A0A5K4F4J5_SCHMA Loading...

Muscleblind-like protein

AlphaFold DB , UniProt , Accession A0A5K4F4J5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 420 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.3	Very low	45.7	Very low	245 Å²	245	128.7 Å²	128.7	100%	1.207	68%	0.679	S	S	*	*				0	53.2	0	-73.1	175.7	159.6	0	0	112.1
2	I	39.7	Very low	46.2	Very low	158 Å²	158	134.5 Å²	134.5	81%	0.81	68%	0.684	S	S	*	*			trans	-137.9	78.6	-173.3	-48.9	174.2	0	0	0	109.4
3	H	42.9	Very low	46.2	Very low	201 Å²	201	137 Å²	137	93%	0.931	69%	0.688	S	S	*	*			trans	-151.6	10.3	171.9	-111.5	-79.5	0	0	0	116.8
4	S	46.6	Very low	46.6	Very low	94 Å²	94	133.9 Å²	133.9	66%	0.657	67%	0.674	S	S	*	*	S	Bend	trans	-106.7	2	-171.4	-149.5	0	0	0	0	116.5
5	S	46.1	Very low	47.1	Very low	105 Å²	105	135.4 Å²	135.4	73%	0.734	67%	0.668	S	S	*	*	S	Bend	trans	-96.1	-14.9	-168.6	-51.1	0	0	0	0	115.5
6	K	48.8	Very low	47.2	Very low	192 Å²	192	136.9 Å²	136.9	84%	0.835	67%	0.67	S	S	*	*	S	Bend	trans	-85.1	-24.8	-171.6	-70.2	180	178.8	176.2	0	114.2
7	S	48.7	Very low	47.3	Very low	44 Å²	44	132.5 Å²	132.5	31%	0.308	66%	0.661	S	S	.	*	H	α-helix	trans	-79	-18	178.8	44.1	0	0	0	0	114.6	Y11	S7-Y11 VanDerWaalsContact O-CD2 3.27Å; S7-Y11 WeakPolarHBondContact O-CD2 3.46Å
8	N	45.5	Very low	47.6	Very low	108 Å²	108	129.8 Å²	129.8	58%	0.578	65%	0.646	S	S	*	*	H	α-helix	trans	-76.8	-19.9	-178.9	-84.3	-24.3	0	0	0	114.1	R12	N8-R12 PolarHBondContact O-N 3.43Å
9	S	46.5	Very low	47.5	Very low	70 Å²	70	132.9 Å²	132.9	49%	0.49	65%	0.651	S	S	.	*	H	α-helix	trans	-71.4	-39.5	-178.9	-169	0	0	0	0	112.4	Y11 R12 F13	S9-Y11 PolarHBondContact O-N 3.48Å; S9-R12 PolarHBondContact O-N 3.46Å; S9-F13 PolarHBondContact O-N 3.49Å
10	I	50.9	Low	47.7	Very low	114 Å²	114	133.2 Å²	133.2	59%	0.585	66%	0.655	S	S	*	*	H	α-helix	trans	-66	-41.4	179.6	-62.3	171.4	0	0	0	110.7	R12 F13 L14	I10-R12 VanDerWaalsContact C-N 3.31Å; I10-R12 PolarHBondContact O-N 3.4Å; I10-F13 PolarHBondContact O-N 3.47Å; I10-L14 HydrophobicContact CG2-CD1 4.02Å; I10-L14 WeakPolarHBondContact O-CG 3.38Å; I10-L14 PolarHBondContact O-N 2.84Å; I10-L14 VanDerWaalsContact O-N 3.1Å
11	Y	46.8	Very low	47.6	Very low	85 Å²	85	131.4 Å²	131.4	33%	0.333	65%	0.645	S	S	.	*	H	α-helix	trans	-64.9	-31.8	175.6	-75.5	-75.9	0	0	0	112.9	S7 S9 R15 D185	S7-Y11 VanDerWaalsContact O-CD2 3.27Å; S7-Y11 WeakPolarHBondContact O-CD2 3.46Å; S9-Y11 PolarHBondContact O-N 3.48Å; Y11-R15 WeakPolarHBondContact O-CB 3.37Å; Y11-R15 PolarHBondContact O-N 2.98Å; Y11-R15 VanDerWaalsContact O-N 3.1Å; Y11-D185 PolarHBondContact OH-OD1 2.88Å
12	R	51.2	Low	47.8	Very low	198 Å²	198	125.5 Å²	125.5	75%	0.747	62%	0.618	S	S	*	*	H	α-helix	trans	-69.1	-39.1	175	-87.3	-173.1	-177.1	160.1	1.2	112.6	N8 S9 I10 K16	N8-R12 PolarHBondContact O-N 3.43Å; S9-R12 PolarHBondContact O-N 3.46Å; I10-R12 VanDerWaalsContact C-N 3.31Å; I10-R12 PolarHBondContact O-N 3.4Å; R12-K16 PolarHBondContact O-N 3.35Å
13	F	46.8	Very low	47.7	Very low	167 Å²	167	125.7 Å²	125.7	73%	0.732	62%	0.615	S	S	*	*	H	α-helix	trans	-70.2	-42.6	179.2	-98	-86.4	0	0	0	112.4	S9 I10 K16 A17	S9-F13 PolarHBondContact O-N 3.49Å; I10-F13 PolarHBondContact O-N 3.47Å; F13-K16 PolarHBondContact O-N 3.38Å; F13-A17 PolarHBondContact O-N 3.41Å
14	L	51.5	Low	47.6	Very low	94 Å²	94	124.3 Å²	124.3	49%	0.492	61%	0.607	S	S	.	*	H	α-helix	trans	-66	-40.1	176.6	-67.7	173.1	0	0	0	112.1	I10 K16 A17 E18	I10-L14 HydrophobicContact CG2-CD1 4.02Å; I10-L14 WeakPolarHBondContact O-CG 3.38Å; I10-L14 PolarHBondContact O-N 2.84Å; I10-L14 VanDerWaalsContact O-N 3.1Å; L14-K16 VanDerWaalsContact C-N 3.28Å; L14-K16 PolarHBondContact O-N 2.97Å; L14-A17 PolarHBondContact O-N 3.37Å; L14-E18 PolarHBondContact O-N 2.74Å
15	R	53.9	Low	47.4	Very low	156 Å²	156	125 Å²	125	59%	0.589	61%	0.609	S	S	*	*	H	α-helix	trans	-65.5	-30.5	178.6	-156.4	-169.4	-67.2	-167.5	-3.4	112.7	Y11 Y19	Y11-R15 WeakPolarHBondContact O-CB 3.37Å; Y11-R15 PolarHBondContact O-N 2.98Å; Y11-R15 VanDerWaalsContact O-N 3.1Å; R15-Y19 PolarHBondContact O-N 3.2Å
16	K	49.1	Very low	47.2	Very low	159 Å²	159	127.4 Å²	127.4	69%	0.691	61%	0.614	S	S	*	*	H	α-helix	trans	-76.8	-27.3	178.6	-146.3	170.3	-174	-178.4	0	112.6	R12 F13 L14	R12-K16 PolarHBondContact O-N 3.35Å; F13-K16 PolarHBondContact O-N 3.38Å; L14-K16 VanDerWaalsContact C-N 3.28Å; L14-K16 PolarHBondContact O-N 2.97Å
17	A	48.5	Very low	47	Very low	63 Å²	63	125.1 Å²	125.1	52%	0.521	61%	0.606	S	S	.	*	H	α-helix	trans	-77.6	-40.6	175.2	0	0	0	0	0	112.5	F13 L14	F13-A17 PolarHBondContact O-N 3.41Å; L14-A17 PolarHBondContact O-N 3.37Å
18	E	52.8	Low	46.8	Very low	84 Å²	84	130 Å²	130	39%	0.393	63%	0.629	S	S	.	*	H	α-helix	trans	-69.4	-31.8	178.4	-90.7	-173.4	140.6	0	0	113.3	L14 R191	L14-E18 PolarHBondContact O-N 2.74Å; E18-R191 IonicContact OE1-CZ 3.18Å; E18-R191 IonicContact OE1-NH1 2.97Å; E18-R191 PolarHBondContact OE1-NH1 2.81Å
19	Y	46.7	Very low	47.1	Very low	188 Å²	188	133.3 Å²	133.3	74%	0.737	64%	0.638	S	S	*	*	H	α-helix	trans	-76.3	-23.7	-178.1	-132.2	-89.3	0	0	0	113.8	R15	R15-Y19 PolarHBondContact O-N 3.2Å
20	L	50	Low	46.9	Very low	138 Å²	138	140.2 Å²	140.2	72%	0.723	66%	0.659	S	S	*	*	H	α-helix	trans	-87.7	-22.4	178.7	-83.6	161.7	0	0	0	113.2
21	E	47.3	Very low	47.1	Very low	97 Å²	97	144.7 Å²	144.7	45%	0.453	67%	0.674	S	S	.	*	H	α-helix	trans	-95.5	-6	-177.4	-132.3	-171.9	164.1	0	0	113.8	Y195 K199	E21-Y195 VanDerWaalsContact CD-OH 3.28Å; E21-Y195 PolarHBondContact OE1-OH 3.34Å; E21-Y195 PolarHBondContact OE2-OH 2.82Å; E21-K199 IonicContact OE1-NZ 2.81Å; E21-K199 PolarHBondContact OE1-NZ 3.19Å
22	L	42.9	Very low	47	Very low	121 Å²	121	149.3 Å²	149.3	63%	0.634	70%	0.696	S	S	*	*	S	Bend	trans	-95.8	0.2	179.6	-78.2	170.9	0	0	0	114.9	F24	L22-F24 PolarHBondContact O-N 3.16Å
23	Q	38.7	Very low	47.4	Very low	161 Å²	161	148 Å²	148	75%	0.752	70%	0.704	S	S	*	*			trans	-89.5	79.4	176	-133.5	141.8	14	0	0	109.5
24	F	41.3	Very low	47.1	Very low	172 Å²	172	145 Å²	145	75%	0.754	70%	0.703	S	S	*	*			trans	-66.8	130	172.6	-71.4	-85	0	0	0	110.1	L22 N26	L22-F24 PolarHBondContact O-N 3.16Å; F24-N26 PolarHBondContact O-N 3.4Å
25	P	42.3	Very low	46.9	Very low	110 Å²	110	152.5 Å²	152.5	71%	0.714	73%	0.725	S	S	*	*			trans	-70.9	123.3	169.8	27.3	-29.1	0	0	0	109.3	E27	P25-E27 PolarHBondContact O-N 3.14Å
26	N	40.5	Very low	46.4	Very low	155 Å²	155	148.8 Å²	148.8	83%	0.829	73%	0.728	S	S	*	*			trans	-68.9	106.5	168.3	-124.3	-12.3	0	0	0	107.7	F24 D28	F24-N26 PolarHBondContact O-N 3.4Å; N26-D28 PolarHBondContact O-N 3.24Å; N26-D28 VanDerWaalsContact O-N 3.16Å
27	E	45.4	Very low	46.2	Very low	143 Å²	143	148.9 Å²	148.9	67%	0.668	74%	0.735	S	S	*	*			trans	-79.7	87.6	172.3	-80.3	-99.7	143.3	0	0	109.3	P25 K29	P25-E27 PolarHBondContact O-N 3.14Å; E27-K29 PolarHBondContact O-N 3.46Å; E27-K29 IonicContact OE2-NZ 2.81Å; E27-K29 PolarHBondContact OE2-NZ 3.04Å
28	D	44	Very low	45.9	Very low	148 Å²	148	151.1 Å²	151.1	79%	0.791	74%	0.742	S	S	*	*			trans	-75.1	107.3	162.7	-82.2	-45.2	0	0	0	109.7	N26	N26-D28 PolarHBondContact O-N 3.24Å; N26-D28 VanDerWaalsContact O-N 3.16Å
29	K	51.5	Low	45.7	Very low	177 Å²	177	151.4 Å²	151.4	77%	0.77	75%	0.754	S	S	*	*			trans	-109.2	89.5	167.8	-87.4	-177	173.1	111.9	0	110.7	E27	E27-K29 PolarHBondContact O-N 3.46Å; E27-K29 IonicContact OE2-NZ 2.81Å; E27-K29 PolarHBondContact OE2-NZ 3.04Å
30	K	43.1	Very low	45.5	Very low	215 Å²	215	149.3 Å²	149.3	94%	0.935	76%	0.755	S	S	*	*			trans	-85.5	108.4	165.9	-165.2	176.3	-172.8	175.8	0	108.6
31	K	55	Low	45.4	Very low	207 Å²	207	148.8 Å²	148.8	90%	0.9	76%	0.758	S	S	*	*			trans	-98.7	121	172	-151.5	177.6	-176.7	-173.6	0	109.5
32	K	44.4	Very low	45.4	Very low	182 Å²	182	148.5 Å²	148.5	79%	0.791	77%	0.767	S	S	*	*			trans	-63.5	140.4	173.8	-75.1	171.1	170	175.5	0	110.7
33	D	59.3	Low	45.5	Very low	172 Å²	172	149 Å²	149	92%	0.92	78%	0.775	S	S	*	*			trans	-137.8	130.2	142.2	-82	-41.8	0	0	0	108.3
34	S	41.8	Very low	45.7	Very low	102 Å²	102	146.4 Å²	146.4	71%	0.713	78%	0.775	S	S	*	*			trans	-146.9	120.7	-178.8	51.4	0	0	0	0	109.2
35	R	45.6	Very low	46.2	Very low	253 Å²	253	143.4 Å²	143.4	96%	0.955	77%	0.772	S	S	*	*			trans	170.6	137.6	154.6	-99.7	175.5	-179.2	-160.6	-0.1	106.4
36	A	43.3	Very low	46.4	Very low	77 Å²	77	147.5 Å²	147.5	64%	0.636	78%	0.779	S	S	*	*			cis	-168.1	147.1	-6.9	0	0	0	0	0	106.6
37	L	45.2	Very low	46.7	Very low	162 Å²	162	145 Å²	145	85%	0.848	77%	0.773	S	S	*	*			trans	44.2	129	134.9	-68.1	164.2	0	0	0	118.5
38	T	43.7	Very low	46.9	Very low	110 Å²	110	144.1 Å²	144.1	68%	0.675	78%	0.778	S	S	*	*			cis	-168.2	161.1	33.2	43.3	0	0	0	0	111.2
39	S	47.5	Very low	47	Very low	90 Å²	90	141.1 Å²	141.1	63%	0.629	77%	0.768	S	S	*	*			trans	59.1	134	142.1	50	0	0	0	0	119.8
40	D	43.4	Very low	46.6	Very low	144 Å²	144	139.7 Å²	139.7	77%	0.77	77%	0.769	S	S	*	*			cis	-172.5	150.6	16.5	-95.8	-21.6	0	0	0	110
41	T	47.1	Very low	46.6	Very low	126 Å²	126	135.9 Å²	135.9	77%	0.773	76%	0.764	S	S	*	*			trans	56.5	126	131.2	-51.2	0	0	0	0	118.7
42	S	46.6	Very low	45.9	Very low	92 Å²	92	130.9 Å²	130.9	64%	0.643	76%	0.755	S	S	*	*			cis	179	166.4	19.7	52.8	0	0	0	0	111.9
43	T	45.3	Very low	46	Very low	132 Å²	132	127.1 Å²	127.1	81%	0.81	75%	0.752	S	S	*	*			trans	74.1	136.5	146.8	-38.6	0	0	0	0	118.2
44	S	43.1	Very low	45.2	Very low	106 Å²	106	124.4 Å²	124.4	74%	0.741	74%	0.741	S	S	*	*			cis	-177.5	150.5	-22.3	-175.5	0	0	0	0	104.9
45	P	52	Low	45.6	Very low	109 Å²	109	127.2 Å²	127.2	71%	0.708	75%	0.748	S	S	*	*			trans	-109.4	167.7	-167.3	39.3	-30.3	0	0	0	113.7
46	K	46.1	Very low	45.5	Very low	195 Å²	195	119.7 Å²	119.7	85%	0.848	73%	0.734	S	S	*	*			trans	177.2	136.1	138.6	-108.6	169	-179.8	174.9	0	116.2
47	S	47.1	Very low	45.7	Very low	102 Å²	102	121.1 Å²	121.1	71%	0.713	73%	0.734	S	S	*	*			trans	71.2	143.9	136.2	68.6	0	0	0	0	118.4
48	V	49.1	Very low	45.7	Very low	126 Å²	126	119.7 Å²	119.7	76%	0.764	73%	0.728	S	S	*	*			cis	-166	139.6	26.6	-131.2	0	0	0	0	110.7
49	S	47.6	Very low	45.8	Very low	84 Å²	84	122.1 Å²	122.1	59%	0.587	74%	0.737	S	S	*	*			trans	44.5	128.3	134.2	60.4	0	0	0	0	125.1
50	N	41.8	Very low	46.1	Very low	147 Å²	147	126.1 Å²	126.1	79%	0.786	75%	0.75	S	S	*	*				57.1	139.9	121.8	-49.9	-12.1	0	0	0	118.6
51	T	42.9	Very low	46.7	Very low	135 Å²	135	124.2 Å²	124.2	83%	0.828	75%	0.745	S	S	*	*				-179	159.2	54.8	-23.4	0	0	0	0	110.2
52	S	42.1	Very low	47	Very low	103 Å²	103	124 Å²	124	72%	0.72	75%	0.746	S	S	*	*			trans	-62.7	178.7	-174.9	-44.6	0	0	0	0	118.8
53	S	44.8	Very low	46.8	Very low	103 Å²	103	127.9 Å²	127.9	72%	0.72	76%	0.759	S	S	*	*			trans	96	137.6	153.7	-28.6	0	0	0	0	113.8
54	T	44.3	Very low	47.1	Very low	114 Å²	114	127.6 Å²	127.6	70%	0.699	76%	0.762	S	S	*	*			cis	175.8	148.8	14.8	11.4	0	0	0	0	107.9
55	L	49.7	Very low	47	Very low	162 Å²	162	127.8 Å²	127.8	85%	0.848	76%	0.764	S	S	*	*			trans	65.7	151.8	146.5	-59	162.7	0	0	0	118
56	S	43.9	Very low	46.7	Very low	94 Å²	94	127.8 Å²	127.8	66%	0.657	77%	0.766	S	S	*	*			cis	177.2	164.4	-14	-175.4	0	0	0	0	107
57	V	46.8	Very low	46.6	Very low	107 Å²	107	123.4 Å²	123.4	65%	0.648	76%	0.76	S	S	*	*			trans	86.3	108.4	151	-152.2	0	0	0	0	121.6
58	N	44.2	Very low	46.4	Very low	133 Å²	133	123.6 Å²	123.6	71%	0.711	76%	0.761	S	S	*	*			trans	58.9	127.5	136.2	-50.8	-7.6	0	0	0	123.2
59	N	46.5	Very low	46.3	Very low	161 Å²	161	124.9 Å²	124.9	86%	0.861	77%	0.769	S	S	*	*				179	138	100	-87.6	-31	0	0	0	112.3
60	L	54.9	Low	45.9	Very low	173 Å²	173	126.1 Å²	126.1	91%	0.906	78%	0.778	S	S	*	*			trans	-87.4	169.3	177	-104.1	105.4	0	0	0	112.4
61	P	55.4	Low	45.9	Very low	104 Å²	104	124.1 Å²	124.1	68%	0.675	78%	0.776	S	S	*	*			trans	-106	-169.6	-154.6	42.6	-34.7	0	0	0	113.7
62	P	52.4	Low	46.1	Very low	121 Å²	121	124 Å²	124	79%	0.786	78%	0.775	S	S	*	*			trans	-138.3	161.6	144.6	35.8	-19.7	0	0	0	116.1
63	L	42.2	Very low	46.2	Very low	174 Å²	174	126.3 Å²	126.3	91%	0.911	78%	0.777	S	S	*	*			trans	-65.1	156.8	178.7	-67	85.7	0	0	0	114.1
64	S	51.5	Low	46.3	Very low	127 Å²	127	127.9 Å²	127.9	89%	0.888	78%	0.783	S	S	*	*			trans	-147.8	137.1	147.3	40.8	0	0	0	0	111.8
65	S	42	Very low	46.1	Very low	110 Å²	110	128 Å²	128	77%	0.769	78%	0.784	S	S	*	*			trans	-99.2	165	-173.5	46.2	0	0	0	0	112.4
66	S	46	Very low	46	Very low	108 Å²	108	126.5 Å²	126.5	76%	0.755	79%	0.787	S	S	*	*			trans	127.6	110.3	156.8	62.1	0	0	0	0	111
67	S	42.6	Very low	45.8	Very low	104 Å²	104	126.6 Å²	126.6	73%	0.727	79%	0.793	S	S	*	*				93.7	121	56.4	66.4	0	0	0	0	113.8
68	S	43.5	Very low	45.9	Very low	106 Å²	106	128.3 Å²	128.3	74%	0.741	80%	0.804	S	S	*	*			trans	75.9	118.9	145	-47.2	0	0	0	0	119.7
69	T	46.6	Very low	45.8	Very low	152 Å²	152	126.7 Å²	126.7	93%	0.933	80%	0.803	S	S	*	*				172.1	157.1	108.6	34.7	0	0	0	0	112.3
