0	0	0	111.3	H133 N134 L140 E141	H133-F137 WeakPolarHBondContact O-CB 3.25Å; H133-F137 PolarHBondContact O-N 3.28Å; N134-F137 PolarHBondContact O-N 3.3Å; F137-L140 PolarHBondContact O-N 3.11Å; F137-E141 VanDerWaalsContact O-CB 3.31Å; F137-E141 WeakPolarHBondContact O-CB 3.47Å; F137-E141 PolarHBondContact O-N 2.89Å
138	F	80.1	Confident	80.6	Confident	101 Å²	101	87.3 Å²	87.3	44%	0.443	44%	0.437	S	S	.	.	H	α-helix	trans	-65	-41.6	179.4	178.9	-108.7	0	0	0	113.7	N134 D135 I136 K142	N134-F138 VanDerWaalsContact O-CB 3.27Å; N134-F138 WeakPolarHBondContact O-CB 3.44Å; N134-F138 PolarHBondContact O-N 2.84Å; D135-F138 PolarHBondContact O-N 3.39Å; I136-F138 VanDerWaalsContact C-N 3.31Å; I136-F138 PolarHBondContact O-N 2.9Å; F138-K142 HydrophobicContact CD1-CD 4.41Å; F138-K142 HydrophobicContact CE1-CD 4.22Å; F138-K142 VanDerWaalsContact CE2-CE 3.49Å; F138-K142 HydrophobicContact CZ-CD 4.38Å; F138-K142 WeakPolarHBondContact O-CG 3.49Å; F138-K142 PolarHBondContact O-N 3.07Å
139	E	79.8	Confident	80.7	Confident	65 Å²	65	94.3 Å²	94.3	30%	0.304	46%	0.46	S	S	.	.	H	α-helix	trans	-71.5	-37.5	176.6	-71.7	-77.4	-157.8	0	0	111.1	K105 Y106 D135 I136 K142 L143	K105-E139 IonicContact NZ-OE1 2.65Å; K105-E139 PolarHBondContact NZ-OE1 3.03Å; K105-E139 VanDerWaalsContact NZ-OE1 3.07Å; Y106-E139 HydrophobicContact CE1-CG 4.14Å; D135-E139 PolarHBondContact O-N 3Å; I136-E139 PolarHBondContact O-N 2.96Å; E139-K142 PolarHBondContact O-N 2.9Å; E139-L143 PolarHBondContact O-N 3.42Å; E139-L143 VanDerWaalsContact O-N 3.12Å
140	L	79	Confident	80.9	Confident	103 Å²	103	95.7 Å²	95.7	54%	0.539	47%	0.465	S	S	.	.	H	α-helix	trans	-66	-40.1	174.6	-72.7	178	0	0	0	112.5	I136 F137 K142 L143 P144	I136-L140 HydrophobicContact CG2-CD1 3.63Å; I136-L140 HydrophobicContact CG2-CG 4.22Å; I136-L140 WeakPolarHBondContact O-CB 3.46Å; I136-L140 VanDerWaalsContact O-CG 3.28Å; I136-L140 WeakPolarHBondContact O-CG 3.32Å; I136-L140 PolarHBondContact O-N 3.19Å; F137-L140 PolarHBondContact O-N 3.11Å; L140-K142 PolarHBondContact O-N 3.39Å; L140-L143 HydrophobicContact CD2-CD2 4.42Å; L140-L143 WeakPolarHBondContact O-CB 3.47Å; L140-L143 PolarHBondContact O-N 3.38Å; L140-L143 VanDerWaalsContact O-N 3.09Å; L140-P144 WeakPolarHBondContact O-CD 3.38Å
141	E	82.1	Confident	81.2	Confident	113 Å²	113	94.1 Å²	94.1	53%	0.528	46%	0.457	S	S	.	.	H	α-helix	trans	-60.6	-32.9	175.7	-174.8	-176.6	-166.2	0	0	111.9	F137 H145	F137-E141 VanDerWaalsContact O-CB 3.31Å; F137-E141 WeakPolarHBondContact O-CB 3.47Å; F137-E141 PolarHBondContact O-N 2.89Å; E141-H145 PolarHBondContact O-ND1 3.42Å
142	K	81.2	Confident	81.5	Confident	94 Å²	94	94.8 Å²	94.8	41%	0.409	46%	0.458	S	S	.	.	H	α-helix	trans	-81.9	-18.9	177.3	-71.6	176.2	175.8	-173.9	0	113.8	F138 E139 L140 H145 L146	F138-K142 HydrophobicContact CD1-CD 4.41Å; F138-K142 HydrophobicContact CE1-CD 4.22Å; F138-K142 VanDerWaalsContact CE2-CE 3.49Å; F138-K142 HydrophobicContact CZ-CD 4.38Å; F138-K142 WeakPolarHBondContact O-CG 3.49Å; F138-K142 PolarHBondContact O-N 3.07Å; E139-K142 PolarHBondContact O-N 2.9Å; L140-K142 PolarHBondContact O-N 3.39Å; K142-H145 WeakPolarHBondContact O-CB 3.35Å; K142-H145 PolarHBondContact O-N 3.15Å; K142-L146 PolarHBondContact O-N 3.34Å
143	L	80.2	Confident	81.9	Confident	80 Å²	80	100.2 Å²	100.2	42%	0.419	48%	0.48	S	S	.	.	H	α-helix	trans	-60.9	-44.9	-175	-168.7	71	0	0	0	112.6	E139 L140 H145 L146 I147	E139-L143 PolarHBondContact O-N 3.42Å; E139-L143 VanDerWaalsContact O-N 3.12Å; L140-L143 HydrophobicContact CD2-CD2 4.42Å; L140-L143 WeakPolarHBondContact O-CB 3.47Å; L140-L143 PolarHBondContact O-N 3.38Å; L140-L143 VanDerWaalsContact O-N 3.09Å; L143-H145 VanDerWaalsContact C-N 3.33Å; L143-H145 PolarHBondContact O-N 2.92Å; L143-L146 WeakPolarHBondContact O-CB 3.37Å; L143-L146 PolarHBondContact O-N 3Å; L143-L146 VanDerWaalsContact O-N 3.09Å; L143-I147 HydrophobicContact CD2-CD1 4.36Å; L143-I147 HydrophobicContact CG-CD1 3.9Å; L143-I147 HydrophobicContact CG-CG1 4.37Å; L143-I147 VanDerWaalsContact O-CG1 3.32Å; L143-I147 WeakPolarHBondContact O-CG1 3.19Å; L143-I147 PolarHBondContact O-N 2.94Å