70	S	39.7	Very low	45.9	Very low	111 Å²	111	125.7 Å²	125.7	78%	0.776	80%	0.803	S	S	*	*			trans	-103.3	169.3	-158.9	-164.1	0	0	0	0	113
71	S	41.7	Very low	45.4	Very low	104 Å²	104	124.5 Å²	124.5	73%	0.727	80%	0.797	S	S	*	*			trans	71	128.3	154.5	58.1	0	0	0	0	120.2
72	V	47.8	Very low	45	Very low	134 Å²	134	126 Å²	126	81%	0.812	81%	0.805	S	S	*	*				175.2	137.7	104.2	163	0	0	0	0	109.8
73	I	44.1	Very low	44.4	Very low	151 Å²	151	131.3 Å²	131.3	77%	0.774	81%	0.809	S	S	*	*			trans	-77.2	138.6	180	-63.4	160.9	0	0	0	110.3
74	T	46.3	Very low	44.5	Very low	135 Å²	135	130.7 Å²	130.7	83%	0.828	81%	0.805	S	S	*	*			trans	-154.1	127.8	143.2	-43.1	0	0	0	0	112
75	T	40.9	Very low	44.7	Very low	117 Å²	117	134.1 Å²	134.1	72%	0.718	80%	0.804	S	S	*	*			trans	-60	146.5	172.9	37.5	0	0	0	0	115.6
76	S	46.6	Very low	44.7	Very low	131 Å²	131	136 Å²	136	92%	0.916	81%	0.806	S	S	*	*			trans	-159.6	120.3	145.5	-73.1	0	0	0	0	110.1
77	A	40.1	Very low	44.5	Very low	96 Å²	96	140 Å²	140	79%	0.793	81%	0.813	S	S	*	*			trans	-85.3	143	-178	0	0	0	0	0	111.7
78	T	48	Very low	44.6	Very low	143 Å²	143	142 Å²	142	88%	0.877	82%	0.815	S	S	*	*			trans	-150.8	123	145.6	-35.9	0	0	0	0	110.5
79	S	42.4	Very low	44.5	Very low	98 Å²	98	143.5 Å²	143.5	69%	0.685	82%	0.819	S	S	*	*			trans	-68	147.1	-179	43.3	0	0	0	0	114.6
80	T	48.4	Very low	44.4	Very low	140 Å²	140	143 Å²	143	86%	0.859	81%	0.81	S	S	*	*			trans	-175.4	100.5	131.3	22.5	0	0	0	0	112
81	N	44.9	Very low	44.1	Very low	148 Å²	148	144 Å²	144	79%	0.791	81%	0.807	S	S	*	*			trans	32.8	113.4	131.8	-136.9	-30.1	0	0	0	119
82	T	46.2	Very low	43.7	Very low	137 Å²	137	146.9 Å²	146.9	84%	0.84	81%	0.814	S	S	*	*				-174.6	119	124.5	25.2	0	0	0	0	112.7
83	R	41.4	Very low	43.1	Very low	232 Å²	232	146 Å²	146	88%	0.875	81%	0.814	S	S	*	*			trans	68.3	92.1	138.8	-146.5	174.8	-156.8	-154.5	5.3	119.9
84	I	43.9	Very low	42.9	Very low	161 Å²	161	145 Å²	145	83%	0.826	82%	0.815	S	S	*	*			trans	-59.6	128.1	158	-62.6	166	0	0	0	110.1
85	K	55.2	Low	42.5	Very low	199 Å²	199	143.9 Å²	143.9	87%	0.865	81%	0.808	S	S	*	*			trans	-135.7	130.8	157.1	-149.5	175.5	-173.8	-178.6	0	108.2
86	N	42.2	Very low	42.5	Very low	149 Å²	149	147.9 Å²	147.9	80%	0.797	82%	0.816	S	S	*	*			trans	-51.3	133.5	-160.3	-66.4	-32.5	0	0	0	116
87	Q	43	Very low	41.9	Very low	193 Å²	193	145.5 Å²	145.5	90%	0.902	81%	0.812	S	S	*	*			trans	-70.3	123.1	161.2	-65.6	174.8	-3.7	0	0	109.2
88	N	42.7	Very low	42	Very low	144 Å²	144	146.3 Å²	146.3	77%	0.77	81%	0.812	S	S	*	*			trans	-156.5	74.9	153	-140.2	-5.3	0	0	0	108.2
89	V	42.5	Very low	42	Very low	138 Å²	138	150.3 Å²	150.3	84%	0.836	81%	0.811	S	S	*	*			trans	-137.2	94.2	169.3	-179.6	0	0	0	0	106.5	N91	V89-N91 PolarHBondContact O-N 3.17Å
90	L	43.6	Very low	42.2	Very low	143 Å²	143	153.1 Å²	153.1	75%	0.749	82%	0.818	S	S	*	*			trans	-64.7	112.1	164.9	-96.9	86.1	0	0	0	108.7
91	N	34.1	Very low	42.7	Very low	132 Å²	132	156.9 Å²	156.9	71%	0.706	82%	0.816	S	S	*	*				46.9	88.6	129.1	-52.6	-9.7	0	0	0	117	V89	V89-N91 PolarHBondContact O-N 3.17Å
92	N	34.4	Very low	43.6	Very low	163 Å²	163	158.5 Å²	158.5	87%	0.872	81%	0.812	S	S	*	*			trans	-135.5	81.5	145.4	-109.2	-5.7	0	0	0	108.4	T94	N92-T94 PolarHBondContact O-N 3.48Å
93	S	34.7	Very low	44.7	Very low	116 Å²	116	157.1 Å²	157.1	81%	0.811	80%	0.796	S	S	*	*			trans	-72.7	91.4	169.4	-63	0	0	0	0	108.9
94	T	40.3	Very low	46.7	Very low	129 Å²	129	149.2 Å²	149.2	79%	0.791	77%	0.771	S	S	*	*			trans	-134.6	92.8	151.3	-35.7	0	0	0	0	107.7	N92	N92-T94 PolarHBondContact O-N 3.48Å
95	T	37.1	Very low	48.7	Very low	113 Å²	113	144.1 Å²	144.1	69%	0.693	74%	0.741	S	S	*	*			trans	-50.7	153.5	171.8	36	0	0	0	0	113.1
96	F	40.2	Very low	50.3	Low	201 Å²	201	135 Å²	135	88%	0.882	70%	0.702	S	S	*	*	S	Bend	trans	97.2	109.4	178.9	-57.8	-72.1	0	0	0	115.6	S98	F96-S98 PolarHBondContact O-N 3.35Å; F96-S98 VanDerWaalsContact O-N 3.12Å
97	G	35.1	Very low	52.7	Low	80 Å²	80	129.7 Å²	129.7	83%	0.825	67%	0.672	S	S	*	*			trans	-42.9	109.1	-170.3	0	0	0	0	0	115.1	R99	G97-R99 PolarHBondContact O-N 2.99Å
98	S	41.2	Very low	55.1	Low	114 Å²	114	121.6 Å²	121.6	80%	0.797	63%	0.633	S	S	*	*			trans	-73.7	74.2	171.4	-161.4	0	0	0	0	109.5	F96 N100	F96-S98 PolarHBondContact O-N 3.35Å; F96-S98 VanDerWaalsContact O-N 3.12Å; S98-N100 PolarHBondContact O-N 3.11Å; S98-N100 VanDerWaalsContact O-N 3.07Å
99	R	48.6	Very low	57.6	Low	227 Å²	227	117.6 Å²	117.6	86%	0.857	62%	0.615	S	S	*	*			trans	-55.8	115.7	148.2	-71.6	-175.3	-166.6	161	5.2	103.7	G97 R101	G97-R99 PolarHBondContact O-N 2.99Å; R99-R101 WeakPolarHBondContact O-CA 3.48Å; R99-R101 PolarHBondContact O-N 3.42Å
100	N	47.4	Very low	60	Low	156 Å²	156	111.8 Å²	111.8	83%	0.834	58%	0.579	S	S	*	*			trans	-47.2	86.9	178.6	-163.2	-12	0	0	0	108.9	S98 R102	S98-N100 PolarHBondContact O-N 3.11Å; S98-N100 VanDerWaalsContact O-N 3.07Å; N100-R102 PolarHBondContact O-N 3.09Å
101	R	58.8	Low	62.4	Low	219 Å²	219	105.5 Å²	105.5	83%	0.826	55%	0.547	S	S	*	.			trans	-71	112.5	-170.8	-95.8	-175.5	178.3	-179.1	0.3	103.1	R99 Q103	R99-R101 WeakPolarHBondContact O-CA 3.48Å; R99-R101 PolarHBondContact O-N 3.42Å; R101-Q103 PolarHBondContact O-N 3Å; R101-Q103 VanDerWaalsContact O-N 3.12Å
102	R	63.4	Low	65.2	Low	183 Å²	183	105.2 Å²	105.2	69%	0.691	55%	0.545	S	S	*	.			trans	-37.2	125.1	170.5	-72.5	175.8	173.9	-102.8	4.3	107.4	N100 D104 E198	N100-R102 PolarHBondContact O-N 3.09Å; R102-D104 PolarHBondContact O-N 3.24Å; R102-E198 IonicContact NH1-OE2 2.95Å; R102-E198 PolarHBondContact NH1-OE2 3.46Å
103	Q	68.5	Low	67.8	Low	108 Å²	108	102.7 Å²	102.7	51%	0.505	53%	0.527	S	S	.	.			trans	-56	120.6	-175.6	-168.6	160	27.5	0	0	108.5	R101 W105 Q194	R101-Q103 PolarHBondContact O-N 3Å; R101-Q103 VanDerWaalsContact O-N 3.12Å; Q103-W105 VanDerWaalsContact C-N 3.31Å; Q103-W105 PolarHBondContact O-N 2.97Å; Q103-Q194 PolarHBondContact O-NE2 3.5Å
104	D	83	Confident	70.6	Confident	66 Å²	66	99.2 Å²	99.2	35%	0.353	50%	0.497	S	S	.	.			trans	-71.1	89.2	-179.2	-74.9	-28.4	0	0	0	108.3	R102 C106 K107	R102-D104 PolarHBondContact O-N 3.24Å; D104-C106 PolarHBondContact O-N 3.17Å; D104-K107 HydrophobicContact CB-CD 4Å; D104-K107 HydrophobicContact CB-CG 3.8Å; D104-K107 PolarHBondContact O-N 3.36Å; D104-K107 WeakPolarHBondContact OD2-CE 3.47Å
105	W	85.9	Confident	73	Confident	53 Å²	53	98 Å²	98	20%	0.201	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-17	179.2	62.2	-90.6	0	0	0	113.3	Q103 K107 F159 I187 R191	Q103-W105 VanDerWaalsContact C-N 3.31Å; Q103-W105 PolarHBondContact O-N 2.97Å; W105-K107 VanDerWaalsContact C-N 3.3Å; W105-F159 HydrophobicContact CD2-CE1 4.46Å; W105-F159 AromaticContact CE2-CE1 3.93Å; W105-F159 HydrophobicContact CE3-CE1 4.33Å; W105-F159 AromaticContact CH2-CD1 3.4Å; W105-F159 HydrophobicContact CH2-CD1 3.4Å; W105-F159 VanDerWaalsContact CH2-CD1 3.4Å; W105-F159 AromaticContact CH2-CE1 3.21Å; W105-F159 HydrophobicContact CH2-CE1 3.21Å; W105-F159 HydrophobicContact CH2-CZ 4.47Å; W105-F159 AromaticContact CZ2-CD1 3.89Å; W105-F159 HydrophobicContact CZ2-CD1 3.89Å; W105-F159 AromaticContact CZ2-CE1 3.3Å; W105-F159 HydrophobicContact CZ2-CE1 3.3Å; W105-F159 HydrophobicContact CZ2-CZ 4.25Å; W105-F159 AromaticContact CZ3-CD1 4Å; W105-F159 HydrophobicContact CZ3-CD1 4Å; W105-F159 AromaticContact CZ3-CE1 3.74Å; W105-F159 HydrophobicContact CZ3-CE1 3.74Å; W105-I187 HydrophobicContact CE3-CG2 3.89Å; W105-I187 HydrophobicContact CZ3-CG2 4.14Å; W105-R191 HydrophobicContact CB-CB 4.41Å; W105-R191 HydrophobicContact CD2-CB 4.23Å; W105-R191 HydrophobicContact CD2-CG 3.99Å; W105-R191 HydrophobicContact CE3-CB 4.21Å; W105-R191 HydrophobicContact CE3-CG 4.3Å; W105-R191 HydrophobicContact CG-CB 4.34Å; W105-R191 HydrophobicContact CG-CG 4.19Å
106	C	88.8	Confident	75.5	Confident	8 Å²	8	97.8 Å²	97.8	5%	0.054	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-3	174.7	65.5	0	0	0	0	114.1	D104 R156 V157 F159	D104-C106 PolarHBondContact O-N 3.17Å; C106-R156 WeakPolarHBondContact O-CA 2.9Å; C106-V157 WeakPolarHBondContact O-CB 3.36Å; C106-V157 WeakPolarHBondContact O-CG2 3.25Å; C106-V157 PolarHBondContact O-N 3.14Å; C106-F159 HydrophobicContact CB-CE1 3.54Å; C106-F159 HydrophobicContact CB-CE2 4.38Å; C106-F159 HydrophobicContact CB-CZ 3.43Å; C106-F159 VanDerWaalsContact CB-CZ 3.43Å
107	K	92.5	Very high	77.8	Confident	38 Å²	38	91.9 Å²	91.9	17%	0.165	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	132.7	171.1	-63.4	-173.2	178.4	-157.8	0	111	D104 W105 D152 Q154 V155	D104-K107 HydrophobicContact CB-CD 4Å; D104-K107 HydrophobicContact CB-CG 3.8Å; D104-K107 PolarHBondContact O-N 3.36Å; D104-K107 WeakPolarHBondContact OD2-CE 3.47Å; W105-K107 VanDerWaalsContact C-N 3.3Å; K107-D152 IonicContact NZ-OD2 2.85Å; K107-Q154 HydrophobicContact CB-CB 4.27Å; K107-Q154 VanDerWaalsContact CD-OE1 3.29Å; K107-V155 CarbonylContact C-O 3.56Å; K107-V155 WeakPolarHBondContact CA-O 3.44Å
108	W	94.5	Very high	80.3	Confident	22 Å²	22	90.1 Å²	90.1	8%	0.083	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	135.9	-178.3	-158.9	-101.1	0	0	0	111.5	Q137 Q154 V155 V157 I183 K186 I187 K190	W108-Q137 PolarHBondContact NE1-O 3.41Å; W108-Q154 CarbonylContact O-C 3.59Å; W108-Q154 VanDerWaalsContact O-CA 3.32Å; W108-Q154 WeakPolarHBondContact O-CA 3.39Å; W108-V155 HydrophobicContact CB-CG2 4.42Å; W108-V155 PolarHBondContact N-O 3.28Å; W108-V155 PolarHBondContact O-N 3.47Å; W108-V157 HydrophobicContact CB-CG2 3.93Å; W108-I183 HydrophobicContact CD2-CG2 4.14Å; W108-I183 HydrophobicContact CG-CG2 4.26Å; W108-I183 HydrophobicContact CZ2-CG2 4.13Å; W108-K186 HydrophobicContact CH2-CB 3.68Å; W108-K186 HydrophobicContact CZ2-CB 4.11Å; W108-K186 HydrophobicContact CZ2-CD 4.47Å; W108-I187 HydrophobicContact CD2-CD1 4.18Å; W108-I187 HydrophobicContact CD2-CG1 3.83Å; W108-I187 HydrophobicContact CE3-CD1 4.1Å; W108-I187 HydrophobicContact CE3-CG1 3.29Å; W108-I187 HydrophobicContact CG-CD1 4.5Å; W108-I187 HydrophobicContact CH2-CG1 4.12Å; W108-I187 HydrophobicContact CZ3-CB 4.36Å; W108-I187 HydrophobicContact CZ3-CG1 3.45Å; W108-I187 VanDerWaalsContact CZ3-CG1 3.45Å; W108-K190 HydrophobicContact CZ3-CD 4.16Å
109	P	94.6	Very high	82.5	Confident	60 Å²	60	91.5 Å²	91.5	39%	0.39	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	146.1	179.1	29	-35.9	0	0	0	111.3	A138 A139	P109-A138 WeakPolarHBondContact O-CA 3.38Å; P109-A139 PolarHBondContact O-N 2.92Å
110	I	94.1	Very high	84.4	Confident	16 Å²	16	81.2 Å²	81.2	8%	0.082	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-91	155.9	172.9	57.2	149.1	0	0	0	112.7	I112 R115 A139 I141 L149 G153 V155	I110-I112 PolarHBondContact O-N 3.44Å; I110-R115 HydrophobicContact CD1-CB 4.28Å; I110-R115 HydrophobicContact CD1-CG 4.37Å; I110-R115 VanDerWaalsContact CD1-NH1 3.33Å; I110-A139 CarbonylContact C-O 3.59Å; I110-A139 WeakPolarHBondContact CA-O 3.37Å; I110-A139 HydrophobicContact CG2-CB 4.18Å; I110-I141 HydrophobicContact CG2-CG1 4.09Å; I110-L149 HydrophobicContact CD1-CD2 3.82Å; I110-L149 HydrophobicContact CG1-CD2 4.17Å; I110-L149 HydrophobicContact CG2-CD2 3.68Å; I110-G153 VanDerWaalsContact CG1-O 3.25Å; I110-G153 WeakPolarHBondContact CG1-O 3.42Å; I110-G153 PolarHBondContact N-O 3.5Å; I110-V155 HydrophobicContact CG2-CB 4.42Å; I110-V155 HydrophobicContact CG2-CG1 3.64Å; I110-V155 HydrophobicContact CG2-CG2 4.09Å
111	C	93.7	Very high	86.1	Confident	11 Å²	11	80.4 Å²	80.4	7%	0.074	39%	0.385	C	S	.	.			trans	-79.2	108.1	171.2	-178	0	0	0	0	109.3	Q113 Y114 R115 A138 A139 H140	C111-Q113 VanDerWaalsContact C-N 3.27Å; C111-Q113 PolarHBondContact O-N 3.07Å; C111-Y114 PolarHBondContact O-N 2.76Å; C111-Y114 PolarHBondContact SG-N 3.12Å; C111-Y114 VanDerWaalsContact SG-N 3.38Å; C111-R115 WeakPolarHBondContact O-CB 3.49Å; C111-R115 PolarHBondContact O-N 3.39Å; C111-A138 HydrophobicContact CB-CB 3.91Å; C111-A139 PolarHBondContact N-O 3.12Å; C111-H140 WeakPolarHBondContact CB-CD2 3.4Å; C111-H140 WeakPolarHBondContact CB-NE2 3.3Å
112	I	91.4	Very high	87.2	Confident	127 Å²	127	70.7 Å²	70.7	65%	0.651	35%	0.353	S	S	*	.	H	α-helix	trans	-60.8	-40.2	179.7	-60.1	171.1	0	0	0	110.7	I110 R115 T116	I110-I112 PolarHBondContact O-N 3.44Å; I112-R115 PolarHBondContact O-N 3.24Å; I112-T116 WeakPolarHBondContact O-CB 3.4Å; I112-T116 PolarHBondContact O-N 3.37Å; I112-T116 PolarHBondContact O-OG1 2.92Å
113	Q	90.7	Very high	87.7	Confident	109 Å²	109	66.9 Å²	66.9	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-60.9	-52.1	178.4	-169.5	66.4	7.9	0	0	111	C111 R115 T116 T117 Y119	C111-Q113 VanDerWaalsContact C-N 3.27Å; C111-Q113 PolarHBondContact O-N 3.07Å; Q113-R115 VanDerWaalsContact C-N 3.3Å; Q113-R115 PolarHBondContact O-N 3.08Å; Q113-T116 PolarHBondContact O-N 2.95Å; Q113-T117 PolarHBondContact O-N 3.01Å; Q113-T117 PolarHBondContact O-OG1 3.13Å; Q113-Y119 CarbonylContact C-O 3.55Å; Q113-Y119 WeakPolarHBondContact CG-O 3.43Å