144	P	83	Confident	82.1	Confident	80 Å²	80	100 Å²	100	52%	0.519	48%	0.482	S	S	.	.	H	α-helix	trans	-54.7	-46.1	173.8	-27.3	34.3	0	0	0	113.2	L140 L146 I147 E148	L140-P144 WeakPolarHBondContact O-CD 3.38Å; P144-L146 VanDerWaalsContact C-N 3.28Å; P144-L146 PolarHBondContact O-N 2.9Å; P144-I147 PolarHBondContact O-N 3.39Å; P144-E148 WeakPolarHBondContact O-CB 3.35Å; P144-E148 PolarHBondContact O-N 2.9Å
145	H	80.7	Confident	82.3	Confident	118 Å²	118	101.7 Å²	101.7	55%	0.546	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-34.2	178.3	-64	94.1	0	0	0	112.4	E141 K142 L143 R149	E141-H145 PolarHBondContact O-ND1 3.42Å; K142-H145 WeakPolarHBondContact O-CB 3.35Å; K142-H145 PolarHBondContact O-N 3.15Å; L143-H145 VanDerWaalsContact C-N 3.33Å; L143-H145 PolarHBondContact O-N 2.92Å; H145-R149 WeakPolarHBondContact O-CB 3.24Å; H145-R149 PolarHBondContact O-N 3.16Å
146	L	79.8	Confident	82.5	Confident	78 Å²	78	99.6 Å²	99.6	41%	0.408	48%	0.479	S	S	.	.	H	α-helix	trans	-71.9	-42.8	176	-172.6	66.3	0	0	0	111.3	K142 L143 P144 R149 Q150	K142-L146 PolarHBondContact O-N 3.34Å; L143-L146 WeakPolarHBondContact O-CB 3.37Å; L143-L146 PolarHBondContact O-N 3Å; L143-L146 VanDerWaalsContact O-N 3.09Å; P144-L146 VanDerWaalsContact C-N 3.28Å; P144-L146 PolarHBondContact O-N 2.9Å; L146-R149 PolarHBondContact O-N 2.92Å; L146-Q150 WeakPolarHBondContact O-CG 3.31Å; L146-Q150 PolarHBondContact O-N 3.3Å
147	I	80.3	Confident	82.6	Confident	93 Å²	93	102.4 Å²	102.4	48%	0.477	49%	0.489	S	S	.	.	H	α-helix	trans	-61.4	-47.4	176.3	-69.6	168.7	0	0	0	109.9	L143 P144 R149 Q150 D151	L143-I147 HydrophobicContact CD2-CD1 4.36Å; L143-I147 HydrophobicContact CG-CD1 3.9Å; L143-I147 HydrophobicContact CG-CG1 4.37Å; L143-I147 VanDerWaalsContact O-CG1 3.32Å; L143-I147 WeakPolarHBondContact O-CG1 3.19Å; L143-I147 PolarHBondContact O-N 2.94Å; P144-I147 PolarHBondContact O-N 3.39Å; I147-R149 VanDerWaalsContact C-N 3.3Å; I147-R149 PolarHBondContact O-N 3.41Å; I147-Q150 PolarHBondContact O-N 3.03Å; I147-Q150 VanDerWaalsContact O-N 3.09Å; I147-D151 WeakPolarHBondContact O-CB 3.33Å; I147-D151 PolarHBondContact O-N 3.46Å
148	E	85.5	Confident	82.9	Confident	122 Å²	122	101.1 Å²	101.1	57%	0.57	49%	0.485	S	S	*	.	H	α-helix	trans	-57.5	-44.5	176.5	-174.4	-174.5	-169.1	0	0	111.3	P144 Q150 D151 M152	P144-E148 WeakPolarHBondContact O-CB 3.35Å; P144-E148 PolarHBondContact O-N 2.9Å; E148-Q150 VanDerWaalsContact C-N 3.33Å; E148-Q150 PolarHBondContact O-N 2.76Å; E148-D151 PolarHBondContact O-N 3.34Å; E148-M152 WeakPolarHBondContact O-CB 3.28Å; E148-M152 VanDerWaalsContact O-CG 3.26Å; E148-M152 WeakPolarHBondContact O-CG 3.39Å; E148-M152 PolarHBondContact O-N 3.06Å
149	R	79.8	Confident	83	Confident	170 Å²	170	100.8 Å²	100.8	64%	0.642	48%	0.481	S	S	*	.	H	α-helix	trans	-63.2	-39	176.6	-172.7	-178.7	-64.9	139.8	3.6	112.4	H145 L146 I147 F153	H145-R149 WeakPolarHBondContact O-CB 3.24Å; H145-R149 PolarHBondContact O-N 3.16Å; L146-R149 PolarHBondContact O-N 2.92Å; I147-R149 VanDerWaalsContact C-N 3.3Å; I147-R149 PolarHBondContact O-N 3.41Å; R149-F153 WeakPolarHBondContact O-CB 3.36Å; R149-F153 PolarHBondContact O-N 3.04Å