114	Y	92	Very high	87.6	Confident	44 Å²	44	64 Å²	64	17%	0.173	33%	0.328	C	S	.	.	H	α-helix	trans	-60.9	-41	178.9	-172.1	-96	0	0	0	112	C111 T116 G118 C120 Y123 H140	C111-Y114 PolarHBondContact O-N 2.76Å; C111-Y114 PolarHBondContact SG-N 3.12Å; C111-Y114 VanDerWaalsContact SG-N 3.38Å; Y114-T116 VanDerWaalsContact C-N 3.31Å; Y114-T116 PolarHBondContact O-N 3.34Å; Y114-G118 VanDerWaalsContact CE2-O 3.24Å; Y114-G118 WeakPolarHBondContact CE2-O 3.45Å; Y114-G118 WeakPolarHBondContact O-CA 3.25Å; Y114-G118 PolarHBondContact O-N 2.95Å; Y114-C120 HydrophobicContact CD2-CB 4.19Å; Y114-Y123 HydrophobicContact CE2-CD1 4.17Å; Y114-Y123 HydrophobicContact CE2-CE1 4.37Å; Y114-H140 HydrophobicContact CD1-CB 3.55Å; Y114-H140 AromaticContact CD1-CG 3.96Å; Y114-H140 HydrophobicContact CD2-CB 4.21Å; Y114-H140 AromaticContact CD2-CG 3.92Å; Y114-H140 AromaticContact CD2-ND1 3.65Å; Y114-H140 HydrophobicContact CE1-CB 3.73Å; Y114-H140 HydrophobicContact CE2-CB 4.38Å; Y114-H140 HydrophobicContact CG-CB 3.8Å; Y114-H140 AromaticContact CG-CG 3.65Å; Y114-H140 AromaticContact CG-ND1 3.87Å
115	R	90.5	Very high	86.7	Confident	103 Å²	103	64.8 Å²	64.8	39%	0.389	34%	0.337	S	S	.	.	H	α-helix	trans	-64.5	-35.9	179.2	-177.6	169.8	177.7	-173.2	-1.7	112.8	I110 C111 I112 Q113 L149	I110-R115 HydrophobicContact CD1-CB 4.28Å; I110-R115 HydrophobicContact CD1-CG 4.37Å; I110-R115 VanDerWaalsContact CD1-NH1 3.33Å; C111-R115 WeakPolarHBondContact O-CB 3.49Å; C111-R115 PolarHBondContact O-N 3.39Å; I112-R115 PolarHBondContact O-N 3.24Å; Q113-R115 VanDerWaalsContact C-N 3.3Å; Q113-R115 PolarHBondContact O-N 3.08Å; R115-L149 VanDerWaalsContact CZ-CD1 3.45Å
116	T	89.9	Confident	85.4	Confident	109 Å²	109	68.6 Å²	68.6	67%	0.669	36%	0.361	S	S	*	.	H	α-helix	trans	-86.1	-41.1	-175	-49.3	0	0	0	0	112.1	I112 Q113 Y114	I112-T116 WeakPolarHBondContact O-CB 3.4Å; I112-T116 PolarHBondContact O-N 3.37Å; I112-T116 PolarHBondContact O-OG1 2.92Å; Q113-T116 PolarHBondContact O-N 2.95Å; Y114-T116 VanDerWaalsContact C-N 3.31Å; Y114-T116 PolarHBondContact O-N 3.34Å
117	T	89.3	Confident	83.9	Confident	76 Å²	76	71.3 Å²	71.3	47%	0.466	39%	0.39	S	S	.	.	H	α-helix	trans	-106.2	-12.1	-173	68.3	0	0	0	0	113.7	Q113 Y119	Q113-T117 PolarHBondContact O-N 3.01Å; Q113-T117 PolarHBondContact O-OG1 3.13Å; T117-Y119 PolarHBondContact O-N 3.45Å; T117-Y119 PolarHBondContact OG1-N 3.06Å; T117-Y119 PolarHBondContact OG1-O 3.31Å
118	G	87.9	Confident	82.2	Confident	44 Å²	44	74.9 Å²	74.9	45%	0.454	42%	0.415	S	S	.	.	S	Bend	trans	72.8	1.2	-167.3	0	0	0	0	0	113.8	Y114	Y114-G118 VanDerWaalsContact CE2-O 3.24Å; Y114-G118 WeakPolarHBondContact CE2-O 3.45Å; Y114-G118 WeakPolarHBondContact O-CA 3.25Å; Y114-G118 PolarHBondContact O-N 2.95Å
119	Y	86.4	Confident	80.3	Confident	142 Å²	142	78.7 Å²	78.7	56%	0.557	44%	0.437	S	S	*	.			trans	-132.4	139.6	-174.3	-178.9	-102	0	0	0	111.7	Q113 T117 L121	Q113-Y119 CarbonylContact C-O 3.55Å; Q113-Y119 WeakPolarHBondContact CG-O 3.43Å; T117-Y119 PolarHBondContact O-N 3.45Å; T117-Y119 PolarHBondContact OG1-N 3.06Å; T117-Y119 PolarHBondContact OG1-O 3.31Å; Y119-L121 HydrophobicContact CE1-CD2 3.78Å; Y119-L121 HydrophobicContact CE1-CG 4.07Å
120	C	89	Confident	78.1	Confident	12 Å²	12	80.1 Å²	80.1	8%	0.081	45%	0.446	C	S	.	.			trans	-140.4	128.7	172	174.3	0	0	0	0	108.9	Y114 G122 Y123	Y114-C120 HydrophobicContact CD2-CB 4.19Å; C120-G122 PolarHBondContact O-N 3.33Å; C120-G122 VanDerWaalsContact O-N 3.15Å; C120-Y123 VanDerWaalsContact O-CB 3.27Å; C120-Y123 WeakPolarHBondContact O-CB 3.42Å; C120-Y123 PolarHBondContact O-N 3.21Å
121	L	83.5	Confident	76.2	Confident	138 Å²	138	87.4 Å²	87.4	72%	0.723	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-31.6	179.9	-70.5	166.3	0	0	0	112.8	Y119	Y119-L121 HydrophobicContact CE1-CD2 3.78Å; Y119-L121 HydrophobicContact CE1-CG 4.07Å
122	G	80.6	Confident	74.1	Confident	15 Å²	15	92.2 Å²	92.2	16%	0.155	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0.9	176.5	0	0	0	0	0	114.3	C120 N124 C136	C120-G122 PolarHBondContact O-N 3.33Å; C120-G122 VanDerWaalsContact O-N 3.15Å; G122-N124 PolarHBondContact O-N 3.23Å; G122-C136 PolarHBondContact O-N 2.89Å
123	Y	74.5	Confident	72.3	Confident	103 Å²	103	89.1 Å²	89.1	40%	0.404	51%	0.507	S	S	.	.			trans	-79.1	116	174.7	-167.6	-131.8	0	0	0	109.7	Y114 C120 P125 H140	Y114-Y123 HydrophobicContact CE2-CD1 4.17Å; Y114-Y123 HydrophobicContact CE2-CE1 4.37Å; C120-Y123 VanDerWaalsContact O-CB 3.27Å; C120-Y123 WeakPolarHBondContact O-CB 3.42Å; C120-Y123 PolarHBondContact O-N 3.21Å; Y123-P125 HydrophobicContact CD1-CG 4.32Å; Y123-P125 HydrophobicContact CE1-CB 4.1Å; Y123-P125 HydrophobicContact CE1-CG 3.8Å; Y123-H140 WeakPolarHBondContact CB-CE1 3.42Å; Y123-H140 WeakPolarHBondContact CB-ND1 3.42Å; Y123-H140 HydrophobicContact CD2-CB 4.48Å; Y123-H140 AromaticContact CD2-CE1 3.5Å; Y123-H140 VanDerWaalsContact CD2-CE1 3.5Å; Y123-H140 WeakPolarHBondContact CD2-CE1 3.43Å; Y123-H140 AromaticContact CD2-CG 3.96Å; Y123-H140 AromaticContact CD2-ND1 2.89Å; Y123-H140 WeakPolarHBondContact CD2-ND1 3.47Å; Y123-H140 HydrophobicContact CE2-CB 4.37Å; Y123-H140 AromaticContact CE2-ND1 3.59Å; Y123-H140 AromaticContact CG-CE1 3.7Å; Y123-H140 AromaticContact CG-ND1 3.26Å; Y123-H140 VanDerWaalsContact CG-ND1 3.26Å
124	N	67.3	Low	71.1	Confident	49 Å²	49	89.7 Å²	89.7	26%	0.262	51%	0.509	S	S	.	.			trans	-132.3	95.4	168	-165.4	-22	0	0	0	110	G122 N126 G127 T128 L129	G122-N124 PolarHBondContact O-N 3.23Å; N124-N126 PolarHBondContact O-N 3.28Å; N124-N126 PolarHBondContact OD1-N 3.46Å; N124-G127 PolarHBondContact OD1-N 2.97Å; N124-T128 PolarHBondContact ND2-N 3.39Å; N124-T128 VanDerWaalsContact ND2-N 3.12Å; N124-T128 PolarHBondContact OD1-N 2.75Å; N124-L129 WeakPolarHBondContact ND2-CA 3.43Å; N124-L129 WeakPolarHBondContact ND2-CB 3.29Å; N124-L129 WeakPolarHBondContact ND2-CG 3.42Å; N124-L129 PolarHBondContact ND2-N 3.16Å
125	P	64.1	Low	70.5	Confident	82 Å²	82	92.4 Å²	92.4	53%	0.532	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-24.6	178.6	25.1	-31	0	0	0	112.3	Y123	Y123-P125 HydrophobicContact CD1-CG 4.32Å; Y123-P125 HydrophobicContact CE1-CB 4.1Å; Y123-P125 HydrophobicContact CE1-CG 3.8Å
126	N	58.8	Low	70.4	Confident	133 Å²	133	89 Å²	89	71%	0.711	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	2	-168.9	-63	-12.1	0	0	0	113.9	N124 T128	N124-N126 PolarHBondContact O-N 3.28Å; N124-N126 PolarHBondContact OD1-N 3.46Å; N126-T128 WeakPolarHBondContact CB-OG1 3.46Å; N126-T128 PolarHBondContact O-N 3.09Å; N126-T128 VanDerWaalsContact O-N 3.13Å; N126-T128 PolarHBondContact O-OG1 2.9Å; N126-T128 VanDerWaalsContact O-OG1 3.08Å
127	G	57.1	Low	70.4	Confident	64 Å²	64	88.1 Å²	88.1	66%	0.66	51%	0.505	S	S	*	.	S	Bend	trans	61.4	16.3	-179.6	0	0	0	0	0	115.4	N124	N124-G127 PolarHBondContact OD1-N 2.97Å
128	T	55.7	Low	70.5	Confident	114 Å²	114	85.4 Å²	85.4	70%	0.699	49%	0.49	S	S	*	.			trans	-92.6	2.5	-168.3	-27	0	0	0	0	114.7	N124 N126	N124-T128 PolarHBondContact ND2-N 3.39Å; N124-T128 VanDerWaalsContact ND2-N 3.12Å; N124-T128 PolarHBondContact OD1-N 2.75Å; N126-T128 WeakPolarHBondContact CB-OG1 3.46Å; N126-T128 PolarHBondContact O-N 3.09Å; N126-T128 VanDerWaalsContact O-N 3.13Å; N126-T128 PolarHBondContact O-OG1 2.9Å; N126-T128 VanDerWaalsContact O-OG1 3.08Å
129	L	54.7	Low	70.8	Confident	102 Å²	102	83.3 Å²	83.3	53%	0.534	47%	0.469	S	S	.	.	S	Bend	trans	-103.7	143.9	179.4	-66.2	167.5	0	0	0	109	N124 I131	N124-L129 WeakPolarHBondContact ND2-CA 3.43Å; N124-L129 WeakPolarHBondContact ND2-CB 3.29Å; N124-L129 WeakPolarHBondContact ND2-CG 3.42Å; N124-L129 PolarHBondContact ND2-N 3.16Å; L129-I131 PolarHBondContact O-N 3.37Å
130	P	48.2	Very low	71.1	Confident	89 Å²	89	77.6 Å²	77.6	58%	0.578	45%	0.447	S	S	*	.			trans	-57.5	135.1	-173.5	22.3	-32.2	0	0	0	110.8	S132 S133	P130-S132 PolarHBondContact O-N 3.35Å; P130-S133 PolarHBondContact O-N 3.1Å
131	I	54.3	Low	71.2	Confident	170 Å²	170	77.3 Å²	77.3	87%	0.872	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-4.9	178.5	-77.8	161.3	0	0	0	114	L129 S133	L129-I131 PolarHBondContact O-N 3.37Å; I131-S133 VanDerWaalsContact C-N 3.34Å; I131-S133 PolarHBondContact O-N 3.46Å
132	S	49.8	Very low	71.2	Confident	112 Å²	112	71.4 Å²	71.4	78%	0.783	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-13.2	177.7	55.9	0	0	0	0	114.8	P130	P130-S132 PolarHBondContact O-N 3.35Å
133	S	53.7	Low	71.2	Confident	62 Å²	62	75.5 Å²	75.5	43%	0.434	44%	0.441	S	S	.	.	S	Bend	trans	-106.1	121.6	172.7	57.8	0	0	0	0	110	P130 I131 M135	P130-S133 PolarHBondContact O-N 3.1Å; I131-S133 VanDerWaalsContact C-N 3.34Å; I131-S133 PolarHBondContact O-N 3.46Å; S133-M135 PolarHBondContact O-N 3.09Å
134	Q	66.5	Low	71.4	Confident	120 Å²	120	77.9 Å²	77.9	56%	0.561	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-57.2	116	-179.6	-66.6	-165.7	-8.8	0	0	110.1	C136 S345	Q134-C136 PolarHBondContact O-N 3.17Å; Q134-S345 PolarHBondContact NE2-O 3.07Å; Q134-S345 VanDerWaalsContact NE2-O 3.15Å
135	M	79.1	Confident	72.3	Confident	101 Å²	101	79.5 Å²	79.5	50%	0.498	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-57.9	137.5	173.9	57.8	-172.6	83.3	0	0	110.8	S133 Q137 L182	S133-M135 PolarHBondContact O-N 3.09Å; M135-Q137 PolarHBondContact O-N 3.35Å; M135-L182 HydrophobicContact CB-CD2 4.46Å; M135-L182 HydrophobicContact CE-CD1 4.45Å; M135-L182 HydrophobicContact CG-CD1 4.46Å; M135-L182 HydrophobicContact CG-CD2 3.48Å; M135-L182 VanDerWaalsContact CG-CD2 3.48Å; M135-L182 HydrophobicContact SD-CB 4.41Å; M135-L182 HydrophobicContact SD-CD1 3.28Å; M135-L182 WeakPolarHBondContact SD-CD1 3.19Å; M135-L182 HydrophobicContact SD-CD2 3.23Å; M135-L182 WeakPolarHBondContact SD-CD2 3.42Å; M135-L182 HydrophobicContact SD-CG 3.73Å
136	C	87.7	Confident	73.3	Confident	31 Å²	31	82.4 Å²	82.4	21%	0.209	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-62.8	130.5	-174.5	-169.7	0	0	0	0	110.4	G122 Q134 H140	G122-C136 PolarHBondContact O-N 2.89Å; Q134-C136 PolarHBondContact O-N 3.17Å; C136-H140 VanDerWaalsContact CB-NE2 3.34Å; C136-H140 WeakPolarHBondContact CB-NE2 3.48Å; C136-H140 PolarHBondContact SG-NE2 3.49Å
137	Q	89.3	Confident	74.8	Confident	92 Å²	92	77.2 Å²	77.2	43%	0.43	45%	0.449	S	S	.	.			trans	-92.4	-12	-174.5	-42.6	-162.7	20	0	0	112.8	W108 M135	W108-Q137 PolarHBondContact NE1-O 3.41Å; M135-Q137 PolarHBondContact O-N 3.35Å
138	A	92.9	Very high	76.4	Confident	19 Å²	19	77.9 Å²	77.9	16%	0.157	44%	0.441	C	S	.	.	S	Bend	trans	-91.5	158.7	-177.6	0	0	0	0	0	111.2	P109 C111 H140 I183	P109-A138 WeakPolarHBondContact O-CA 3.38Å; C111-A138 HydrophobicContact CB-CB 3.91Å; A138-H140 PolarHBondContact O-CD2 3.31Å; A138-H140 PolarHBondContact O-N 3.07Å; A138-I183 WeakPolarHBondContact O-CD1 3.34Å
139	A	93.5	Very high	78.1	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	42%	0.423	C	S	.	.	B	Isolated β-bridge	trans	-70.6	127.7	178.9	0	0	0	0	0	110.6	P109 I110 C111 I141 V155 Y177	P109-A139 PolarHBondContact O-N 2.92Å; I110-A139 CarbonylContact C-O 3.59Å; I110-A139 WeakPolarHBondContact CA-O 3.37Å; I110-A139 HydrophobicContact CG2-CB 4.18Å; C111-A139 PolarHBondContact N-O 3.12Å; A139-I141 HydrophobicContact CB-CG1 4.22Å; A139-I141 PolarHBondContact O-N 3.32Å; A139-V155 HydrophobicContact CB-CG2 3.76Å; A139-Y177 HydrophobicContact CB-CD1 3.99Å; A139-Y177 HydrophobicContact CB-CE1 3.48Å; A139-Y177 VanDerWaalsContact CB-CE1 3.48Å; A139-Y177 HydrophobicContact CB-CE2 4.22Å
140	H	91.9	Very high	79.8	Confident	21 Å²	21	72.4 Å²	72.4	10%	0.097	41%	0.411	C	S	.	.			trans	-91.5	103.9	173.6	-72.8	-170.6	0	0	0	108	C111 Y114 Y123 C136 A138	C111-H140 WeakPolarHBondContact CB-CD2 3.4Å; C111-H140 WeakPolarHBondContact CB-NE2 3.3Å; Y114-H140 HydrophobicContact CD1-CB 3.55Å; Y114-H140 AromaticContact CD1-CG 3.96Å; Y114-H140 HydrophobicContact CD2-CB 4.21Å; Y114-H140 AromaticContact CD2-CG 3.92Å; Y114-H140 AromaticContact CD2-ND1 3.65Å; Y114-H140 HydrophobicContact CE1-CB 3.73Å; Y114-H140 HydrophobicContact CE2-CB 4.38Å; Y114-H140 HydrophobicContact CG-CB 3.8Å; Y114-H140 AromaticContact CG-CG 3.65Å; Y114-H140 AromaticContact CG-ND1 3.87Å; Y123-H140 WeakPolarHBondContact CB-CE1 3.42Å; Y123-H140 WeakPolarHBondContact CB-ND1 3.42Å; Y123-H140 HydrophobicContact CD2-CB 4.48Å; Y123-H140 AromaticContact CD2-CE1 3.5Å; Y123-H140 VanDerWaalsContact CD2-CE1 3.5Å; Y123-H140 WeakPolarHBondContact CD2-CE1 3.43Å; Y123-H140 AromaticContact CD2-CG 3.96Å; Y123-H140 AromaticContact CD2-ND1 2.89Å; Y123-H140 WeakPolarHBondContact CD2-ND1 3.47Å; Y123-H140 HydrophobicContact CE2-CB 4.37Å; Y123-H140 AromaticContact CE2-ND1 3.59Å; Y123-H140 AromaticContact CG-CE1 3.7Å; Y123-H140 AromaticContact CG-ND1 3.26Å; Y123-H140 VanDerWaalsContact CG-ND1 3.26Å; C136-H140 VanDerWaalsContact CB-NE2 3.34Å; C136-H140 WeakPolarHBondContact CB-NE2 3.48Å; C136-H140 PolarHBondContact SG-NE2 3.49Å; A138-H140 PolarHBondContact O-CD2 3.31Å; A138-H140 PolarHBondContact O-N 3.07Å