150	Q	83.8	Confident	83.2	Confident	108 Å²	108	103.3 Å²	103.3	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-68.7	-43.4	177.3	-74	178.6	3.9	0	0	111.6	L146 I147 E148 M152 F153 L154	L146-Q150 WeakPolarHBondContact O-CG 3.31Å; L146-Q150 PolarHBondContact O-N 3.3Å; I147-Q150 PolarHBondContact O-N 3.03Å; I147-Q150 VanDerWaalsContact O-N 3.09Å; E148-Q150 VanDerWaalsContact C-N 3.33Å; E148-Q150 PolarHBondContact O-N 2.76Å; Q150-M152 PolarHBondContact O-N 3.47Å; Q150-F153 WeakPolarHBondContact O-CB 3.48Å; Q150-F153 PolarHBondContact O-N 3.33Å; Q150-L154 WeakPolarHBondContact O-CG 3.18Å; Q150-L154 PolarHBondContact O-N 2.92Å
151	D	87.5	Confident	83.3	Confident	64 Å²	64	102.9 Å²	102.9	34%	0.342	49%	0.488	S	S	.	.	H	α-helix	trans	-58.3	-47.5	174	174.6	61.1	0	0	0	111	I147 E148 F153 L154 K155	I147-D151 WeakPolarHBondContact O-CB 3.33Å; I147-D151 PolarHBondContact O-N 3.46Å; E148-D151 PolarHBondContact O-N 3.34Å; D151-F153 VanDerWaalsContact C-N 3.31Å; D151-F153 PolarHBondContact O-N 3.26Å; D151-L154 PolarHBondContact O-N 2.87Å; D151-L154 VanDerWaalsContact O-N 3.16Å; D151-K155 WeakPolarHBondContact O-CB 3.48Å; D151-K155 WeakPolarHBondContact O-CG 3.42Å; D151-K155 PolarHBondContact O-N 3.24Å; D151-K155 WeakPolarHBondContact OD1-CE 3.46Å; D151-K155 IonicContact OD1-NZ 3.56Å; D151-K155 WeakPolarHBondContact OD2-CE 3.27Å; D151-K155 IonicContact OD2-NZ 3.07Å; D151-K155 PolarHBondContact OD2-NZ 2.89Å
152	M	88	Confident	83.2	Confident	114 Å²	114	104.3 Å²	104.3	56%	0.562	49%	0.489	S	S	*	.	H	α-helix	trans	-61.6	-38.2	175.5	-71.7	-64	-75.4	0	0	112.6	E148 Q150 K155 S156	E148-M152 WeakPolarHBondContact O-CB 3.28Å; E148-M152 VanDerWaalsContact O-CG 3.26Å; E148-M152 WeakPolarHBondContact O-CG 3.39Å; E148-M152 PolarHBondContact O-N 3.06Å; Q150-M152 PolarHBondContact O-N 3.47Å; M152-K155 HydrophobicContact SD-CD 4.47Å; M152-S156 WeakPolarHBondContact O-CB 3.27Å; M152-S156 PolarHBondContact O-N 3.39Å
153	F	86.5	Confident	82.9	Confident	137 Å²	137	101.5 Å²	101.5	60%	0.601	48%	0.478	S	S	*	.	H	α-helix	trans	-64.3	-45.4	173.6	173.8	-95.1	0	0	0	111.8	R149 Q150 D151 S156 F157	R149-F153 WeakPolarHBondContact O-CB 3.36Å; R149-F153 PolarHBondContact O-N 3.04Å; Q150-F153 WeakPolarHBondContact O-CB 3.48Å; Q150-F153 PolarHBondContact O-N 3.33Å; D151-F153 VanDerWaalsContact C-N 3.31Å; D151-F153 PolarHBondContact O-N 3.26Å; F153-S156 WeakPolarHBondContact O-CB 3.2Å; F153-S156 PolarHBondContact O-N 3.17Å; F153-F157 WeakPolarHBondContact O-CB 3.47Å; F153-F157 PolarHBondContact O-N 3.06Å
154	L	84.9	Confident	82.8	Confident	106 Å²	106	104.4 Å²	104.4	56%	0.555	49%	0.487	S	S	*	.	H	α-helix	trans	-64.6	-44.1	178.4	-73	173.8	0	0	0	111.5	Q150 D151 S156 F157 Q158	Q150-L154 WeakPolarHBondContact O-CG 3.18Å; Q150-L154 PolarHBondContact O-N 2.92Å; D151-L154 PolarHBondContact O-N 2.87Å; D151-L154 VanDerWaalsContact O-N 3.16Å; L154-S156 VanDerWaalsContact C-N 3.34Å; L154-S156 PolarHBondContact O-N 3.26Å; L154-F157 PolarHBondContact O-N 3.1Å; L154-F157 VanDerWaalsContact O-N 3.11Å; L154-Q158 WeakPolarHBondContact O-CB 3.42Å; L154-Q158 PolarHBondContact O-N 2.88Å
155	K	87.1	Confident	82.5	Confident	112 Å²	112	105.6 Å²	105.6	49%	0.487	49%	0.486	S	S	.	.	H	α-helix	trans	-56.1	-48.9	172	-75.8	172.5	176.2	164.9	0	110.8	D151 M152 F157 Q158 R159	D151-K155 WeakPolarHBondContact O-CB 3.48Å; D151-K155 WeakPolarHBondContact O-CG 3.42Å; D151-K155 PolarHBondContact O-N 3.24Å; D151-K155 WeakPolarHBondContact OD1-CE 3.46Å; D151-K155 IonicContact OD1-NZ 3.56Å; D151-K155 WeakPolarHBondContact OD2-CE 3.27Å; D151-K155 IonicContact OD2-NZ 3.07Å; D151-K155 PolarHBondContact OD2-NZ 2.89Å; M152-K155 HydrophobicContact SD-CD 4.47Å; K155-F157 VanDerWaalsContact C-N 3.3Å; K155-F157 PolarHBondContact O-N 2.8Å; K155-Q158 PolarHBondContact O-N 3.39Å; K155-R159 WeakPolarHBondContact O-CB 3.26Å; K155-R159 PolarHBondContact O-N 3.23Å
156	S	85.4	Confident	82.1	Confident	51 Å²	51	105.2 Å²	105.2	36%	0.357	48%	0.483	S	S	.	.	H	α-helix	trans	-61.4	-36.5	175.8	-173.7	0	0	0	0	112.8	M152 F153 L154 R159 K160	M152-S156 WeakPolarHBondContact O-CB 3.27Å; M152-S156 PolarHBondContact O-N 3.39Å; F153-S156 WeakPolarHBondContact O-CB 3.2Å; F153-S156 PolarHBondContact O-N 3.17Å; L154-S156 VanDerWaalsContact C-N 3.34Å; L154-S156 PolarHBondContact O-N 3.26Å; S156-R159 WeakPolarHBondContact O-CB 3.42Å; S156-K160 WeakPolarHBondContact O-CG 3.05Å; S156-K160 PolarHBondContact O-N 3.25Å; S156-K160 VanDerWaalsContact O-N 3.09Å
157	F	82.1	Confident	81.6	Confident	116 Å²	116	102.8 Å²	102.8	51%	0.509	47%	0.472	S	S	.	.	H	α-helix	trans	-70.9	-48.3	178.2	-175.4	-98.4	0	0	0	112	F153 L154 K155 R159 K160 L161	F153-F157 WeakPolarHBondContact O-CB 3.47Å; F153-F157 PolarHBondContact O-N 3.06Å; L154-F157 PolarHBondContact O-N 3.1Å; L154-F157 VanDerWaalsContact O-N 3.11Å; K155-F157 VanDerWaalsContact C-N 3.3Å; K155-F157 PolarHBondContact O-N 2.8Å; F157-R159 PolarHBondContact O-N 2.93Å; F157-K160 WeakPolarHBondContact O-CB 3.4Å; F157-K160 PolarHBondContact O-N 3.28Å; F157-K160 VanDerWaalsContact O-N 3.09Å; F157-L161 HydrophobicContact CE1-CD1 4.22Å; F157-L161 PolarHBondContact O-N 3.41Å
158	Q	83.8	Confident	81	Confident	99 Å²	99	104.2 Å²	104.2	46%	0.463	48%	0.476	S	S	.	.	H	α-helix	trans	-57.1	-40.6	174.5	-172	-175.4	23.1	0	0	110.8	L154 K155 K160 L161 R162	L154-Q158 WeakPolarHBondContact O-CB 3.42Å; L154-Q158 PolarHBondContact O-N 2.88Å; K155-Q158 PolarHBondContact O-N 3.39Å; Q158-K160 PolarHBondContact O-N 2.73Å; Q158-L161 PolarHBondContact O-N 3.08Å; Q158-R162 WeakPolarHBondContact O-CG 3.35Å; Q158-R162 PolarHBondContact O-N 3.44Å
159	R	83	Confident	80.2	Confident	94 Å²	94	102.9 Å²	102.9	36%	0.355	47%	0.469	S	S	.	.	H	α-helix	trans	-55.9	-50.1	173.8	-160.5	-178.8	-176.3	145.1	13.3	112.3	K155 S156 F157 L161 R162 L163 Y185 E189	K155-R159 WeakPolarHBondContact O-CB 3.26Å; K155-R159 PolarHBondContact O-N 3.23Å; S156-R159 WeakPolarHBondContact O-CB 3.42Å; F157-R159 PolarHBondContact O-N 2.93Å; R159-L161 VanDerWaalsContact C-N 3.33Å; R159-L161 PolarHBondContact O-N 2.87Å; R159-R162 PolarHBondContact O-N 3.23Å; R159-L163 WeakPolarHBondContact O-CB 3.17Å; R159-L163 PolarHBondContact O-N 3.44Å; R159-Y185 WeakPolarHBondContact CD-OH 2.97Å; R159-Y185 HydrophobicContact CG-CE1 3.99Å; R159-Y185 WeakPolarHBondContact CG-OH 3.08Å; R159-Y185 VanDerWaalsContact NE-CZ 3.3Å; R159-Y185 PolarHBondContact NE-OH 3.41Å; R159-E189 IonicContact CZ-OE1 2.74Å; R159-E189 IonicContact CZ-OE2 3.19Å; R159-E189 IonicContact NE-OE1 2.82Å; R159-E189 IonicContact NH1-OE1 3.67Å; R159-E189 PolarHBondContact NH1-OE1 3.27Å; R159-E189 IonicContact NH1-OE2 3.47Å; R159-E189 IonicContact NH2-OE1 2.66Å; R159-E189 PolarHBondContact NH2-OE1 3.22Å; R159-E189 IonicContact NH2-OE2 2.6Å; R159-E189 PolarHBondContact NH2-OE2 3.37Å
160	K	83.3	Confident	79.2	Confident	117 Å²	117	96.9 Å²	96.9	51%	0.509	45%	0.45	S	S	.	.	H	α-helix	trans	-64.3	-35.9	176.1	-73.5	171.7	-175.1	172.6	0	112.9	S156 F157 Q158 L163 K164	S156-K160 WeakPolarHBondContact O-CG 3.05Å; S156-K160 PolarHBondContact O-N 3.25Å; S156-K160 VanDerWaalsContact O-N 3.09Å; F157-K160 WeakPolarHBondContact O-CB 3.4Å; F157-K160 PolarHBondContact O-N 3.28Å; F157-K160 VanDerWaalsContact O-N 3.09Å; Q158-K160 PolarHBondContact O-N 2.73Å; K160-L163 WeakPolarHBondContact O-CB 3.4Å; K160-L163 PolarHBondContact O-N 2.73Å; K160-K164 PolarHBondContact O-N 2.97Å
161	L	80.7	Confident	78.1	Confident	95 Å²	95	95 Å²	95	50%	0.497	45%	0.449	S	S	.	.	H	α-helix	trans	-67.6	-45.7	178.8	-165	120.7	0	0	0	111.1	F157 Q158 R159 L163 K164 Q165	F157-L161 HydrophobicContact CE1-CD1 4.22Å; F157-L161 PolarHBondContact O-N 3.41Å; Q158-L161 PolarHBondContact O-N 3.08Å; R159-L161 VanDerWaalsContact C-N 3.33Å; R159-L161 PolarHBondContact O-N 2.87Å; L161-L163 VanDerWaalsContact C-N 3.31Å; L161-L163 PolarHBondContact O-N 2.71Å; L161-K164 PolarHBondContact O-N 3.29Å; L161-Q165 WeakPolarHBondContact O-CB 3.31Å; L161-Q165 PolarHBondContact O-N 2.97Å