141	I	91.3	Very high	81.8	Confident	6 Å²	6	74.6 Å²	74.6	3%	0.031	43%	0.429	C	S	.	.			trans	-123.5	116.4	178.8	-55.6	-67.2	0	0	0	105.7	I110 A139 D145 V147 V155 Y177	I110-I141 HydrophobicContact CG2-CG1 4.09Å; A139-I141 HydrophobicContact CB-CG1 4.22Å; A139-I141 PolarHBondContact O-N 3.32Å; I141-D145 VanDerWaalsContact CA-OD2 3.31Å; I141-D145 WeakPolarHBondContact CA-OD2 3.48Å; I141-D145 HydrophobicContact CG2-CB 3.65Å; I141-V147 HydrophobicContact CD1-CB 4.46Å; I141-V147 HydrophobicContact CD1-CG2 4.42Å; I141-V147 HydrophobicContact CG2-CB 4.49Å; I141-V155 HydrophobicContact CG1-CG1 4.03Å; I141-Y177 HydrophobicContact CD1-CD2 3.33Å; I141-Y177 HydrophobicContact CD1-CE2 3.64Å; I141-Y177 HydrophobicContact CD1-CG 4.11Å
142	G	84.5	Confident	83.5	Confident	15 Å²	15	70.2 Å²	70.2	16%	0.155	41%	0.407	C	S	.	.			trans	-71.5	165.3	176.1	0	0	0	0	0	111.5	N144 D145	G142-N144 PolarHBondContact O-N 3.42Å; G142-D145 PolarHBondContact N-OD2 3.02Å; G142-D145 PolarHBondContact O-N 2.83Å
143	P	79.4	Confident	85.5	Confident	100 Å²	100	66.1 Å²	66.1	65%	0.649	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.6	176.6	25.9	-34.3	0	0	0	113.3
144	N	80.7	Confident	87.4	Confident	154 Å²	154	66 Å²	66	82%	0.824	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-1.5	-177.3	-60.8	-27.8	0	0	0	113.9	G142	G142-N144 PolarHBondContact O-N 3.42Å
145	D	86.1	Confident	88.7	Confident	82 Å²	82	60.2 Å²	60.2	44%	0.439	35%	0.348	S	S	.	.			trans	-76.4	139.5	-178.7	-73.3	-27.9	0	0	0	111.2	I141 G142 V147	I141-D145 VanDerWaalsContact CA-OD2 3.31Å; I141-D145 WeakPolarHBondContact CA-OD2 3.48Å; I141-D145 HydrophobicContact CG2-CB 3.65Å; G142-D145 PolarHBondContact N-OD2 3.02Å; G142-D145 PolarHBondContact O-N 2.83Å; D145-V147 PolarHBondContact O-N 3.23Å; D145-V147 VanDerWaalsContact O-N 3.1Å
146	Q	84.8	Confident	89.5	Confident	144 Å²	144	61.1 Å²	61.1	67%	0.673	35%	0.346	S	S	*	.			trans	-76.2	8.3	-178.8	-60	-176.1	34.9	0	0	114.2
147	V	90.8	Very high	89.8	Confident	23 Å²	23	59.8 Å²	59.8	14%	0.139	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-82	119.3	-175.8	-178.5	0	0	0	0	109.5	I141 D145 L149 V155	I141-V147 HydrophobicContact CD1-CB 4.46Å; I141-V147 HydrophobicContact CD1-CG2 4.42Å; I141-V147 HydrophobicContact CG2-CB 4.49Å; D145-V147 PolarHBondContact O-N 3.23Å; D145-V147 VanDerWaalsContact O-N 3.1Å; V147-L149 PolarHBondContact O-N 3.36Å; V147-V155 HydrophobicContact CG1-CB 4.08Å; V147-V155 HydrophobicContact CG1-CG1 3.87Å
148	P	90.5	Very high	89.9	Confident	78 Å²	78	55.5 Å²	55.5	51%	0.506	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-68.9	136.1	-178.7	29.2	-31.5	0	0	0	110.7	Y175	P148-Y175 WeakPolarHBondContact CD-O 3.34Å
149	L	90.9	Very high	89.8	Confident	60 Å²	60	59.3 Å²	59.3	31%	0.314	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	133.5	177.6	-72.4	134.6	0	0	0	109.9	I110 R115 V147 V155	I110-L149 HydrophobicContact CD1-CD2 3.82Å; I110-L149 HydrophobicContact CG1-CD2 4.17Å; I110-L149 HydrophobicContact CG2-CD2 3.68Å; R115-L149 VanDerWaalsContact CZ-CD1 3.45Å; V147-L149 PolarHBondContact O-N 3.36Å; L149-V155 HydrophobicContact CD2-CG1 3.63Å; L149-V155 HydrophobicContact CG-CG1 4.05Å
150	S	90.1	Very high	89.6	Confident	41 Å²	41	61.9 Å²	61.9	29%	0.287	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	152.1	168.9	-178.8	0	0	0	0	109.1	D152 G153 Q154	S150-D152 WeakPolarHBondContact CB-OD1 3.35Å; S150-D152 PolarHBondContact O-N 3.41Å; S150-D152 PolarHBondContact OG-OD1 2.93Å; S150-G153 PolarHBondContact O-N 2.86Å; S150-Q154 WeakPolarHBondContact CB-O 3.5Å; S150-Q154 PolarHBondContact N-O 3.24Å
151	S	89.5	Confident	89.5	Confident	136 Å²	136	61.2 Å²	61.2	95%	0.951	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.7	-174.6	51.8	0	0	0	0	113.9	G153	S151-G153 VanDerWaalsContact C-N 3.31Å
152	D	90.3	Very high	89.3	Confident	78 Å²	78	61.6 Å²	61.6	42%	0.417	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	7.7	175.3	58.7	-19.6	0	0	0	114.1	K107 S150 Q154	K107-D152 IonicContact NZ-OD2 2.85Å; S150-D152 WeakPolarHBondContact CB-OD1 3.35Å; S150-D152 PolarHBondContact O-N 3.41Å; S150-D152 PolarHBondContact OG-OD1 2.93Å; D152-Q154 PolarHBondContact OD2-NE2 3.43Å; D152-Q154 PolarHBondContact OD2-OE1 3.2Å
153	G	91.6	Very high	89	Confident	25 Å²	25	62.2 Å²	62.2	26%	0.258	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	35	-179.3	0	0	0	0	0	112.9	I110 S150 S151	I110-G153 VanDerWaalsContact CG1-O 3.25Å; I110-G153 WeakPolarHBondContact CG1-O 3.42Å; I110-G153 PolarHBondContact N-O 3.5Å; S150-G153 PolarHBondContact O-N 2.86Å; S151-G153 VanDerWaalsContact C-N 3.31Å
154	Q	94.3	Very high	88.6	Confident	59 Å²	59	61.1 Å²	61.1	28%	0.276	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	146.1	177.3	-59.9	-179.5	10.8	0	0	111.1	K107 W108 S150 D152	K107-Q154 HydrophobicContact CB-CB 4.27Å; K107-Q154 VanDerWaalsContact CD-OE1 3.29Å; W108-Q154 CarbonylContact O-C 3.59Å; W108-Q154 VanDerWaalsContact O-CA 3.32Å; W108-Q154 WeakPolarHBondContact O-CA 3.39Å; S150-Q154 WeakPolarHBondContact CB-O 3.5Å; S150-Q154 PolarHBondContact N-O 3.24Å; D152-Q154 PolarHBondContact OD2-NE2 3.43Å; D152-Q154 PolarHBondContact OD2-OE1 3.2Å
155	V	94.5	Very high	88	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	149.6	170.5	-71.2	0	0	0	0	111.3	K107 W108 I110 A139 I141 V147 L149 Y177	K107-V155 CarbonylContact C-O 3.56Å; K107-V155 WeakPolarHBondContact CA-O 3.44Å; W108-V155 HydrophobicContact CB-CG2 4.42Å; W108-V155 PolarHBondContact N-O 3.28Å; W108-V155 PolarHBondContact O-N 3.47Å; I110-V155 HydrophobicContact CG2-CB 4.42Å; I110-V155 HydrophobicContact CG2-CG1 3.64Å; I110-V155 HydrophobicContact CG2-CG2 4.09Å; A139-V155 HydrophobicContact CB-CG2 3.76Å; I141-V155 HydrophobicContact CG1-CG1 4.03Å; V147-V155 HydrophobicContact CG1-CB 4.08Å; V147-V155 HydrophobicContact CG1-CG1 3.87Å; L149-V155 HydrophobicContact CD2-CG1 3.63Å; L149-V155 HydrophobicContact CG-CG1 4.05Å; V155-Y177 HydrophobicContact CG2-CD1 4Å; V155-Y177 HydrophobicContact CG2-CG 4.07Å
156	R	94.4	Very high	87.2	Confident	119 Å²	119	59.5 Å²	59.5	45%	0.449	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	128.3	171	-73.6	-177	177.8	-106	-0.3	110.2	C106 F176 Y177	C106-R156 WeakPolarHBondContact O-CA 2.9Å; R156-F176 HydrophobicContact CB-CD1 3.78Å; R156-F176 HydrophobicContact CB-CE1 4.11Å; R156-Y177 PolarHBondContact O-N 3.45Å
157	V	93.9	Very high	86.6	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.018	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-81.6	138	178.3	175.8	0	0	0	0	110.4	C106 W108 F159 M162 Y177 P179 I187	C106-V157 WeakPolarHBondContact O-CB 3.36Å; C106-V157 WeakPolarHBondContact O-CG2 3.25Å; C106-V157 PolarHBondContact O-N 3.14Å; W108-V157 HydrophobicContact CB-CG2 3.93Å; V157-F159 PolarHBondContact O-N 3.15Å; V157-M162 HydrophobicContact CG1-CG 4.05Å; V157-M162 HydrophobicContact CG1-SD 3.6Å; V157-Y177 HydrophobicContact CG2-CD1 4.27Å; V157-P179 HydrophobicContact CG1-CG 3.71Å; V157-I187 HydrophobicContact CB-CD1 4.46Å; V157-I187 HydrophobicContact CG1-CD1 4.1Å; V157-I187 HydrophobicContact CG2-CD1 3.65Å
158	C	92.9	Very high	86.2	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.014	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-72.2	117	173.5	-178.7	0	0	0	0	110.4	D160 S161 M162 C169 C174 F176 Y177 H178	C158-D160 VanDerWaalsContact C-N 3.27Å; C158-D160 PolarHBondContact O-N 3.5Å; C158-S161 WeakPolarHBondContact CB-OG 3.37Å; C158-S161 PolarHBondContact O-N 2.98Å; C158-S161 PolarHBondContact O-OG 2.81Å; C158-M162 PolarHBondContact O-N 3.06Å; C158-C169 VanDerWaalsContact SG-SG 3.62Å; C158-C174 VanDerWaalsContact SG-SG 3.6Å; C158-F176 HydrophobicContact CB-CB 3.56Å; C158-Y177 PolarHBondContact N-O 3.07Å; C158-H178 WeakPolarHBondContact CB-CD2 3.49Å; C158-H178 WeakPolarHBondContact CB-NE2 3.49Å; C158-H178 PolarHBondContact SG-NE2 3.5Å; C158-H178 VanDerWaalsContact SG-NE2 3.43Å
159	F	90.4	Very high	86.1	Confident	100 Å²	100	60 Å²	60	44%	0.439	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-36.6	177	-66.3	-62.6	0	0	0	112.9	W105 C106 V157 S161 M162	W105-F159 HydrophobicContact CD2-CE1 4.46Å; W105-F159 AromaticContact CE2-CE1 3.93Å; W105-F159 HydrophobicContact CE3-CE1 4.33Å; W105-F159 AromaticContact CH2-CD1 3.4Å; W105-F159 HydrophobicContact CH2-CD1 3.4Å; W105-F159 VanDerWaalsContact CH2-CD1 3.4Å; W105-F159 AromaticContact CH2-CE1 3.21Å; W105-F159 HydrophobicContact CH2-CE1 3.21Å; W105-F159 HydrophobicContact CH2-CZ 4.47Å; W105-F159 AromaticContact CZ2-CD1 3.89Å; W105-F159 HydrophobicContact CZ2-CD1 3.89Å; W105-F159 AromaticContact CZ2-CE1 3.3Å; W105-F159 HydrophobicContact CZ2-CE1 3.3Å; W105-F159 HydrophobicContact CZ2-CZ 4.25Å; W105-F159 AromaticContact CZ3-CD1 4Å; W105-F159 HydrophobicContact CZ3-CD1 4Å; W105-F159 AromaticContact CZ3-CE1 3.74Å; W105-F159 HydrophobicContact CZ3-CE1 3.74Å; C106-F159 HydrophobicContact CB-CE1 3.54Å; C106-F159 HydrophobicContact CB-CE2 4.38Å; C106-F159 HydrophobicContact CB-CZ 3.43Å; C106-F159 VanDerWaalsContact CB-CZ 3.43Å; V157-F159 PolarHBondContact O-N 3.15Å; F159-S161 VanDerWaalsContact C-N 3.3Å; F159-S161 PolarHBondContact O-N 2.75Å; F159-M162 VanDerWaalsContact O-CB 3.3Å; F159-M162 WeakPolarHBondContact O-CB 3.41Å; F159-M162 PolarHBondContact O-N 3.43Å
160	D	89.3	Confident	85.9	Confident	53 Å²	53	63.2 Å²	63.2	28%	0.283	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-67	-34.6	-179.8	-57.1	-27.3	0	0	0	111	C158 M162 C169 R171	C158-D160 VanDerWaalsContact C-N 3.27Å; C158-D160 PolarHBondContact O-N 3.5Å; D160-M162 PolarHBondContact O-N 3.48Å; D160-C169 HydrophobicContact CB-CB 3.99Å; D160-R171 IonicContact OD2-CZ 3.88Å; D160-R171 VanDerWaalsContact OD2-CZ 3.29Å; D160-R171 IonicContact OD2-NE 3.07Å; D160-R171 PolarHBondContact OD2-NE 3.29Å; D160-R171 IonicContact OD2-NH2 2.91Å; D160-R171 PolarHBondContact OD2-NH2 3.18Å
161	S	90	Very high	85.9	Confident	8 Å²	8	67.8 Å²	67.8	6%	0.056	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-72.1	-14.7	177.4	78.7	0	0	0	0	114.2	C158 F159 G163 H178 R184	C158-S161 WeakPolarHBondContact CB-OG 3.37Å; C158-S161 PolarHBondContact O-N 2.98Å; C158-S161 PolarHBondContact O-OG 2.81Å; F159-S161 VanDerWaalsContact C-N 3.3Å; F159-S161 PolarHBondContact O-N 2.75Å; S161-G163 PolarHBondContact O-N 3.18Å; S161-H178 VanDerWaalsContact CB-CD2 3.49Å; S161-H178 WeakPolarHBondContact CB-CD2 3.45Å; S161-R184 VanDerWaalsContact O-CD 3.27Å; S161-R184 WeakPolarHBondContact O-CD 3.23Å; S161-R184 PolarHBondContact O-NH1 3.41Å; S161-R184 VanDerWaalsContact O-NH1 3.14Å
162	M	86.8	Confident	85.6	Confident	14 Å²	14	66.5 Å²	66.5	7%	0.069	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-69.9	-10.4	179.2	-68.6	-63.7	-62.2	0	0	112.9	V157 C158 F159 D160 L164 P179 R184 I187 V188	V157-M162 HydrophobicContact CG1-CG 4.05Å; V157-M162 HydrophobicContact CG1-SD 3.6Å; C158-M162 PolarHBondContact O-N 3.06Å; F159-M162 VanDerWaalsContact O-CB 3.3Å; F159-M162 WeakPolarHBondContact O-CB 3.41Å; F159-M162 PolarHBondContact O-N 3.43Å; D160-M162 PolarHBondContact O-N 3.48Å; M162-L164 VanDerWaalsContact C-N 3.32Å; M162-L164 HydrophobicContact CB-CD1 4.44Å; M162-L164 HydrophobicContact CB-CG 4.17Å; M162-P179 HydrophobicContact SD-CG 4.01Å; M162-R184 HydrophobicContact CE-CB 4.4Å; M162-R184 HydrophobicContact SD-CB 4.48Å; M162-R184 HydrophobicContact SD-CG 3.99Å; M162-I187 HydrophobicContact CE-CB 3.76Å; M162-I187 HydrophobicContact CE-CG2 3.54Å; M162-I187 HydrophobicContact SD-CB 4.43Å; M162-I187 HydrophobicContact SD-CD1 4.2Å; M162-I187 HydrophobicContact SD-CG2 4.15Å; M162-V188 HydrophobicContact CE-CG2 3.49Å; M162-V188 VanDerWaalsContact CE-CG2 3.49Å
163	G	78.4	Confident	85.4	Confident	28 Å²	28	68 Å²	68	29%	0.289	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	13.1	178.1	0	0	0	0	0	114.2	S161 N166	S161-G163 PolarHBondContact O-N 3.18Å; G163-N166 VanDerWaalsContact CA-O 3.31Å; G163-N166 WeakPolarHBondContact CA-O 3.28Å
164	L	71	Confident	85.4	Confident	76 Å²	76	68.1 Å²	68.1	40%	0.398	36%	0.364	S	S	.	.	S	Bend	trans	-73.1	-32.6	-178.5	-65.3	176.9	0	0	0	112.3	M162	M162-L164 VanDerWaalsContact C-N 3.32Å; M162-L164 HydrophobicContact CB-CD1 4.44Å; M162-L164 HydrophobicContact CB-CG 4.17Å
165	V	67.4	Low	85.3	Confident	121 Å²	121	71.8 Å²	71.8	73%	0.733	38%	0.377	S	S	*	.	S	Bend	trans	-116.6	-57.8	179.9	-175	0	0	0	0	110.3
166	N	69.9	Low	85.2	Confident	81 Å²	81	75.3 Å²	75.3	43%	0.433	39%	0.392	S	S	.	.	S	Bend	trans	-120.5	149.2	178.2	-64.7	-24	0	0	0	110.1	G163 T168 N170	G163-N166 VanDerWaalsContact CA-O 3.31Å; G163-N166 WeakPolarHBondContact CA-O 3.28Å; N166-T168 PolarHBondContact O-N 3.3Å; N166-N170 PolarHBondContact ND2-OD1 3.18Å
167	L	71.8	Confident	85.2	Confident	138 Å²	138	70.5 Å²	70.5	72%	0.723	37%	0.374	S	S	*	.	S	Bend	trans	-65.1	-20.6	-178.5	-87.5	73.7	0	0	0	113.1
168	T	81.5	Confident	85.2	Confident	98 Å²	98	74.4 Å²	74.4	60%	0.601	39%	0.392	S	S	*	.	S	Bend	trans	-139.4	148.2	-179.2	53	0	0	0	0	110	N166 N170	N166-T168 PolarHBondContact O-N 3.3Å; T168-N170 PolarHBondContact O-OD1 3.09Å
169	C	89.4	Confident	85.1	Confident	21 Å²	21	74.7 Å²	74.7	14%	0.142	39%	0.393	C	S	.	.			trans	-71.4	133.8	173.1	179.9	0	0	0	0	109.7	C158 D160 H178	C158-C169 VanDerWaalsContact SG-SG 3.62Å; D160-C169 HydrophobicContact CB-CB 3.99Å; C169-H178 WeakPolarHBondContact CB-CE1 3.32Å
170	N	87.2	Confident	85.1	Confident	126 Å²	126	73.3 Å²	73.3	67%	0.674	40%	0.395	S	S	*	.			trans	-89.7	1.9	-178.5	-66.3	87.7	0	0	0	114.3	N166 T168	N166-N170 PolarHBondContact ND2-OD1 3.18Å; T168-N170 PolarHBondContact O-OD1 3.09Å
171	R	88.7	Confident	84.9	Confident	138 Å²	138	75.1 Å²	75.1	52%	0.521	40%	0.4	S	S	.	.			trans	-84	126.5	-178.3	-56.1	177.4	-161	-159.5	0.8	109.4	D160 C174	D160-R171 IonicContact OD2-CZ 3.88Å; D160-R171 VanDerWaalsContact OD2-CZ 3.29Å; D160-R171 IonicContact OD2-NE 3.07Å; D160-R171 PolarHBondContact OD2-NE 3.29Å; D160-R171 IonicContact OD2-NH2 2.91Å; D160-R171 PolarHBondContact OD2-NH2 3.18Å; R171-C174 HydrophobicContact CB-CB 4.08Å
172	S	84.3	Confident	84.7	Confident	109 Å²	109	77.7 Å²	77.7	76%	0.762	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-44.9	178.3	53.2	0	0	0	0	112
173	D	86.6	Confident	84.9	Confident	108 Å²	108	77.4 Å²	77.4	58%	0.578	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	63.5	-175.1	-54.1	-66.2	0	0	0	109.7	Y175	D173-Y175 WeakPolarHBondContact O-CD2 3.5Å; D173-Y175 WeakPolarHBondContact O-CE2 3.39Å; D173-Y175 PolarHBondContact O-N 2.94Å
174	C	91	Very high	85.5	Confident	28 Å²	28	79.1 Å²	79.1	19%	0.189	41%	0.409	C	S	.	.			trans	-75	108.1	-179.1	-165.7	0	0	0	0	111	C158 R171 F176 H178	C158-C174 VanDerWaalsContact SG-SG 3.6Å; R171-C174 HydrophobicContact CB-CB 4.08Å; C174-F176 PolarHBondContact O-N 2.87Å; C174-F176 VanDerWaalsContact O-N 3.08Å; C174-H178 PolarHBondContact SG-NE2 2.85Å
175	Y	91.4	Very high	86.4	Confident	137 Å²	137	78.7 Å²	78.7	54%	0.537	41%	0.407	S	S	.	.			trans	-71.9	8.1	174.4	-58.8	-78.7	0	0	0	114.4	P148 D173	P148-Y175 WeakPolarHBondContact CD-O 3.34Å; D173-Y175 WeakPolarHBondContact O-CD2 3.5Å; D173-Y175 WeakPolarHBondContact O-CE2 3.39Å; D173-Y175 PolarHBondContact O-N 2.94Å
176	F	94	Very high	87.5	Confident	73 Å²	73	75.6 Å²	75.6	32%	0.32	38%	0.384	S	S	.	.	S	Bend	trans	-111.2	147.7	-178.2	-64	-71.6	0	0	0	110.9	R156 C158 C174 H178	R156-F176 HydrophobicContact CB-CD1 3.78Å; R156-F176 HydrophobicContact CB-CE1 4.11Å; C158-F176 HydrophobicContact CB-CB 3.56Å; C174-F176 PolarHBondContact O-N 2.87Å; C174-F176 VanDerWaalsContact O-N 3.08Å; F176-H178 PolarHBondContact O-CD2 3.32Å; F176-H178 PolarHBondContact O-N 3.31Å
177	Y	94.1	Very high	88.6	Confident	19 Å²	19	71.7 Å²	71.7	8%	0.075	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-64.2	130.9	-179.2	177.1	-127.8	0	0	0	111.8	A139 I141 V155 R156 V157 C158 P179 P180 I183	A139-Y177 HydrophobicContact CB-CD1 3.99Å; A139-Y177 HydrophobicContact CB-CE1 3.48Å; A139-Y177 VanDerWaalsContact CB-CE1 3.48Å; A139-Y177 HydrophobicContact CB-CE2 4.22Å; I141-Y177 HydrophobicContact CD1-CD2 3.33Å; I141-Y177 HydrophobicContact CD1-CE2 3.64Å; I141-Y177 HydrophobicContact CD1-CG 4.11Å; V155-Y177 HydrophobicContact CG2-CD1 4Å; V155-Y177 HydrophobicContact CG2-CG 4.07Å; R156-Y177 PolarHBondContact O-N 3.45Å; V157-Y177 HydrophobicContact CG2-CD1 4.27Å; C158-Y177 PolarHBondContact N-O 3.07Å; Y177-P179 HydrophobicContact CD1-CB 4.12Å; Y177-P179 HydrophobicContact CD1-CG 4.48Å; Y177-P179 HydrophobicContact CE1-CB 3.63Å; Y177-P179 HydrophobicContact CE1-CG 4.46Å; Y177-P179 WeakPolarHBondContact O-CD 3.43Å; Y177-P180 WeakPolarHBondContact OH-CD 3.32Å; Y177-I183 HydrophobicContact CE1-CG2 4.4Å
178	H	92.4	Very high	89.5	Confident	84 Å²	84	67.5 Å²	67.5	39%	0.389	34%	0.343	S	S	.	.			trans	-100.1	91.5	173.2	-72.7	-175.3	0	0	0	110	C158 S161 C169 C174 F176	C158-H178 WeakPolarHBondContact CB-CD2 3.49Å; C158-H178 WeakPolarHBondContact CB-NE2 3.49Å; C158-H178 PolarHBondContact SG-NE2 3.5Å; C158-H178 VanDerWaalsContact SG-NE2 3.43Å; S161-H178 VanDerWaalsContact CB-CD2 3.49Å; S161-H178 WeakPolarHBondContact CB-CD2 3.45Å; C169-H178 WeakPolarHBondContact CB-CE1 3.32Å; C174-H178 PolarHBondContact SG-NE2 2.85Å; F176-H178 PolarHBondContact O-CD2 3.32Å; F176-H178 PolarHBondContact O-N 3.31Å
179	P	91.5	Very high	89.9	Confident	8 Å²	8	65.6 Å²	65.6	5%	0.052	34%	0.337	C	S	.	.			trans	-64.5	141.2	-176.3	21.6	-34.1	0	0	0	113.7	V157 M162 Y177 I183 R184 I187	V157-P179 HydrophobicContact CG1-CG 3.71Å; M162-P179 HydrophobicContact SD-CG 4.01Å; Y177-P179 HydrophobicContact CD1-CB 4.12Å; Y177-P179 HydrophobicContact CD1-CG 4.48Å; Y177-P179 HydrophobicContact CE1-CB 3.63Å; Y177-P179 HydrophobicContact CE1-CG 4.46Å; Y177-P179 WeakPolarHBondContact O-CD 3.43Å; P179-I183 HydrophobicContact CB-CB 3.87Å; P179-I183 HydrophobicContact CB-CG2 3.6Å; P179-R184 HydrophobicContact CB-CG 3.84Å; P179-R184 HydrophobicContact CG-CG 3.47Å; P179-R184 VanDerWaalsContact CG-CG 3.47Å; P179-R184 WeakPolarHBondContact O-CD 3.4Å; P179-R184 WeakPolarHBondContact O-CG 3.47Å; P179-R184 PolarHBondContact O-NE 2.61Å; P179-I187 HydrophobicContact CB-CD1 4.16Å; P179-I187 HydrophobicContact CG-CD1 3.98Å
180	P	89.7	Confident	90	Very high	72 Å²	72	68 Å²	68	47%	0.468	35%	0.345	S	S	.	.			trans	-55.9	159.9	163.4	-24.6	33.5	0	0	0	112.3	Y177 L182 I183 R184	Y177-P180 WeakPolarHBondContact OH-CD 3.32Å; P180-L182 VanDerWaalsContact C-N 3.3Å; P180-L182 PolarHBondContact O-N 3.12Å; P180-I183 PolarHBondContact O-N 2.89Å; P180-R184 PolarHBondContact O-N 2.72Å
181	K	86.6	Confident	90.2	Very high	90 Å²	90	65.8 Å²	65.8	39%	0.391	33%	0.328	S	S	.	.	H	α-helix	trans	-49.4	-47	-177.2	-174.8	179.3	177.1	-176.3	0	113.5	I183 R184 D185	K181-I183 VanDerWaalsContact C-N 3.33Å; K181-I183 PolarHBondContact O-N 3.05Å; K181-R184 WeakPolarHBondContact O-CB 3.4Å; K181-R184 PolarHBondContact O-N 3.35Å; K181-D185 VanDerWaalsContact O-CG 3.28Å; K181-D185 PolarHBondContact O-N 3.04Å
182	L	85.9	Confident	90.3	Very high	62 Å²	62	64.3 Å²	64.3	33%	0.325	33%	0.326	S	S	.	.	H	α-helix	trans	-58.8	-44.9	179.5	-173.3	88.7	0	0	0	112.5	M135 P180 D185 K186	M135-L182 HydrophobicContact CB-CD2 4.46Å; M135-L182 HydrophobicContact CE-CD1 4.45Å; M135-L182 HydrophobicContact CG-CD1 4.46Å; M135-L182 HydrophobicContact CG-CD2 3.48Å; M135-L182 VanDerWaalsContact CG-CD2 3.48Å; M135-L182 HydrophobicContact SD-CB 4.41Å; M135-L182 HydrophobicContact SD-CD1 3.28Å; M135-L182 WeakPolarHBondContact SD-CD1 3.19Å; M135-L182 HydrophobicContact SD-CD2 3.23Å; M135-L182 WeakPolarHBondContact SD-CD2 3.42Å; M135-L182 HydrophobicContact SD-CG 3.73Å; P180-L182 VanDerWaalsContact C-N 3.3Å; P180-L182 PolarHBondContact O-N 3.12Å; L182-D185 PolarHBondContact O-N 3.46Å; L182-K186 WeakPolarHBondContact O-CG 3.38Å; L182-K186 PolarHBondContact O-N 3.43Å
183	I	91.1	Very high	90.6	Very high	8 Å²	8	60.4 Å²	60.4	4%	0.041	30%	0.301	C	S	.	.	H	α-helix	trans	-70.5	-39.1	-179.7	-65.2	-178.5	0	0	0	109.8	W108 A138 Y177 P179 P180 K181 D185 K186 I187	W108-I183 HydrophobicContact CD2-CG2 4.14Å; W108-I183 HydrophobicContact CG-CG2 4.26Å; W108-I183 HydrophobicContact CZ2-CG2 4.13Å; A138-I183 WeakPolarHBondContact O-CD1 3.34Å; Y177-I183 HydrophobicContact CE1-CG2 4.4Å; P179-I183 HydrophobicContact CB-CB 3.87Å; P179-I183 HydrophobicContact CB-CG2 3.6Å; P180-I183 PolarHBondContact O-N 2.89Å; K181-I183 VanDerWaalsContact C-N 3.33Å; K181-I183 PolarHBondContact O-N 3.05Å; I183-D185 PolarHBondContact O-N 2.94Å; I183-K186 PolarHBondContact O-N 3.18Å; I183-I187 HydrophobicContact CG2-CD1 3.74Å; I183-I187 HydrophobicContact CG2-CG1 4.36Å; I183-I187 WeakPolarHBondContact O-CD1 2.89Å; I183-I187 WeakPolarHBondContact O-CG1 3.44Å; I183-I187 PolarHBondContact O-N 3.49Å
184	R	91.1	Very high	90.8	Very high	65 Å²	65	56.1 Å²	56.1	25%	0.245	28%	0.277	C	S	.	.	H	α-helix	trans	-54.5	-51.5	172.6	-76	-172	-65.6	172.4	2.3	111.8	S161 M162 P179 P180 K181 K186 I187 V188	S161-R184 VanDerWaalsContact O-CD 3.27Å; S161-R184 WeakPolarHBondContact O-CD 3.23Å; S161-R184 PolarHBondContact O-NH1 3.41Å; S161-R184 VanDerWaalsContact O-NH1 3.14Å; M162-R184 HydrophobicContact CE-CB 4.4Å; M162-R184 HydrophobicContact SD-CB 4.48Å; M162-R184 HydrophobicContact SD-CG 3.99Å; P179-R184 HydrophobicContact CB-CG 3.84Å; P179-R184 HydrophobicContact CG-CG 3.47Å; P179-R184 VanDerWaalsContact CG-CG 3.47Å; P179-R184 WeakPolarHBondContact O-CD 3.4Å; P179-R184 WeakPolarHBondContact O-CG 3.47Å; P179-R184 PolarHBondContact O-NE 2.61Å; P180-R184 PolarHBondContact O-N 2.72Å; K181-R184 WeakPolarHBondContact O-CB 3.4Å; K181-R184 PolarHBondContact O-N 3.35Å; R184-K186 PolarHBondContact O-N 2.89Å; R184-I187 PolarHBondContact O-N 3.2Å; R184-I187 VanDerWaalsContact O-N 3.13Å; R184-V188 WeakPolarHBondContact O-CG2 3.5Å; R184-V188 PolarHBondContact O-N 2.91Å
185	D	88.9	Confident	90.8	Very high	66 Å²	66	58.5 Å²	58.5	35%	0.353	28%	0.283	S	S	.	.	H	α-helix	trans	-60.4	-37.5	-177.9	-66	-20.4	0	0	0	111.2	Y11 K181 L182 I183 V188 A189	Y11-D185 PolarHBondContact OH-OD1 2.88Å; K181-D185 VanDerWaalsContact O-CG 3.28Å; K181-D185 PolarHBondContact O-N 3.04Å; L182-D185 PolarHBondContact O-N 3.46Å; I183-D185 PolarHBondContact O-N 2.94Å; D185-V188 PolarHBondContact O-N 3.38Å; D185-A189 WeakPolarHBondContact O-CB 3.47Å; D185-A189 PolarHBondContact O-N 3.28Å
186	K	91	Very high	90.8	Very high	56 Å²	56	54.7 Å²	54.7	24%	0.243	27%	0.271	C	S	.	.	H	α-helix	trans	-68	-41	175	-69	179.1	-179.4	-175.3	0	113.4	W108 L182 I183 R184 V188 A189 K190	W108-K186 HydrophobicContact CH2-CB 3.68Å; W108-K186 HydrophobicContact CZ2-CB 4.11Å; W108-K186 HydrophobicContact CZ2-CD 4.47Å; L182-K186 WeakPolarHBondContact O-CG 3.38Å; L182-K186 PolarHBondContact O-N 3.43Å; I183-K186 PolarHBondContact O-N 3.18Å; R184-K186 PolarHBondContact O-N 2.89Å; K186-V188 VanDerWaalsContact C-N 3.34Å; K186-A189 PolarHBondContact O-N 3.29Å; K186-K190 WeakPolarHBondContact O-CB 3.47Å; K186-K190 PolarHBondContact O-N 3.26Å
187	I	92.3	Very high	90.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-44.5	175.7	-67.7	158.2	0	0	0	110.1	W105 W108 V157 M162 P179 I183 R184 K190 R191	W105-I187 HydrophobicContact CE3-CG2 3.89Å; W105-I187 HydrophobicContact CZ3-CG2 4.14Å; W108-I187 HydrophobicContact CD2-CD1 4.18Å; W108-I187 HydrophobicContact CD2-CG1 3.83Å; W108-I187 HydrophobicContact CE3-CD1 4.1Å; W108-I187 HydrophobicContact CE3-CG1 3.29Å; W108-I187 HydrophobicContact CG-CD1 4.5Å; W108-I187 HydrophobicContact CH2-CG1 4.12Å; W108-I187 HydrophobicContact CZ3-CB 4.36Å; W108-I187 HydrophobicContact CZ3-CG1 3.45Å; W108-I187 VanDerWaalsContact CZ3-CG1 3.45Å; V157-I187 HydrophobicContact CB-CD1 4.46Å; V157-I187 HydrophobicContact CG1-CD1 4.1Å; V157-I187 HydrophobicContact CG2-CD1 3.65Å; M162-I187 HydrophobicContact CE-CB 3.76Å; M162-I187 HydrophobicContact CE-CG2 3.54Å; M162-I187 HydrophobicContact SD-CB 4.43Å; M162-I187 HydrophobicContact SD-CD1 4.2Å; M162-I187 HydrophobicContact SD-CG2 4.15Å; P179-I187 HydrophobicContact CB-CD1 4.16Å; P179-I187 HydrophobicContact CG-CD1 3.98Å; I183-I187 HydrophobicContact CG2-CD1 3.74Å; I183-I187 HydrophobicContact CG2-CG1 4.36Å; I183-I187 WeakPolarHBondContact O-CD1 2.89Å; I183-I187 WeakPolarHBondContact O-CG1 3.44Å; I183-I187 PolarHBondContact O-N 3.49Å; R184-I187 PolarHBondContact O-N 3.2Å; R184-I187 VanDerWaalsContact O-N 3.13Å; I187-K190 PolarHBondContact O-N 2.96Å; I187-R191 PolarHBondContact O-N 3.39Å