162	R	81.1	Confident	76.7	Confident	142 Å²	142	101.2 Å²	101.2	54%	0.536	47%	0.469	S	S	.	.	H	α-helix	trans	-59.6	-41.5	173.3	-73	-179.4	177.6	175.7	0.1	112	Q158 R159 Q165 K166	Q158-R162 WeakPolarHBondContact O-CG 3.35Å; Q158-R162 PolarHBondContact O-N 3.44Å; R159-R162 PolarHBondContact O-N 3.23Å; R162-Q165 PolarHBondContact O-N 3.21Å; R162-K166 WeakPolarHBondContact O-CG 3.21Å; R162-K166 PolarHBondContact O-N 2.92Å
163	L	75	Confident	75.5	Confident	36 Å²	36	103.7 Å²	103.7	19%	0.188	48%	0.477	C	S	.	.	H	α-helix	trans	-58.1	-49.4	173.1	-93.6	173.4	0	0	0	112.4	R159 K160 L161 Q165 K166 S167 Y185	R159-L163 WeakPolarHBondContact O-CB 3.17Å; R159-L163 PolarHBondContact O-N 3.44Å; K160-L163 WeakPolarHBondContact O-CB 3.4Å; K160-L163 PolarHBondContact O-N 2.73Å; L161-L163 VanDerWaalsContact C-N 3.31Å; L161-L163 PolarHBondContact O-N 2.71Å; L163-Q165 VanDerWaalsContact C-N 3.35Å; L163-Q165 PolarHBondContact O-N 3.49Å; L163-K166 PolarHBondContact O-N 3.35Å; L163-S167 PolarHBondContact O-N 2.56Å; L163-S167 PolarHBondContact O-OG 3.13Å; L163-Y185 HydrophobicContact CD1-CD1 3.5Å; L163-Y185 HydrophobicContact CD1-CE1 3.44Å; L163-Y185 VanDerWaalsContact CD1-CE1 3.44Å; L163-Y185 HydrophobicContact CD1-CG 4.19Å; L163-Y185 VanDerWaalsContact CD2-CB 3.48Å; L163-Y185 HydrophobicContact CD2-CD1 3.41Å; L163-Y185 VanDerWaalsContact CD2-CD1 3.41Å; L163-Y185 HydrophobicContact CD2-CD2 3.55Å; L163-Y185 HydrophobicContact CD2-CE1 3.97Å; L163-Y185 HydrophobicContact CD2-CE2 4.11Å; L163-Y185 HydrophobicContact CD2-CG 3.15Å; L163-Y185 HydrophobicContact CG-CD1 3.61Å; L163-Y185 HydrophobicContact CG-CD2 4.02Å; L163-Y185 HydrophobicContact CG-CE1 3.63Å; L163-Y185 HydrophobicContact CG-CE2 4.07Å; L163-Y185 HydrophobicContact CG-CG 3.79Å
164	K	76.9	Confident	74.2	Confident	140 Å²	140	100.5 Å²	100.5	61%	0.609	48%	0.483	S	S	*	.	H	α-helix	trans	-59.1	-47.5	175.7	-79.5	-166.4	172.2	-166.5	0	111	K160 L161 K166 S167 F168	K160-K164 PolarHBondContact O-N 2.97Å; L161-K164 PolarHBondContact O-N 3.29Å; K164-K166 PolarHBondContact O-N 2.92Å; K164-S167 WeakPolarHBondContact CA-OG 3.46Å; K164-S167 PolarHBondContact O-N 3.11Å; K164-S167 PolarHBondContact O-OG 2.82Å; K164-F168 HydrophobicContact CB-CD2 4.44Å; K164-F168 WeakPolarHBondContact O-CD2 3.14Å; K164-F168 PolarHBondContact O-N 3.5Å
165	Q	77.6	Confident	73.1	Confident	105 Å²	105	99.9 Å²	99.9	49%	0.491	49%	0.487	S	S	.	.	H	α-helix	trans	-58.2	-46.2	179	-174.7	178.8	-0	0	0	111.9	L161 R162 L163 F168 Q169	L161-Q165 WeakPolarHBondContact O-CB 3.31Å; L161-Q165 PolarHBondContact O-N 2.97Å; R162-Q165 PolarHBondContact O-N 3.21Å; L163-Q165 VanDerWaalsContact C-N 3.35Å; L163-Q165 PolarHBondContact O-N 3.49Å; Q165-F168 PolarHBondContact O-N 3.12Å; Q165-Q169 WeakPolarHBondContact O-CG 3.48Å; Q165-Q169 PolarHBondContact O-N 3.31Å
166	K	72.1	Confident	71.8	Confident	110 Å²	110	97.2 Å²	97.2	48%	0.478	48%	0.481	S	S	.	.	H	α-helix	trans	-59.6	-48.6	173.7	-74.3	-174.7	176.7	-167.7	0	111.6	R162 L163 K164 F168 Q169 D170 V181	R162-K166 WeakPolarHBondContact O-CG 3.21Å; R162-K166 PolarHBondContact O-N 2.92Å; L163-K166 PolarHBondContact O-N 3.35Å; K164-K166 PolarHBondContact O-N 2.92Å; K166-F168 VanDerWaalsContact C-N 3.27Å; K166-F168 PolarHBondContact O-N 3.17Å; K166-Q169 PolarHBondContact O-N 3.49Å; K166-D170 WeakPolarHBondContact O-CB 3.49Å; K166-D170 VanDerWaalsContact O-CG 3.29Å; K166-D170 PolarHBondContact O-N 3.34Å; K166-V181 HydrophobicContact CB-CG1 4.1Å