188	V	90.6	Very high	90.4	Very high	50 Å²	50	57 Å²	57	30%	0.303	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-46.9	176.3	175.2	0	0	0	0	110.8	M162 R184 D185 K186 K190 R191 H192	M162-V188 HydrophobicContact CE-CG2 3.49Å; M162-V188 VanDerWaalsContact CE-CG2 3.49Å; R184-V188 WeakPolarHBondContact O-CG2 3.5Å; R184-V188 PolarHBondContact O-N 2.91Å; D185-V188 PolarHBondContact O-N 3.38Å; K186-V188 VanDerWaalsContact C-N 3.34Å; V188-K190 VanDerWaalsContact C-N 3.35Å; V188-K190 PolarHBondContact O-N 2.88Å; V188-R191 PolarHBondContact O-N 2.99Å; V188-H192 WeakPolarHBondContact O-CB 3.48Å; V188-H192 PolarHBondContact O-N 3.41Å
189	A	90.8	Very high	90.3	Very high	57 Å²	57	56.5 Å²	56.5	47%	0.471	28%	0.277	S	S	.	.	H	α-helix	trans	-59.7	-43.7	177.1	0	0	0	0	0	112.1	D185 K186 R191 H192 A193	D185-A189 WeakPolarHBondContact O-CB 3.47Å; D185-A189 PolarHBondContact O-N 3.28Å; K186-A189 PolarHBondContact O-N 3.29Å; A189-R191 PolarHBondContact O-N 2.98Å; A189-H192 PolarHBondContact O-N 3.46Å; A189-A193 WeakPolarHBondContact O-CB 3.27Å; A189-A193 PolarHBondContact O-N 2.91Å
190	K	91.4	Very high	90.3	Very high	72 Å²	72	60 Å²	60	31%	0.313	30%	0.298	S	S	.	.	H	α-helix	trans	-60.3	-45.3	176.3	-175.8	179.4	-180	-178.5	0	111.7	W108 K186 I187 V188 A193 Q194	W108-K190 HydrophobicContact CZ3-CD 4.16Å; K186-K190 WeakPolarHBondContact O-CB 3.47Å; K186-K190 PolarHBondContact O-N 3.26Å; I187-K190 PolarHBondContact O-N 2.96Å; V188-K190 VanDerWaalsContact C-N 3.35Å; V188-K190 PolarHBondContact O-N 2.88Å; K190-A193 PolarHBondContact O-N 2.94Å; K190-Q194 WeakPolarHBondContact O-CB 3.41Å; K190-Q194 PolarHBondContact O-N 3.04Å
191	R	91.5	Very high	90.2	Very high	80 Å²	80	61.7 Å²	61.7	30%	0.302	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-45.7	175.7	-178.3	-175.1	178.6	-133	-1.7	111.3	E18 W105 I187 V188 A189 Q194 Y195	E18-R191 IonicContact OE1-CZ 3.18Å; E18-R191 IonicContact OE1-NH1 2.97Å; E18-R191 PolarHBondContact OE1-NH1 2.81Å; W105-R191 HydrophobicContact CB-CB 4.41Å; W105-R191 HydrophobicContact CD2-CB 4.23Å; W105-R191 HydrophobicContact CD2-CG 3.99Å; W105-R191 HydrophobicContact CE3-CB 4.21Å; W105-R191 HydrophobicContact CE3-CG 4.3Å; W105-R191 HydrophobicContact CG-CB 4.34Å; W105-R191 HydrophobicContact CG-CG 4.19Å; I187-R191 PolarHBondContact O-N 3.39Å; V188-R191 PolarHBondContact O-N 2.99Å; A189-R191 PolarHBondContact O-N 2.98Å; R191-Q194 PolarHBondContact O-N 3.21Å; R191-Y195 PolarHBondContact O-N 3.16Å
192	H	90.9	Very high	90.2	Very high	106 Å²	106	63.1 Å²	63.1	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-63.8	-44.8	179.1	-174.8	-102.1	0	0	0	111.9	V188 A189 Q194 Y195 L196	V188-H192 WeakPolarHBondContact O-CB 3.48Å; V188-H192 PolarHBondContact O-N 3.41Å; A189-H192 PolarHBondContact O-N 3.46Å; H192-Q194 VanDerWaalsContact C-N 3.3Å; H192-Q194 PolarHBondContact O-N 3.3Å; H192-Y195 WeakPolarHBondContact O-CB 3.32Å; H192-Y195 PolarHBondContact O-N 3.4Å; H192-L196 WeakPolarHBondContact O-CG 3.17Å; H192-L196 PolarHBondContact O-N 3.22Å
193	A	90.5	Very high	90.4	Very high	28 Å²	28	63.7 Å²	63.7	23%	0.231	31%	0.308	C	S	.	.	H	α-helix	trans	-61.6	-37.5	175.3	0	0	0	0	0	112.3	A189 K190 R197	A189-A193 WeakPolarHBondContact O-CB 3.27Å; A189-A193 PolarHBondContact O-N 2.91Å; K190-A193 PolarHBondContact O-N 2.94Å; A193-R197 WeakPolarHBondContact O-CG 3.48Å; A193-R197 PolarHBondContact O-N 2.54Å; A193-R197 VanDerWaalsContact O-N 3.14Å; A193-R197 PolarHBondContact O-NE 3.14Å
194	Q	90.3	Very high	90.1	Very high	17 Å²	17	65.6 Å²	65.6	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-65.7	-45.4	173.3	-177.8	178.4	-22.6	0	0	111.8	Q103 K190 R191 H192 L196 R197 E198	Q103-Q194 PolarHBondContact O-NE2 3.5Å; K190-Q194 WeakPolarHBondContact O-CB 3.41Å; K190-Q194 PolarHBondContact O-N 3.04Å; R191-Q194 PolarHBondContact O-N 3.21Å; H192-Q194 VanDerWaalsContact C-N 3.3Å; H192-Q194 PolarHBondContact O-N 3.3Å; Q194-L196 VanDerWaalsContact C-N 3.34Å; Q194-L196 PolarHBondContact O-N 3.24Å; Q194-R197 PolarHBondContact O-N 2.96Å; Q194-E198 HydrophobicContact CG-CG 4.49Å; Q194-E198 WeakPolarHBondContact CG-OE1 3.02Å; Q194-E198 PolarHBondContact NE2-OE1 3.13Å; Q194-E198 WeakPolarHBondContact O-CG 3.41Å; Q194-E198 PolarHBondContact O-N 3.05Å
195	Y	90.9	Very high	89.7	Confident	79 Å²	79	65 Å²	65	31%	0.31	33%	0.331	S	S	.	.	H	α-helix	trans	-57.4	-45.8	177.1	173.6	-105.6	0	0	0	112.1	E21 R191 H192 R197 E198 K199	E21-Y195 VanDerWaalsContact CD-OH 3.28Å; E21-Y195 PolarHBondContact OE1-OH 3.34Å; E21-Y195 PolarHBondContact OE2-OH 2.82Å; R191-Y195 PolarHBondContact O-N 3.16Å; H192-Y195 WeakPolarHBondContact O-CB 3.32Å; H192-Y195 PolarHBondContact O-N 3.4Å; Y195-R197 PolarHBondContact O-N 3.38Å; Y195-E198 PolarHBondContact O-N 2.91Å; Y195-K199 HydrophobicContact CE1-CD 4.21Å; Y195-K199 WeakPolarHBondContact O-CB 3.42Å; Y195-K199 PolarHBondContact O-N 2.96Å
196	L	92.3	Very high	89.3	Confident	57 Å²	57	67.5 Å²	67.5	30%	0.298	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-44.6	177.1	-70.9	176.8	0	0	0	112.1	H192 Q194 E198 K199 V200	H192-L196 WeakPolarHBondContact O-CG 3.17Å; H192-L196 PolarHBondContact O-N 3.22Å; Q194-L196 VanDerWaalsContact C-N 3.34Å; Q194-L196 PolarHBondContact O-N 3.24Å; L196-E198 PolarHBondContact O-N 2.95Å; L196-K199 PolarHBondContact O-N 3.38Å; L196-V200 WeakPolarHBondContact O-CG2 3.31Å; L196-V200 PolarHBondContact O-N 3.49Å
197	R	89.2	Confident	88.4	Confident	84 Å²	84	68.3 Å²	68.3	32%	0.317	35%	0.351	S	S	.	.	H	α-helix	trans	-58.7	-46.8	174.9	-75.5	-177.1	-72.4	141.1	-6	111.6	A193 Q194 Y195 K199 V200 I201 I397	A193-R197 WeakPolarHBondContact O-CG 3.48Å; A193-R197 PolarHBondContact O-N 2.54Å; A193-R197 VanDerWaalsContact O-N 3.14Å; A193-R197 PolarHBondContact O-NE 3.14Å; Q194-R197 PolarHBondContact O-N 2.96Å; Y195-R197 PolarHBondContact O-N 3.38Å; R197-K199 VanDerWaalsContact C-N 3.31Å; R197-K199 PolarHBondContact O-N 2.91Å; R197-V200 PolarHBondContact O-N 3.33Å; R197-I201 VanDerWaalsContact O-CG1 3.3Å; R197-I201 WeakPolarHBondContact O-CG1 3.05Å; R197-I201 PolarHBondContact O-N 2.87Å; R197-I201 VanDerWaalsContact O-N 3.12Å; R197-I397 HydrophobicContact CG-CG2 4.15Å
198	E	89.5	Confident	87.1	Confident	56 Å²	56	76.8 Å²	76.8	26%	0.262	38%	0.383	S	S	.	.	H	α-helix	trans	-64.3	-34.3	177.2	-71.2	-178.4	-159.4	0	0	112.3	R102 Q194 Y195 L196 R202	R102-E198 IonicContact NH1-OE2 2.95Å; R102-E198 PolarHBondContact NH1-OE2 3.46Å; Q194-E198 HydrophobicContact CG-CG 4.49Å; Q194-E198 WeakPolarHBondContact CG-OE1 3.02Å; Q194-E198 PolarHBondContact NE2-OE1 3.13Å; Q194-E198 WeakPolarHBondContact O-CG 3.41Å; Q194-E198 PolarHBondContact O-N 3.05Å; Y195-E198 PolarHBondContact O-N 2.91Å; L196-E198 PolarHBondContact O-N 2.95Å; E198-R202 WeakPolarHBondContact O-CB 3.27Å; E198-R202 VanDerWaalsContact O-CG 3.29Å; E198-R202 WeakPolarHBondContact O-CG 3.17Å; E198-R202 PolarHBondContact O-N 3.29Å; E198-R202 PolarHBondContact O-NE 3.47Å
199	K	90.9	Very high	86	Confident	73 Å²	73	82.5 Å²	82.5	32%	0.317	40%	0.404	S	S	.	.	H	α-helix	trans	-67.1	-48.6	176.3	-170.7	170.2	-178.4	170.6	0	111.5	E21 Y195 L196 R197 I201 R202 D203	E21-K199 IonicContact OE1-NZ 2.81Å; E21-K199 PolarHBondContact OE1-NZ 3.19Å; Y195-K199 HydrophobicContact CE1-CD 4.21Å; Y195-K199 WeakPolarHBondContact O-CB 3.42Å; Y195-K199 PolarHBondContact O-N 2.96Å; L196-K199 PolarHBondContact O-N 3.38Å; R197-K199 VanDerWaalsContact C-N 3.31Å; R197-K199 PolarHBondContact O-N 2.91Å; K199-I201 VanDerWaalsContact C-N 3.34Å; K199-I201 PolarHBondContact O-N 3.25Å; K199-R202 WeakPolarHBondContact O-CB 3.13Å; K199-R202 PolarHBondContact O-N 3.5Å; K199-R202 VanDerWaalsContact O-N 3.13Å; K199-D203 PolarHBondContact O-N 3.32Å
200	V	90	Very high	84.6	Confident	81 Å²	81	85.5 Å²	85.5	49%	0.491	41%	0.411	S	S	.	.	H	α-helix	trans	-58.1	-45.1	176.8	173.3	0	0	0	0	111.4	L196 R197 R202 D203 A204	L196-V200 WeakPolarHBondContact O-CG2 3.31Å; L196-V200 PolarHBondContact O-N 3.49Å; R197-V200 PolarHBondContact O-N 3.33Å; V200-R202 VanDerWaalsContact C-N 3.34Å; V200-R202 PolarHBondContact O-N 2.91Å; V200-D203 PolarHBondContact O-N 3.5Å; V200-A204 WeakPolarHBondContact O-CB 3.43Å; V200-A204 PolarHBondContact O-N 3.3Å
201	I	88.2	Confident	83	Confident	109 Å²	109	86 Å²	86	56%	0.559	42%	0.42	S	S	*	.	H	α-helix	trans	-63.3	-40.6	177.7	-66.4	166.2	0	0	0	111.3	R197 K199 S205	R197-I201 VanDerWaalsContact O-CG1 3.3Å; R197-I201 WeakPolarHBondContact O-CG1 3.05Å; R197-I201 PolarHBondContact O-N 2.87Å; R197-I201 VanDerWaalsContact O-N 3.12Å; K199-I201 VanDerWaalsContact C-N 3.34Å; K199-I201 PolarHBondContact O-N 3.25Å; I201-S205 WeakPolarHBondContact O-CB 3.26Å; I201-S205 PolarHBondContact O-N 3.1Å; I201-S205 VanDerWaalsContact O-N 3.08Å; I201-S205 PolarHBondContact O-OG 3.37Å
202	R	87.7	Confident	81.2	Confident	120 Å²	120	84.4 Å²	84.4	45%	0.453	43%	0.43	S	S	.	.	H	α-helix	trans	-64.1	-44.4	176.8	-79.7	-172.2	-68	161.5	-0.9	111.7	E198 K199 V200 S205 K206	E198-R202 WeakPolarHBondContact O-CB 3.27Å; E198-R202 VanDerWaalsContact O-CG 3.29Å; E198-R202 WeakPolarHBondContact O-CG 3.17Å; E198-R202 PolarHBondContact O-N 3.29Å; E198-R202 PolarHBondContact O-NE 3.47Å; K199-R202 WeakPolarHBondContact O-CB 3.13Å; K199-R202 PolarHBondContact O-N 3.5Å; K199-R202 VanDerWaalsContact O-N 3.13Å; V200-R202 VanDerWaalsContact C-N 3.34Å; V200-R202 PolarHBondContact O-N 2.91Å; R202-S205 PolarHBondContact O-N 3.35Å; R202-K206 WeakPolarHBondContact O-CG 3.44Å; R202-K206 PolarHBondContact O-N 3.19Å
203	D	88.5	Confident	79.3	Confident	73 Å²	73	86.1 Å²	86.1	39%	0.39	44%	0.442	S	S	.	.	H	α-helix	trans	-72.6	-36.2	-177.5	-65.6	-25.1	0	0	0	112	K199 V200 S205 K206 S207	K199-D203 PolarHBondContact O-N 3.32Å; V200-D203 PolarHBondContact O-N 3.5Å; D203-S205 VanDerWaalsContact C-N 3.27Å; D203-S205 PolarHBondContact O-N 3.26Å; D203-K206 PolarHBondContact O-N 3.35Å; D203-K206 IonicContact OD1-NZ 3.29Å; D203-K206 PolarHBondContact OD1-NZ 3.05Å; D203-S207 PolarHBondContact O-N 2.79Å
204	A	85.2	Confident	77.5	Confident	48 Å²	48	91.9 Å²	91.9	40%	0.397	47%	0.468	S	S	.	.	H	α-helix	trans	-61.5	-35.1	169.5	0	0	0	0	0	112.6	V200 R208	V200-A204 WeakPolarHBondContact O-CB 3.43Å; V200-A204 PolarHBondContact O-N 3.3Å; A204-R208 PolarHBondContact O-N 3.39Å; A204-R208 VanDerWaalsContact O-N 3.17Å
205	S	82.7	Confident	75.5	Confident	52 Å²	52	96.5 Å²	96.5	36%	0.364	50%	0.497	S	S	.	.	H	α-helix	trans	-74.9	-34	178.1	-57.1	0	0	0	0	112.7	I201 R202 D203 K209	I201-S205 WeakPolarHBondContact O-CB 3.26Å; I201-S205 PolarHBondContact O-N 3.1Å; I201-S205 VanDerWaalsContact O-N 3.08Å; I201-S205 PolarHBondContact O-OG 3.37Å; R202-S205 PolarHBondContact O-N 3.35Å; D203-S205 VanDerWaalsContact C-N 3.27Å; D203-S205 PolarHBondContact O-N 3.26Å; S205-K209 PolarHBondContact O-N 2.79Å; S205-K209 VanDerWaalsContact O-N 3.16Å
206	K	81.7	Confident	73.3	Confident	120 Å²	120	101.7 Å²	101.7	52%	0.522	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-41.7	171.8	-68.4	171.2	-167.3	159.5	0	111.7	R202 D203 R208 K209 L210	R202-K206 WeakPolarHBondContact O-CG 3.44Å; R202-K206 PolarHBondContact O-N 3.19Å; D203-K206 PolarHBondContact O-N 3.35Å; D203-K206 IonicContact OD1-NZ 3.29Å; D203-K206 PolarHBondContact OD1-NZ 3.05Å; K206-R208 PolarHBondContact O-N 3.38Å; K206-K209 PolarHBondContact O-N 3.42Å; K206-K209 VanDerWaalsContact O-N 3.14Å; K206-L210 PolarHBondContact O-N 3.01Å
207	S	71.6	Confident	71.2	Confident	73 Å²	73	107.8 Å²	107.8	51%	0.51	55%	0.549	S	S	.	.	H	α-helix	trans	-61.1	-43.4	177.4	-176	0	0	0	0	111.7	D203 K209 L210 T211	D203-S207 PolarHBondContact O-N 2.79Å; S207-K209 VanDerWaalsContact C-N 3.32Å; S207-K209 PolarHBondContact O-N 3.2Å; S207-L210 PolarHBondContact O-N 2.85Å; S207-T211 PolarHBondContact O-N 3.04Å; S207-T211 PolarHBondContact O-OG1 2.89Å
208	R	65.1	Low	69.1	Low	178 Å²	178	112.7 Å²	112.7	67%	0.672	58%	0.575	S	S	*	*	H	α-helix	trans	-63.5	-33.1	173.7	-74.3	-172.3	-69.7	-179.6	0.2	113.6	A204 K206 T211 G212	A204-R208 PolarHBondContact O-N 3.39Å; A204-R208 VanDerWaalsContact O-N 3.17Å; K206-R208 PolarHBondContact O-N 3.38Å; R208-T211 WeakPolarHBondContact CA-OG1 3.24Å; R208-T211 PolarHBondContact O-OG1 2.86Å; R208-G212 PolarHBondContact O-N 2.91Å
209	K	66.4	Low	66.7	Low	170 Å²	170	117.9 Å²	117.9	74%	0.739	61%	0.605	S	S	*	*	H	α-helix	trans	-73.1	-30	177.1	-158.7	171.1	-175.7	179.8	0	112.5	S205 K206 S207 L213	S205-K209 PolarHBondContact O-N 2.79Å; S205-K209 VanDerWaalsContact O-N 3.16Å; K206-K209 PolarHBondContact O-N 3.42Å; K206-K209 VanDerWaalsContact O-N 3.14Å; S207-K209 VanDerWaalsContact C-N 3.32Å; S207-K209 PolarHBondContact O-N 3.2Å; K209-L213 PolarHBondContact O-N 3.37Å
210	L	61	Low	64.7	Low	119 Å²	119	121.9 Å²	121.9	62%	0.623	63%	0.628	S	S	*	*	H	α-helix	trans	-76.3	-39.5	173.3	-81.1	162.5	0	0	0	112.3	K206 S207 L213 L214	K206-L210 PolarHBondContact O-N 3.01Å; S207-L210 PolarHBondContact O-N 2.85Å; L210-L213 PolarHBondContact O-N 3.36Å; L210-L214 WeakPolarHBondContact O-CG 3.15Å; L210-L214 PolarHBondContact O-N 2.87Å