167	S	68.3	Low	70.8	Confident	27 Å²	27	97.8 Å²	97.8	19%	0.189	49%	0.485	C	S	.	.	H	α-helix	trans	-60.8	-35.2	178.1	68.9	0	0	0	0	113.3	L163 K164 S171	L163-S167 PolarHBondContact O-N 2.56Å; L163-S167 PolarHBondContact O-OG 3.13Å; K164-S167 WeakPolarHBondContact CA-OG 3.46Å; K164-S167 PolarHBondContact O-N 3.11Å; K164-S167 PolarHBondContact O-OG 2.82Å; S167-S171 VanDerWaalsContact O-CB 3.31Å; S167-S171 WeakPolarHBondContact O-CB 3.49Å; S167-S171 PolarHBondContact O-N 2.93Å; S167-S171 PolarHBondContact O-OG 3.36Å
168	F	69.3	Low	69.9	Low	124 Å²	124	95.3 Å²	95.3	54%	0.544	48%	0.48	S	S	.	.	H	α-helix	trans	-69.7	-50.3	174.1	-84.3	-69.1	0	0	0	110.8	K164 Q165 K166 D170 S171 Y172	K164-F168 HydrophobicContact CB-CD2 4.44Å; K164-F168 WeakPolarHBondContact O-CD2 3.14Å; K164-F168 PolarHBondContact O-N 3.5Å; Q165-F168 PolarHBondContact O-N 3.12Å; K166-F168 VanDerWaalsContact C-N 3.27Å; K166-F168 PolarHBondContact O-N 3.17Å; F168-D170 VanDerWaalsContact C-N 3.3Å; F168-D170 PolarHBondContact O-N 3.06Å; F168-S171 PolarHBondContact O-N 2.98Å; F168-S171 VanDerWaalsContact O-N 3.16Å; F168-Y172 HydrophobicContact CD1-CE2 4.39Å; F168-Y172 WeakPolarHBondContact O-CB 3.38Å; F168-Y172 WeakPolarHBondContact O-CD2 3.33Å; F168-Y172 PolarHBondContact O-N 3.47Å
169	Q	67.8	Low	69.1	Low	94 Å²	94	97.2 Å²	97.2	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-54.9	-47.6	176.2	-76.6	178.1	-22.2	0	0	111	Q165 K166 S171 Y172 F173	Q165-Q169 WeakPolarHBondContact O-CG 3.48Å; Q165-Q169 PolarHBondContact O-N 3.31Å; K166-Q169 PolarHBondContact O-N 3.49Å; Q169-S171 VanDerWaalsContact C-N 3.34Å; Q169-S171 PolarHBondContact O-N 2.98Å; Q169-Y172 CarbonylContact O-C 3.59Å; Q169-Y172 PolarHBondContact O-N 3.06Å; Q169-Y172 VanDerWaalsContact O-N 3.15Å; Q169-F173 HydrophobicContact CB-CD2 4.33Å; Q169-F173 WeakPolarHBondContact O-CB 3.48Å; Q169-F173 WeakPolarHBondContact O-CD2 3.47Å; Q169-F173 PolarHBondContact O-N 3.33Å
170	D	59.3	Low	68.4	Low	43 Å²	43	94.4 Å²	94.4	23%	0.23	49%	0.488	C	S	.	.	H	α-helix	trans	-67.6	-32.7	179.8	-66.6	-31.7	0	0	0	112.8	K166 F168 G174 V181	K166-D170 WeakPolarHBondContact O-CB 3.49Å; K166-D170 VanDerWaalsContact O-CG 3.29Å; K166-D170 PolarHBondContact O-N 3.34Å; F168-D170 VanDerWaalsContact C-N 3.3Å; F168-D170 PolarHBondContact O-N 3.06Å; D170-G174 PolarHBondContact O-N 2.94Å; D170-V181 HydrophobicContact CB-CG2 3.92Å; D170-V181 WeakPolarHBondContact OD2-CG2 3.36Å
171	S	60.3	Low	67.5	Low	70 Å²	70	89.5 Å²	89.5	49%	0.49	47%	0.467	S	S	.	.	H	α-helix	trans	-68.8	-37.5	171.7	-57.8	0	0	0	0	111.9	S167 F168 Q169	S167-S171 VanDerWaalsContact O-CB 3.31Å; S167-S171 WeakPolarHBondContact O-CB 3.49Å; S167-S171 PolarHBondContact O-N 2.93Å; S167-S171 PolarHBondContact O-OG 3.36Å; F168-S171 PolarHBondContact O-N 2.98Å; F168-S171 VanDerWaalsContact O-N 3.16Å; Q169-S171 VanDerWaalsContact C-N 3.34Å; Q169-S171 PolarHBondContact O-N 2.98Å
172	Y	58.4	Low	66.8	Low	194 Å²	194	88.8 Å²	88.8	76%	0.761	46%	0.463	S	S	*	.	H	α-helix	trans	-72.4	-33.5	175.7	-87.1	-74.3	0	0	0	112.6	F168 Q169	F168-Y172 HydrophobicContact CD1-CE2 4.39Å; F168-Y172 WeakPolarHBondContact O-CB 3.38Å; F168-Y172 WeakPolarHBondContact O-CD2 3.33Å; F168-Y172 PolarHBondContact O-N 3.47Å; Q169-Y172 CarbonylContact O-C 3.59Å; Q169-Y172 PolarHBondContact O-N 3.06Å; Q169-Y172 VanDerWaalsContact O-N 3.15Å
173	F	62.3	Low	66.3	Low	165 Å²	165	85.5 Å²	85.5	72%	0.724	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	6.6	-178.3	-67.4	-67.5	0	0	0	114	Q169 S175	Q169-F173 HydrophobicContact CB-CD2 4.33Å; Q169-F173 WeakPolarHBondContact O-CB 3.48Å; Q169-F173 WeakPolarHBondContact O-CD2 3.47Å; Q169-F173 PolarHBondContact O-N 3.33Å; F173-S175 VanDerWaalsContact C-N 3.27Å; F173-S175 PolarHBondContact O-N 3.2Å
174	G	59.6	Low	66	Low	71 Å²	71	89.3 Å²	89.3	73%	0.732	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	9.5	160.5	0	0	0	0	0	118	D170	D170-G174 PolarHBondContact O-N 2.94Å
175	S	61.1	Low	65.4	Low	92 Å²	92	85 Å²	85	64%	0.643	46%	0.463	S	S	*	.	S	Bend	trans	-99.4	-21.2	-169.7	67.7	0	0	0	0	115.1	F173	F173-S175 VanDerWaalsContact C-N 3.27Å; F173-S175 PolarHBondContact O-N 3.2Å
176	T	59.8	Low	64.9	Low	57 Å²	57	84.8 Å²	84.8	35%	0.35	46%	0.464	S	S	.	.	S	Bend	trans	-142.7	143.9	-178.4	53.1	0	0	0	0	112.5	V181	T176-V181 WeakPolarHBondContact OG1-CG2 3.45Å
177	S	65.3	Low	64.6	Low	63 Å²	63	81.8 Å²	81.8	44%	0.441	47%	0.465	S	S	.	.			trans	-65.9	146.2	175	75.2	0	0	0	0	110.5	L179 S180 V181	S177-L179 PolarHBondContact O-N 3.32Å; S177-S180 PolarHBondContact N-OG 3.11Å; S177-S180 VanDerWaalsContact N-OG 3.1Å; S177-S180 PolarHBondContact O-N 3.33Å; S177-S180 PolarHBondContact O-OG 2.73Å; S177-S180 PolarHBondContact OG-N 3.18Å; S177-S180 VanDerWaalsContact OG-N 3.11Å; S177-S180 PolarHBondContact OG-OG 3.06Å; S177-V181 PolarHBondContact O-N 2.65Å
178	P	63.4	Low	64.1	Low	64 Å²	64	84.4 Å²	84.4	42%	0.416	49%	0.488	S	S	.	.	H	α-helix	trans	-53	-32.1	173.6	-27.8	34.3	0	0	0	113.2	V181 I182	P178-V181 PolarHBondContact O-N 3.36Å; P178-I182 WeakPolarHBondContact O-CD1 3.26Å; P178-I182 VanDerWaalsContact O-CG1 3.27Å; P178-I182 WeakPolarHBondContact O-CG1 3.36Å; P178-I182 PolarHBondContact O-N 3.33Å; P178-I182 VanDerWaalsContact O-N 3.09Å
179	L	66.8	Low	63.2	Low	138 Å²	138	83 Å²	83	72%	0.723	48%	0.484	S	S	*	.	H	α-helix	trans	-66.5	-40.3	176.6	-69.8	172.4	0	0	0	112.8	S177 I182 S183	S177-L179 PolarHBondContact O-N 3.32Å; L179-I182 PolarHBondContact O-N 3.44Å; L179-S183 VanDerWaalsContact O-CB 3.25Å; L179-S183 WeakPolarHBondContact O-CB 3.44Å; L179-S183 PolarHBondContact O-N 3.16Å
180	S	67.9	Low	61.9	Low	36 Å²	36	89.9 Å²	89.9	25%	0.252	52%	0.519	S	S	.	.	H	α-helix	trans	-67.4	-35.7	175.9	39.8	0	0	0	0	112.6	S177 S183 N184	S177-S180 PolarHBondContact N-OG 3.11Å; S177-S180 VanDerWaalsContact N-OG 3.1Å; S177-S180 PolarHBondContact O-N 3.33Å; S177-S180 PolarHBondContact O-OG 2.73Å; S177-S180 PolarHBondContact OG-N 3.18Å; S177-S180 VanDerWaalsContact OG-N 3.11Å; S177-S180 PolarHBondContact OG-OG 3.06Å; S180-S183 PolarHBondContact O-N 3.09Å; S180-N184 WeakPolarHBondContact O-CB 3.41Å; S180-N184 PolarHBondContact O-N 2.65Å; S180-N184 PolarHBondContact O-ND2 3.43Å
181	V	65	Low	62	Low	13 Å²	13	92.3 Å²	92.3	8%	0.079	53%	0.533	C	S	.	.	H	α-helix	trans	-65.7	-46.4	176.1	-178.3	0	0	0	0	110.6	K166 D170 T176 S177 P178 Y185	K166-V181 HydrophobicContact CB-CG1 4.1Å; D170-V181 HydrophobicContact CB-CG2 3.92Å; D170-V181 WeakPolarHBondContact OD2-CG2 3.36Å; T176-V181 WeakPolarHBondContact OG1-CG2 3.45Å; S177-V181 PolarHBondContact O-N 2.65Å; P178-V181 PolarHBondContact O-N 3.36Å; V181-Y185 VanDerWaalsContact O-CB 3.29Å; V181-Y185 WeakPolarHBondContact O-CB 2.99Å; V181-Y185 PolarHBondContact O-N 3.1Å
182	I	65.5	Low	62.1	Low	80 Å²	80	93.4 Å²	93.4	41%	0.41	54%	0.535	S	S	.	.	H	α-helix	trans	-62.9	-44	175.9	-66.2	165.9	0	0	0	110.5	P178 L179 Y185 L186	P178-I182 WeakPolarHBondContact O-CD1 3.26Å; P178-I182 VanDerWaalsContact O-CG1 3.27Å; P178-I182 WeakPolarHBondContact O-CG1 3.36Å; P178-I182 PolarHBondContact O-N 3.33Å; P178-I182 VanDerWaalsContact O-N 3.09Å; L179-I182 PolarHBondContact O-N 3.44Å; I182-Y185 PolarHBondContact O-N 3.1Å; I182-L186 HydrophobicContact CG2-CD1 3.83Å; I182-L186 HydrophobicContact CG2-CG 4.41Å; I182-L186 WeakPolarHBondContact O-CG 3.47Å; I182-L186 PolarHBondContact O-N 3Å
183	S	70.1	Confident	62.3	Low	74 Å²	74	87.8 Å²	87.8	52%	0.517	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-46.9	179	-174.1	0	0	0	0	112.5	L179 S180 Y185 L186 G187	L179-S183 VanDerWaalsContact O-CB 3.25Å; L179-S183 WeakPolarHBondContact O-CB 3.44Å; L179-S183 PolarHBondContact O-N 3.16Å; S180-S183 PolarHBondContact O-N 3.09Å; S183-Y185 PolarHBondContact O-N 2.69Å; S183-L186 PolarHBondContact O-N 2.7Å; S183-G187 PolarHBondContact O-N 3.08Å