211	T	59.4	Low	62.4	Low	82 Å²	82	124.7 Å²	124.7	50%	0.503	64%	0.64	S	S	.	*	H	α-helix	trans	-71.8	-32.8	176.3	27	0	0	0	0	112.9	S207 R208 L213 L214 T215	S207-T211 PolarHBondContact O-N 3.04Å; S207-T211 PolarHBondContact O-OG1 2.89Å; R208-T211 WeakPolarHBondContact CA-OG1 3.24Å; R208-T211 PolarHBondContact O-OG1 2.86Å; T211-L213 VanDerWaalsContact C-N 3.32Å; T211-L213 PolarHBondContact O-N 2.98Å; T211-L214 PolarHBondContact O-N 2.87Å; T211-T215 PolarHBondContact O-OG1 3.38Å
212	G	52.4	Low	60.1	Low	48 Å²	48	125.6 Å²	125.6	50%	0.495	65%	0.653	S	S	.	*	H	α-helix	trans	-73	-18	173.5	0	0	0	0	0	114.8	R208	R208-G212 PolarHBondContact O-N 2.91Å
213	L	52.2	Low	57.7	Low	142 Å²	142	122.5 Å²	122.5	74%	0.743	66%	0.659	S	S	*	*	H	α-helix	trans	-86.6	-21.2	173	-146.9	86.6	0	0	0	112.2	K209 L210 T211	K209-L213 PolarHBondContact O-N 3.37Å; L210-L213 PolarHBondContact O-N 3.36Å; T211-L213 VanDerWaalsContact C-N 3.32Å; T211-L213 PolarHBondContact O-N 2.98Å
214	L	51.8	Low	55.5	Low	149 Å²	149	126 Å²	126	78%	0.78	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	4.2	178.7	-68.3	174.4	0	0	0	113.8	L210 T211	L210-L214 WeakPolarHBondContact O-CG 3.15Å; L210-L214 PolarHBondContact O-N 2.87Å; T211-L214 PolarHBondContact O-N 2.87Å
215	T	47.9	Very low	53.5	Low	113 Å²	113	131.4 Å²	131.4	69%	0.693	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.5	15.5	177.9	19.9	0	0	0	0	114	T211	T211-T215 PolarHBondContact O-OG1 3.38Å
216	F	46.1	Very low	51.6	Low	189 Å²	189	136.9 Å²	136.9	83%	0.829	72%	0.723	S	S	*	*	S	Bend	trans	-111.8	40.9	179.1	-135.8	-88.1	0	0	0	113.2
217	E	46.7	Very low	49.6	Very low	184 Å²	184	136.8 Å²	136.8	86%	0.86	74%	0.737	S	S	*	*	S	Bend	trans	-149.5	73.2	163.7	-76.3	-151.4	136.4	0	0	110.1
218	Q	45.8	Very low	48	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	76%	0.756	S	S	*	*			trans	-177.1	71.9	154.3	-103.5	162.4	19.4	0	0	108.6
219	N	39	Very low	46.9	Very low	164 Å²	164	144.1 Å²	144.1	88%	0.877	77%	0.765	S	S	*	*			trans	-122.2	69.6	163.8	-140.8	-26	0	0	0	106.9
220	I	48.7	Very low	45.6	Very low	158 Å²	158	140.2 Å²	140.2	81%	0.81	76%	0.759	S	S	*	*			trans	-95.4	105.1	168.1	-62.4	-178.1	0	0	0	106.6
221	N	42.1	Very low	44.7	Very low	140 Å²	140	142.9 Å²	142.9	75%	0.749	77%	0.768	S	S	*	*			trans	39.9	118.5	148.7	-113.5	-27.4	0	0	0	119.6	G223	N221-G223 PolarHBondContact O-N 3.35Å
222	P	38.9	Very low	44	Very low	127 Å²	127	147.5 Å²	147.5	83%	0.825	79%	0.789	S	S	*	*			trans	-81.8	109.9	163.6	33.3	-25.3	0	0	0	108.4
223	G	38.4	Very low	43.3	Very low	56 Å²	56	154.2 Å²	154.2	58%	0.577	81%	0.805	S	S	*	*			trans	170.9	106.1	174.3	0	0	0	0	0	113.3	N221	N221-G223 PolarHBondContact O-N 3.35Å
224	N	42.2	Very low	42.6	Very low	147 Å²	147	155.7 Å²	155.7	79%	0.786	81%	0.812	S	S	*	*			trans	59.6	107.6	148.8	-51.8	-13.4	0	0	0	115.9
225	N	42.4	Very low	42	Very low	161 Å²	161	153.4 Å²	153.4	86%	0.861	81%	0.805	S	S	*	*				175	117.9	110.2	-79.6	-33.4	0	0	0	110.1	S227	N225-S227 PolarHBondContact O-N 3.39Å
226	I	43.1	Very low	41.5	Very low	167 Å²	167	154 Å²	154	86%	0.856	81%	0.809	S	S	*	*			trans	-59.7	122.8	163.3	-66.2	162.9	0	0	0	107.6
227	S	40.1	Very low	40.9	Very low	117 Å²	117	152.1 Å²	152.1	82%	0.818	81%	0.806	S	S	*	*			trans	-161.1	124.1	147.2	-85.5	0	0	0	0	111.2	N225	N225-S227 PolarHBondContact O-N 3.39Å
228	R	37.2	Very low	40.3	Very low	238 Å²	238	151.4 Å²	151.4	90%	0.898	81%	0.809	S	S	*	*			trans	-58	132.6	175.3	-63	167.1	175.9	156.4	-2.7	110.6
229	I	42.1	Very low	40	Very low	168 Å²	168	151.2 Å²	151.2	86%	0.862	81%	0.805	S	S	*	*			trans	-135.6	137.4	145.6	-64.9	-173.2	0	0	0	108.7
230	S	39.9	Very low	39.7	Very low	87 Å²	87	148.9 Å²	148.9	61%	0.608	80%	0.801	S	S	*	*			trans	-67.9	148.6	-162.5	48.2	0	0	0	0	117.4
231	H	41.6	Very low	39.1	Very low	176 Å²	176	146.5 Å²	146.5	82%	0.815	80%	0.797	S	S	*	*			trans	31.4	114.5	134	-52.7	-65.1	0	0	0	118.9
232	N	44.7	Very low	38.7	Very low	178 Å²	178	146.8 Å²	146.8	95%	0.952	80%	0.799	S	S	*	*			trans	-139.2	111.6	133.1	-88.1	-31.7	0	0	0	109
233	K	37.3	Very low	38.5	Very low	190 Å²	190	149.8 Å²	149.8	83%	0.826	80%	0.802	S	S	*	*			trans	-92.9	114.9	175.7	177.4	-178	-178.6	-177.1	0	106.7
234	L	38.9	Very low	38.3	Very low	172 Å²	172	152.5 Å²	152.5	90%	0.901	81%	0.812	S	S	*	*			trans	-134.4	141.8	159.9	-141	75.3	0	0	0	110.3
235	T	39	Very low	38	Very low	102 Å²	102	151.2 Å²	151.2	63%	0.626	81%	0.81	S	S	*	*			trans	-85.2	156.2	-154.6	23.9	0	0	0	0	114.4
236	T	36.6	Very low	37.8	Very low	126 Å²	126	149.6 Å²	149.6	77%	0.773	81%	0.805	S	S	*	*			trans	63.6	105.9	142.5	52	0	0	0	0	119.6
237	L	34.6	Very low	37.4	Very low	148 Å²	148	146.2 Å²	146.2	78%	0.775	79%	0.794	S	S	*	*				-167.2	93.1	108.1	-126.5	149.6	0	0	0	109.9	K239	L237-K239 HydrophobicContact CD2-CB 4.38Å; L237-K239 HydrophobicContact CD2-CD 3.98Å; L237-K239 HydrophobicContact CD2-CG 3.81Å
238	N	34.3	Very low	37.2	Very low	170 Å²	170	149.5 Å²	149.5	91%	0.909	80%	0.796	S	S	*	*			trans	-98	107.4	165.4	-141.5	-3.2	0	0	0	105.8
239	K	39.8	Very low	37	Very low	184 Å²	184	145 Å²	145	80%	0.8	79%	0.79	S	S	*	*			trans	-101.3	108.4	171.4	-105.1	178.5	179.4	-179.9	0	107.8	L237	L237-K239 HydrophobicContact CD2-CB 4.38Å; L237-K239 HydrophobicContact CD2-CD 3.98Å; L237-K239 HydrophobicContact CD2-CG 3.81Å
240	S	32.3	Very low	36.7	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	79%	0.79	S	S	*	*			trans	-59.3	134.9	160.4	59.7	0	0	0	0	110.2
241	C	35.1	Very low	36.4	Very low	107 Å²	107	149.2 Å²	149.2	72%	0.723	80%	0.797	S	S	*	*			trans	-155	108.4	147.4	-153.5	0	0	0	0	110
242	N	35	Very low	35.7	Very low	147 Å²	147	144.2 Å²	144.2	79%	0.786	79%	0.794	S	S	*	*			trans	66.3	103	145.3	-58.9	-11.4	0	0	0	120
243	Q	34.9	Very low	35.3	Very low	189 Å²	189	142.4 Å²	142.4	88%	0.883	78%	0.782	S	S	*	*			trans	-38.4	130.2	142.9	-70.5	165.8	3.1	0	0	111.9
244	S	33	Very low	35.2	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	78%	0.777	S	S	*	*			trans	-136.3	107.9	147	-173.8	0	0	0	0	107
245	V	35.7	Very low	34.6	Very low	120 Å²	120	138.2 Å²	138.2	73%	0.727	77%	0.774	S	S	*	*			trans	-77.5	123.6	174.9	172.5	0	0	0	0	107.1
246	V	38.9	Very low	34.5	Very low	127 Å²	127	139.3 Å²	139.3	77%	0.77	78%	0.78	S	S	*	*			trans	-111.4	120	161	-176.6	0	0	0	0	106.7
247	P	35.3	Very low	34.2	Very low	95 Å²	95	142 Å²	142	62%	0.617	78%	0.784	S	S	*	*			trans	-68.9	136.5	179.4	-15.8	29.6	0	0	0	111.8
248	Q	35.3	Very low	34.3	Very low	186 Å²	186	140 Å²	140	87%	0.869	78%	0.782	S	S	*	*			trans	-77.7	107.9	155.8	-89.2	173.4	-31.2	0	0	107.9	F250	Q248-F250 PolarHBondContact O-N 2.83Å
249	D	33.7	Very low	34.3	Very low	144 Å²	144	137.4 Å²	137.4	77%	0.77	78%	0.777	S	S	*	*			trans	-86.1	107.5	165.5	-75.6	-33.4	0	0	0	109.8
250	F	33.9	Very low	34	Very low	196 Å²	196	134 Å²	134	86%	0.86	78%	0.777	S	S	*	*			trans	-70.7	118.3	156.1	-110	-100.9	0	0	0	108.2	Q248	Q248-F250 PolarHBondContact O-N 2.83Å
251	I	34.3	Very low	34.1	Very low	147 Å²	147	134 Å²	134	75%	0.754	78%	0.777	S	S	*	*			trans	-136	102.1	154.2	-57.7	177.9	0	0	0	107.6	I253	I251-I253 HydrophobicContact CG2-CG1 4.23Å
252	G	27.5	Very low	34.2	Very low	72 Å²	72	134.8 Å²	134.8	74%	0.742	78%	0.778	S	S	*	*			trans	-108.5	113.1	152.4	0	0	0	0	0	107.1
253	I	35	Very low	34.4	Very low	139 Å²	139	135.5 Å²	135.5	71%	0.713	78%	0.78	S	S	*	*			trans	-147	101.9	169	-56.5	-177.1	0	0	0	108.4	I251	I251-I253 HydrophobicContact CG2-CG1 4.23Å
254	T	35.7	Very low	34.3	Very low	116 Å²	116	132.1 Å²	132.1	71%	0.712	77%	0.768	S	S	*	*			trans	51.2	128.5	139.3	65	0	0	0	0	122.6
255	D	27.1	Very low	34.6	Very low	159 Å²	159	138 Å²	138	85%	0.85	77%	0.773	S	S	*	*			trans	-45.9	130	147	-78.8	-50.5	0	0	0	112.6
256	V	36.8	Very low	34.6	Very low	124 Å²	124	137.6 Å²	137.6	75%	0.752	77%	0.767	S	S	*	*			trans	-145.4	113	152.6	-177.8	0	0	0	0	109.1
257	H	31.1	Very low	34.6	Very low	182 Å²	182	138.9 Å²	138.9	84%	0.843	77%	0.769	S	S	*	*			trans	-61.3	133	160	-88.5	-115.5	0	0	0	110.8
258	S	36.2	Very low	34.7	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	78%	0.784	S	S	*	*			trans	-176	104	148.8	-80.6	0	0	0	0	108.4
259	S	34	Very low	35	Very low	116 Å²	116	141.4 Å²	141.4	81%	0.811	78%	0.777	S	S	*	*				86.9	117.2	86	-66.6	0	0	0	0	114.3
260	S	33.8	Very low	35	Very low	113 Å²	113	140.9 Å²	140.9	79%	0.79	77%	0.774	S	S	*	*			trans	82.3	108.5	141.8	-146.5	0	0	0	0	120
261	S	34.5	Very low	35.3	Very low	114 Å²	114	139.1 Å²	139.1	80%	0.797	77%	0.773	S	S	*	*				-156	102.9	126.5	62.9	0	0	0	0	109.9
262	V	36.1	Very low	35.4	Very low	125 Å²	125	138.9 Å²	138.9	76%	0.758	77%	0.772	S	S	*	*			trans	-80.8	130.3	168.3	-178	0	0	0	0	107.7
263	I	39	Very low	35.8	Very low	162 Å²	162	144.5 Å²	144.5	83%	0.831	78%	0.779	S	S	*	*			trans	-126.9	102.7	157.9	-54.7	178.5	0	0	0	106.9
264	N	34.2	Very low	35.9	Very low	118 Å²	118	140.9 Å²	140.9	63%	0.631	78%	0.776	S	S	*	*			trans	-85.8	135.6	166.5	-170.2	6.9	0	0	0	108.1	D266	N264-D266 PolarHBondContact ND2-OD2 3.49Å; N264-D266 PolarHBondContact OD1-OD2 2.8Å
265	R	38.4	Very low	35.9	Very low	238 Å²	238	140.9 Å²	140.9	90%	0.898	78%	0.781	S	S	*	*			trans	-149.9	86.9	161.5	-138	-179.2	-177.4	166.9	1.9	110.1
266	D	36.1	Very low	36.4	Very low	111 Å²	111	140.9 Å²	140.9	59%	0.594	78%	0.775	S	S	*	*			trans	-59.5	157.1	155.5	-66.1	-56.9	0	0	0	111.3	N264	N264-D266 PolarHBondContact ND2-OD2 3.49Å; N264-D266 PolarHBondContact OD1-OD2 2.8Å
267	N	38.5	Very low	36.5	Very low	153 Å²	153	140.6 Å²	140.6	82%	0.818	78%	0.776	S	S	*	*			trans	97.6	100.3	170.5	-54.1	-54.1	0	0	0	116.8
268	L	38.2	Very low	37	Very low	176 Å²	176	137.9 Å²	137.9	92%	0.921	77%	0.768	S	S	*	*				-164.2	109.2	116.1	-104.7	154	0	0	0	111.4
269	H	40.3	Very low	37	Very low	158 Å²	158	138 Å²	138	73%	0.731	77%	0.769	S	S	*	*			trans	-73.6	148	168.3	-120.8	-84.3	0	0	0	110.6
270	N	35	Very low	37.2	Very low	133 Å²	133	139.4 Å²	139.4	71%	0.711	77%	0.772	S	S	*	*			trans	54.8	114.7	148.7	-61.4	-11.8	0	0	0	120.6
271	L	38.8	Very low	37.2	Very low	160 Å²	160	141.8 Å²	141.8	84%	0.838	77%	0.771	S	S	*	*			trans	-159.9	99.2	135.4	-127.8	75	0	0	0	107.2
272	L	36.8	Very low	37.2	Very low	141 Å²	141	144.5 Å²	144.5	74%	0.738	78%	0.775	S	S	*	*				77.3	105.2	102.9	-87.6	152.5	0	0	0	115.5
273	H	37.2	Very low	37.3	Very low	190 Å²	190	144 Å²	144	88%	0.88	77%	0.773	S	S	*	*				45.5	125.8	129.7	-80	-97.2	0	0	0	121.3
274	G	35.7	Very low	36.8	Very low	64 Å²	64	143.7 Å²	143.7	66%	0.66	77%	0.773	S	S	*	*			trans	164.7	71.3	158.1	0	0	0	0	0	111.9
275	S	36.5	Very low	37.1	Very low	115 Å²	115	143.3 Å²	143.3	80%	0.804	78%	0.777	S	S	*	*				51.3	97.9	102.1	61.2	0	0	0	0	116.5
276	H	36.5	Very low	37.1	Very low	159 Å²	159	136.1 Å²	136.1	74%	0.736	77%	0.769	S	S	*	*				-177	127.8	123	-129.2	-89.4	0	0	0	111	D278	H276-D278 IonicContact CE1-OD2 2.72Å; H276-D278 PolarHBondContact CE1-OD2 3.45Å; H276-D278 IonicContact ND1-OD2 4Å; H276-D278 PolarHBondContact ND1-OD2 3.43Å
277	P	39.9	Very low	37.2	Very low	118 Å²	118	139.3 Å²	139.3	77%	0.766	78%	0.78	S	S	*	*			trans	-112	128.7	157.2	33.5	-20.4	0	0	0	110.1
278	D	42.3	Very low	37.2	Very low	126 Å²	126	139 Å²	139	67%	0.674	77%	0.773	S	S	*	*			trans	-131.1	102.5	165.8	-82.5	-49.4	0	0	0	110.9	H276	H276-D278 IonicContact CE1-OD2 2.72Å; H276-D278 PolarHBondContact CE1-OD2 3.45Å; H276-D278 IonicContact ND1-OD2 4Å; H276-D278 PolarHBondContact ND1-OD2 3.43Å
279	S	36	Very low	37.2	Very low	108 Å²	108	138 Å²	138	76%	0.755	77%	0.768	S	S	*	*				36.3	102.8	121.4	-55.2	0	0	0	0	118.9
280	V	38.1	Very low	37.1	Very low	145 Å²	145	136.6 Å²	136.6	88%	0.879	77%	0.765	S	S	*	*				-141.6	107.9	127.7	-178.8	0	0	0	0	108.3
281	Q	33.4	Very low	37.3	Very low	163 Å²	163	137.7 Å²	137.7	76%	0.762	77%	0.765	S	S	*	*			trans	-73.3	140.9	160.6	-68	-164.3	18.5	0	0	109.3
282	L	34.5	Very low	37.2	Very low	171 Å²	171	137.8 Å²	137.8	90%	0.895	76%	0.762	S	S	*	*				-165.1	125.9	128.1	-106	136.3	0	0	0	110.6
283	T	37.2	Very low	37.4	Very low	116 Å²	116	139.5 Å²	139.5	71%	0.712	77%	0.765	S	S	*	*			trans	-80.3	143.3	-173.4	41.6	0	0	0	0	112.6
284	N	29.8	Very low	37.6	Very low	154 Å²	154	135.7 Å²	135.7	82%	0.824	76%	0.76	S	S	*	*			trans	-66.7	172	148.7	-123.6	-12.7	0	0	0	109
285	P	40	Very low	37.6	Very low	110 Å²	110	140.6 Å²	140.6	71%	0.714	77%	0.771	S	S	*	*			cis	-145.3	-163.2	3.9	34.6	-9.1	0	0	0	114.4
286	A	37.8	Very low	38.1	Very low	88 Å²	88	140 Å²	140	73%	0.727	77%	0.765	S	S	*	*			trans	98.4	113.9	144	0	0	0	0	0	122.1
287	H	39.7	Very low	38.1	Very low	178 Å²	178	136.9 Å²	136.9	82%	0.824	76%	0.761	S	S	*	*				53.2	125.4	121.4	-101.2	-106.1	0	0	0	123.6
288	H	37.4	Very low	38.1	Very low	145 Å²	145	139.8 Å²	139.8	67%	0.671	77%	0.765	S	S	*	*				86.9	117.2	129.6	-139	-83.5	0	0	0	121.1