184	N	69.6	Low	62.3	Low	115 Å²	115	83.3 Å²	83.3	62%	0.615	51%	0.511	S	S	*	.	H	α-helix	trans	-62.5	-36.8	177.5	-73.6	-14.2	0	0	0	111.3	S180 A188	S180-N184 WeakPolarHBondContact O-CB 3.41Å; S180-N184 PolarHBondContact O-N 2.65Å; S180-N184 PolarHBondContact O-ND2 3.43Å; N184-A188 WeakPolarHBondContact O-CB 3.32Å; N184-A188 PolarHBondContact O-N 3.22Å
185	Y	63.8	Low	62.4	Low	49 Å²	49	84.1 Å²	84.1	19%	0.192	50%	0.497	C	S	.	.	H	α-helix	trans	-67.5	-44.6	177.5	-169.6	-94.7	0	0	0	113.5	R159 L163 V181 I182 S183	R159-Y185 WeakPolarHBondContact CD-OH 2.97Å; R159-Y185 HydrophobicContact CG-CE1 3.99Å; R159-Y185 WeakPolarHBondContact CG-OH 3.08Å; R159-Y185 VanDerWaalsContact NE-CZ 3.3Å; R159-Y185 PolarHBondContact NE-OH 3.41Å; L163-Y185 HydrophobicContact CD1-CD1 3.5Å; L163-Y185 HydrophobicContact CD1-CE1 3.44Å; L163-Y185 VanDerWaalsContact CD1-CE1 3.44Å; L163-Y185 HydrophobicContact CD1-CG 4.19Å; L163-Y185 VanDerWaalsContact CD2-CB 3.48Å; L163-Y185 HydrophobicContact CD2-CD1 3.41Å; L163-Y185 VanDerWaalsContact CD2-CD1 3.41Å; L163-Y185 HydrophobicContact CD2-CD2 3.55Å; L163-Y185 HydrophobicContact CD2-CE1 3.97Å; L163-Y185 HydrophobicContact CD2-CE2 4.11Å; L163-Y185 HydrophobicContact CD2-CG 3.15Å; L163-Y185 HydrophobicContact CG-CD1 3.61Å; L163-Y185 HydrophobicContact CG-CD2 4.02Å; L163-Y185 HydrophobicContact CG-CE1 3.63Å; L163-Y185 HydrophobicContact CG-CE2 4.07Å; L163-Y185 HydrophobicContact CG-CG 3.79Å; V181-Y185 VanDerWaalsContact O-CB 3.29Å; V181-Y185 WeakPolarHBondContact O-CB 2.99Å; V181-Y185 PolarHBondContact O-N 3.1Å; I182-Y185 PolarHBondContact O-N 3.1Å; S183-Y185 PolarHBondContact O-N 2.69Å
186	L	68.2	Low	62.5	Low	101 Å²	101	83.5 Å²	83.5	53%	0.529	49%	0.487	S	S	.	.	H	α-helix	trans	-71.2	-33.7	176.2	-68.5	171.9	0	0	0	111.6	I182 S183 E189	I182-L186 HydrophobicContact CG2-CD1 3.83Å; I182-L186 HydrophobicContact CG2-CG 4.41Å; I182-L186 WeakPolarHBondContact O-CG 3.47Å; I182-L186 PolarHBondContact O-N 3Å; S183-L186 PolarHBondContact O-N 2.7Å; L186-E189 WeakPolarHBondContact O-CB 3.3Å; L186-E189 PolarHBondContact O-N 3.31Å
187	G	65.5	Low	62.7	Low	48 Å²	48	85.4 Å²	85.4	50%	0.495	50%	0.497	S	S	.	.	H	α-helix	trans	-71.7	-29.2	178.4	0	0	0	0	0	113.8	S183 E189 M190	S183-G187 PolarHBondContact O-N 3.08Å; G187-E189 PolarHBondContact O-N 2.87Å; G187-M190 PolarHBondContact O-N 3.36Å
188	A	57.4	Low	62.5	Low	82 Å²	82	87.2 Å²	87.2	68%	0.678	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-0.3	172.2	0	0	0	0	0	113.7	N184	N184-A188 WeakPolarHBondContact O-CB 3.32Å; N184-A188 PolarHBondContact O-N 3.22Å
189	E	49.2	Very low	62.5	Low	95 Å²	95	89.1 Å²	89.1	44%	0.444	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	0.9	176.5	-61.5	-165.6	87.9	0	0	115	R159 L186 G187	R159-E189 IonicContact CZ-OE1 2.74Å; R159-E189 IonicContact CZ-OE2 3.19Å; R159-E189 IonicContact NE-OE1 2.82Å; R159-E189 IonicContact NH1-OE1 3.67Å; R159-E189 PolarHBondContact NH1-OE1 3.27Å; R159-E189 IonicContact NH1-OE2 3.47Å; R159-E189 IonicContact NH2-OE1 2.66Å; R159-E189 PolarHBondContact NH2-OE1 3.22Å; R159-E189 IonicContact NH2-OE2 2.6Å; R159-E189 PolarHBondContact NH2-OE2 3.37Å; L186-E189 WeakPolarHBondContact O-CB 3.3Å; L186-E189 PolarHBondContact O-N 3.31Å; G187-E189 PolarHBondContact O-N 2.87Å
190	M	40.5	Very low	62.1	Low	238 Å²	238	84.6 Å²	84.6	100%	1.172	49%	0.489	S	S	*	.			trans	-90	0	164.4	-70.4	-159.5	-158.6	0	0	110.5	G187	G187-M190 PolarHBondContact O-N 3.36Å

Retrieved 190 of 190 residues in 33.2 ms (Link to these results)

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