289	L	39.4	Very low	37.9	Very low	156 Å²	156	138 Å²	138	82%	0.817	76%	0.762	S	S	*	*			trans	160.6	103.5	142.6	-89.5	162.8	0	0	0	108.5
290	L	36.9	Very low	38	Very low	128 Å²	128	139.9 Å²	139.9	67%	0.67	76%	0.763	S	S	*	*				65	104.5	72.8	-143.4	97.6	0	0	0	115.2
291	Q	39	Very low	38	Very low	156 Å²	156	141.1 Å²	141.1	73%	0.729	76%	0.759	S	S	*	*			trans	168.9	95.9	136.6	-135.4	95	71	0	0	108.3
292	Q	36.2	Very low	38.1	Very low	163 Å²	163	140.1 Å²	140.1	76%	0.762	76%	0.758	S	S	*	*				44.1	118.5	99.2	-69.9	-169.8	-19.3	0	0	116.6
293	H	42	Very low	38.4	Very low	176 Å²	176	141.1 Å²	141.1	82%	0.815	76%	0.758	S	S	*	*				-169.2	113.9	128.3	-88.7	-60.9	0	0	0	112.3
294	S	40.6	Very low	38.2	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	76%	0.76	S	S	*	*				78.2	87.3	129.8	-41.2	0	0	0	0	123.3
295	N	37	Very low	38.4	Very low	167 Å²	167	140.9 Å²	140.9	89%	0.893	76%	0.755	S	S	*	*			trans	-3.2	170.3	136.9	-98.7	2.5	0	0	0	126.1
296	P	46.1	Very low	38.2	Very low	102 Å²	102	141 Å²	141	66%	0.662	76%	0.758	S	S	*	*			trans	-117.5	-175.6	-147.8	46.2	-37	0	0	0	115.6
297	S	37.8	Very low	38.2	Very low	95 Å²	95	144.4 Å²	144.4	66%	0.664	76%	0.759	S	S	*	*			trans	171.4	142.3	140	-88.2	0	0	0	0	116.9
298	Q	39.1	Very low	37.7	Very low	179 Å²	179	142.5 Å²	142.5	84%	0.836	75%	0.754	S	S	*	*			trans	76.4	139.8	143.3	-67.4	166.6	46.5	0	0	118.7
299	S	37.9	Very low	37.6	Very low	88 Å²	88	144.6 Å²	144.6	62%	0.615	76%	0.757	S	S	*	*			cis	178.3	153.2	5.7	49	0	0	0	0	111.6
300	L	38.5	Very low	37.3	Very low	148 Å²	148	143.3 Å²	143.3	78%	0.775	75%	0.747	S	S	*	*			trans	69.4	144	149	-65.1	148	0	0	0	118.1
301	Q	38	Very low	37	Very low	171 Å²	171	145.6 Å²	145.6	80%	0.799	75%	0.754	S	S	*	*			cis	-164.8	160.9	16.2	-141.1	169.4	-1.9	0	0	112.2
302	L	35	Very low	36.8	Very low	141 Å²	141	144.5 Å²	144.5	74%	0.738	76%	0.759	S	S	*	*			trans	-69.6	155	-179.1	-67.6	108.8	0	0	0	116.7
303	H	40.5	Very low	36.5	Very low	193 Å²	193	146.3 Å²	146.3	89%	0.894	76%	0.764	S	S	*	*				-163.2	136.7	118.6	-114.1	81.8	0	0	0	115.1
304	Q	32.9	Very low	36.3	Very low	163 Å²	163	144.3 Å²	144.3	76%	0.762	76%	0.764	S	S	*	*			trans	-87.7	168.7	175.9	-77.9	173.3	-7.5	0	0	113
305	S	35.1	Very low	35.7	Very low	102 Å²	102	146.7 Å²	146.7	71%	0.713	77%	0.768	S	S	*	*			trans	121.9	103.6	142.6	-49.4	0	0	0	0	112.8
306	S	34.5	Very low	35.7	Very low	111 Å²	111	144.2 Å²	144.2	78%	0.776	76%	0.761	S	S	*	*				79.7	119	75.4	-73.5	0	0	0	0	114.6
307	Q	37.7	Very low	35	Very low	161 Å²	161	148.2 Å²	148.2	75%	0.752	77%	0.768	S	S	*	*			trans	131.4	122.8	132.8	-62	-128.4	45.3	0	0	117.2
308	L	30.3	Very low	34.6	Very low	137 Å²	137	150 Å²	150	72%	0.717	77%	0.769	S	S	*	*			trans	61.7	120.2	138	-68.4	167.7	0	0	0	120.1
309	Y	35	Very low	34.4	Very low	189 Å²	189	150.2 Å²	150.2	74%	0.741	77%	0.77	S	S	*	*				179	159.8	91.6	-145.7	-102.3	0	0	0	113
310	Q	34.2	Very low	33.8	Very low	130 Å²	130	151.2 Å²	151.2	61%	0.607	78%	0.775	S	S	*	*			trans	-59.7	138.1	-170.6	-67.3	154.1	17.9	0	0	115.4
311	Q	29.9	Very low	33.6	Very low	175 Å²	175	151.8 Å²	151.8	82%	0.818	78%	0.78	S	S	*	*				72.8	113.8	94.3	-156.8	161.8	22.7	0	0	116.1
312	T	34.9	Very low	33.2	Very low	134 Å²	134	154.7 Å²	154.7	82%	0.822	78%	0.783	S	S	*	*			trans	169	101.2	145.5	27.7	0	0	0	0	108.3
313	K	29.3	Very low	33.1	Very low	201 Å²	201	153.3 Å²	153.3	87%	0.874	78%	0.781	S	S	*	*				53.1	94	89.9	-166.5	-175.8	-174.1	-174.6	0	114.4
314	V	37.3	Very low	32.7	Very low	134 Å²	134	152 Å²	152	81%	0.812	78%	0.78	S	S	*	*			trans	-159.1	120.5	140.4	-166.7	0	0	0	0	109
315	D	28.8	Very low	32.6	Very low	160 Å²	160	153.1 Å²	153.1	86%	0.856	79%	0.786	S	S	*	*			trans	-88.7	150.9	160.5	-82.7	-44.4	0	0	0	109
316	P	37.3	Very low	32.6	Very low	114 Å²	114	153.9 Å²	153.9	74%	0.74	79%	0.791	S	S	*	*			trans	-137.1	128.5	135.3	32.2	-16.3	0	0	0	114.4
317	F	31.1	Very low	32.4	Very low	186 Å²	186	154.7 Å²	154.7	82%	0.816	79%	0.791	S	S	*	*			trans	35.4	113.4	132.2	-87.1	-95.2	0	0	0	121.8
318	I	30.4	Very low	31.9	Very low	132 Å²	132	151.3 Å²	151.3	68%	0.677	79%	0.785	S	S	*	*				41.5	117.5	123.9	-50.6	-175	0	0	0	118.7
319	Q	33.2	Very low	32	Very low	185 Å²	185	153.1 Å²	153.1	86%	0.864	79%	0.79	S	S	*	*			trans	-142.7	120.8	133.4	-161.5	155.7	-25.5	0	0	110.3
320	C	26.9	Very low	31.7	Very low	108 Å²	108	152.7 Å²	152.7	73%	0.73	80%	0.799	S	S	*	*			trans	-79.3	141.3	172.7	-70	0	0	0	0	109.7
321	D	33.2	Very low	31.7	Very low	161 Å²	161	153 Å²	153	86%	0.861	80%	0.804	S	S	*	*			trans	-134.1	142.4	151.9	-107.1	-39.1	0	0	0	111.7
322	R	29.7	Very low	31.8	Very low	231 Å²	231	149.9 Å²	149.9	87%	0.872	80%	0.801	S	S	*	*			trans	-101.2	167.4	-160.1	-156.6	178.7	-168.6	-170.6	3.8	109.8
323	T	32.8	Very low	31.7	Very low	113 Å²	113	150.3 Å²	150.3	69%	0.693	80%	0.798	S	S	*	*			trans	102.8	100.2	163.2	73.3	0	0	0	0	116.3
324	N	33.1	Very low	32.1	Very low	164 Å²	164	143.9 Å²	143.9	88%	0.877	78%	0.779	S	S	*	*				-175.6	141.7	94.9	-92.7	-42.3	0	0	0	112.4
325	Q	29.3	Very low	32.2	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	78%	0.777	S	S	*	*			trans	-79.5	142.7	-177.6	-67.1	168.4	3.7	0	0	111.1
326	S	36.2	Very low	32.5	Very low	118 Å²	118	140.6 Å²	140.6	83%	0.825	76%	0.761	S	S	*	*			trans	-166.1	92.5	149.6	-74.9	0	0	0	0	110.6
327	T	29.5	Very low	32.6	Very low	127 Å²	127	137.2 Å²	137.2	78%	0.779	74%	0.743	S	S	*	*			trans	32.1	127.6	134.1	-2.9	0	0	0	0	122.8
328	S	27.4	Very low	32.9	Very low	90 Å²	90	136.9 Å²	136.9	63%	0.629	74%	0.738	S	S	*	*			trans	61.8	119.9	142.3	52	0	0	0	0	118.9
329	H	33.1	Very low	33.4	Very low	175 Å²	175	135.6 Å²	135.6	81%	0.81	73%	0.731	S	S	*	*				-151	138.7	51.6	-86.7	-100	0	0	0	112.1	I331	H329-I331 PolarHBondContact O-N 3.24Å
330	L	28.2	Very low	33.7	Very low	181 Å²	181	129.2 Å²	129.2	95%	0.948	71%	0.707	S	S	*	*			trans	-72.7	112.6	171.5	-75.9	154.1	0	0	0	110.1
331	I	35	Very low	34.4	Very low	135 Å²	135	129.3 Å²	129.3	69%	0.692	70%	0.7	S	S	*	*			trans	-112.8	110.8	160.1	-60.2	176.4	0	0	0	107.1	H329 N333	H329-I331 PolarHBondContact O-N 3.24Å; I331-N333 PolarHBondContact O-N 3.46Å
332	S	30.4	Very low	34.9	Very low	110 Å²	110	125.9 Å²	125.9	77%	0.769	68%	0.681	S	S	*	*			trans	-63.3	95.7	174.6	-178	0	0	0	0	109.7	S334	S332-S334 VanDerWaalsContact C-N 3.33Å; S332-S334 PolarHBondContact O-N 2.85Å; S332-S334 VanDerWaalsContact O-N 3.07Å
333	N	33.4	Very low	35.3	Very low	143 Å²	143	118 Å²	118	77%	0.765	66%	0.656	S	S	*	*			trans	-83	78.1	177.9	-73.8	-35.7	0	0	0	110.1	I331	I331-N333 PolarHBondContact O-N 3.46Å
334	S	38.4	Very low	35.8	Very low	67 Å²	67	118.8 Å²	118.8	47%	0.469	66%	0.655	S	S	.	*			trans	-79.6	141.3	162.9	76.6	0	0	0	0	109.5	S332 S336 A337	S332-S334 VanDerWaalsContact C-N 3.33Å; S332-S334 PolarHBondContact O-N 2.85Å; S332-S334 VanDerWaalsContact O-N 3.07Å; S334-S336 PolarHBondContact O-N 3.15Å; S334-A337 PolarHBondContact O-N 3.41Å
335	I	38.7	Very low	36.2	Very low	149 Å²	149	114.1 Å²	114.1	76%	0.764	64%	0.635	S	S	*	*	H	α-helix	trans	-49.1	-21.4	178	-68.7	162.5	0	0	0	112.7
336	S	36.2	Very low	36.8	Very low	75 Å²	75	110 Å²	110	52%	0.524	62%	0.62	S	S	.	*	H	α-helix	trans	-59.5	-41.9	173.5	-162.6	0	0	0	0	113.5	S334 Y338 L339 S340	S334-S336 PolarHBondContact O-N 3.15Å; S336-Y338 VanDerWaalsContact C-N 3.3Å; S336-Y338 PolarHBondContact O-N 2.9Å; S336-L339 PolarHBondContact O-N 3.38Å; S336-S340 PolarHBondContact O-N 3.02Å; S336-S340 VanDerWaalsContact O-N 3.09Å; S336-S340 PolarHBondContact O-OG 3.19Å; S336-S340 VanDerWaalsContact O-OG 3.09Å
337	A	38.4	Very low	36.9	Very low	43 Å²	43	110.4 Å²	110.4	36%	0.355	61%	0.612	S	S	.	*	H	α-helix	trans	-68.8	-26.1	-174.8	0	0	0	0	0	113.7	S334 N341	S334-A337 PolarHBondContact O-N 3.41Å; A337-N341 PolarHBondContact O-N 2.94Å; A337-N341 PolarHBondContact O-ND2 3.23Å
338	Y	38.2	Very low	37.1	Very low	180 Å²	180	111.6 Å²	111.6	71%	0.706	61%	0.613	S	S	*	*	H	α-helix	trans	-76.1	-31	177	-155.6	-96.7	0	0	0	111.9	S336 I342	S336-Y338 VanDerWaalsContact C-N 3.3Å; S336-Y338 PolarHBondContact O-N 2.9Å; Y338-I342 HydrophobicContact CD1-CD1 4.07Å; Y338-I342 HydrophobicContact CE1-CD1 4.1Å; Y338-I342 WeakPolarHBondContact O-CD1 3.3Å; Y338-I342 WeakPolarHBondContact O-CG1 3.27Å
339	L	40.8	Very low	37.2	Very low	104 Å²	104	117.5 Å²	117.5	55%	0.545	62%	0.623	S	S	.	*	H	α-helix	trans	-77.4	-35.2	175.7	-64.3	174	0	0	0	111.6	S336 I342 L343	S336-L339 PolarHBondContact O-N 3.38Å; L339-I342 PolarHBondContact O-N 3.39Å; L339-L343 WeakPolarHBondContact O-CG 3.43Å; L339-L343 PolarHBondContact O-N 3.12Å
340	S	39.5	Very low	37.2	Very low	52 Å²	52	115.6 Å²	115.6	36%	0.364	62%	0.617	S	S	.	*	H	α-helix	trans	-66.2	-38	175.8	-53.7	0	0	0	0	113.3	S336 I342 L343 L344	S336-S340 PolarHBondContact O-N 3.02Å; S336-S340 VanDerWaalsContact O-N 3.09Å; S336-S340 PolarHBondContact O-OG 3.19Å; S336-S340 VanDerWaalsContact O-OG 3.09Å; S340-I342 VanDerWaalsContact C-N 3.32Å; S340-I342 PolarHBondContact O-N 2.81Å; S340-L343 PolarHBondContact O-N 2.71Å; S340-L344 PolarHBondContact O-N 3.22Å; S340-L344 VanDerWaalsContact O-N 3.1Å
341	N	41.4	Very low	37.5	Very low	109 Å²	109	110.7 Å²	110.7	58%	0.583	60%	0.596	S	S	*	*	H	α-helix	trans	-71.6	-24.7	179.8	-78.9	-34.8	0	0	0	113.8	A337 L343 S345	A337-N341 PolarHBondContact O-N 2.94Å; A337-N341 PolarHBondContact O-ND2 3.23Å; N341-L343 VanDerWaalsContact C-N 3.34Å; N341-S345 PolarHBondContact O-OG 2.89Å
342	I	42.4	Very low	37.5	Very low	89 Å²	89	110.7 Å²	110.7	46%	0.456	61%	0.605	S	S	.	*	H	α-helix	trans	-76.1	-25.9	173.1	-65.3	169.4	0	0	0	111.1	Y338 L339 S340 N346	Y338-I342 HydrophobicContact CD1-CD1 4.07Å; Y338-I342 HydrophobicContact CE1-CD1 4.1Å; Y338-I342 WeakPolarHBondContact O-CD1 3.3Å; Y338-I342 WeakPolarHBondContact O-CG1 3.27Å; L339-I342 PolarHBondContact O-N 3.39Å; S340-I342 VanDerWaalsContact C-N 3.32Å; S340-I342 PolarHBondContact O-N 2.81Å; I342-N346 PolarHBondContact O-ND2 3.5Å
343	L	39.4	Very low	37.5	Very low	65 Å²	65	110.6 Å²	110.6	34%	0.34	60%	0.604	S	S	.	*	H	α-helix	trans	-80.4	-38	176.8	-69.1	167.1	0	0	0	112.4	L339 S340 N341 S345	L339-L343 WeakPolarHBondContact O-CG 3.43Å; L339-L343 PolarHBondContact O-N 3.12Å; S340-L343 PolarHBondContact O-N 2.71Å; N341-L343 VanDerWaalsContact C-N 3.34Å; L343-S345 VanDerWaalsContact C-N 3.33Å; L343-S345 PolarHBondContact O-N 3.1Å
344	L	42.7	Very low	37.6	Very low	130 Å²	130	109.1 Å²	109.1	68%	0.681	61%	0.605	S	S	*	*	H	α-helix	trans	-72.3	-22.4	179.2	-98.8	76.9	0	0	0	114.2	S340 N346	S340-L344 PolarHBondContact O-N 3.22Å; S340-L344 VanDerWaalsContact O-N 3.1Å; L344-N346 VanDerWaalsContact C-N 3.32Å
345	S	42.4	Very low	37.4	Very low	66 Å²	66	112.9 Å²	112.9	46%	0.462	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.4	-1.2	-178.8	34.7	0	0	0	0	114.1	Q134 N341 L343	Q134-S345 PolarHBondContact NE2-O 3.07Å; Q134-S345 VanDerWaalsContact NE2-O 3.15Å; N341-S345 PolarHBondContact O-OG 2.89Å; L343-S345 VanDerWaalsContact C-N 3.33Å; L343-S345 PolarHBondContact O-N 3.1Å
346	N	42.1	Very low	37.1	Very low	103 Å²	103	113.2 Å²	113.2	55%	0.551	62%	0.623	S	S	*	*	S	Bend	trans	-118.6	0.9	177.5	-69	-55.8	0	0	0	113.8	I342 L344	I342-N346 PolarHBondContact O-ND2 3.5Å; L344-N346 VanDerWaalsContact C-N 3.32Å
347	L	37.5	Very low	37	Very low	125 Å²	125	114.6 Å²	114.6	65%	0.654	63%	0.633	S	S	*	*	S	Bend	trans	-131.8	122.4	176.5	-74.9	167.3	0	0	0	108.4
348	L	34.1	Very low	36.7	Very low	152 Å²	152	117.4 Å²	117.4	80%	0.796	65%	0.65	S	S	*	*			trans	83.3	89.6	169.8	-55	158.1	0	0	0	116.4	I350	L348-I350 HydrophobicContact CD2-CD1 3.98Å; L348-I350 HydrophobicContact CD2-CG1 4.36Å
349	Y	29.8	Very low	36.6	Very low	214 Å²	214	115.4 Å²	115.4	84%	0.839	65%	0.651	S	S	*	*			trans	-114.4	88.8	137.5	-168.9	-97.1	0	0	0	107.6	P351	Y349-P351 HydrophobicContact CE1-CB 4.48Å
350	I	32.5	Very low	36.2	Very low	135 Å²	135	118.9 Å²	118.9	69%	0.692	66%	0.662	S	S	*	*			trans	-108.2	115.9	161.3	-60	175.9	0	0	0	104.6	L348	L348-I350 HydrophobicContact CD2-CD1 3.98Å; L348-I350 HydrophobicContact CD2-CG1 4.36Å
351	P	34.2	Very low	35.9	Very low	79 Å²	79	124.2 Å²	124.2	51%	0.513	69%	0.685	S	S	.	*			trans	-70.6	134.3	177.9	28.1	-31.5	0	0	0	109.6	Y349 S353	Y349-P351 HydrophobicContact CE1-CB 4.48Å; P351-S353 PolarHBondContact O-N 3.31Å
352	P	35	Very low	35.7	Very low	135 Å²	135	124.1 Å²	124.1	88%	0.877	69%	0.691	S	S	*	*			trans	-77.3	117.9	173.3	30.1	-28.9	0	0	0	109
353	S	31.3	Very low	35.2	Very low	108 Å²	108	127.2 Å²	127.2	76%	0.755	71%	0.708	S	S	*	*			trans	-105.4	150.4	165.8	55.1	0	0	0	0	110.2	P351	P351-S353 PolarHBondContact O-N 3.31Å
354	S	34.3	Very low	35.2	Very low	112 Å²	112	129.8 Å²	129.8	78%	0.783	73%	0.729	S	S	*	*			trans	91.5	99.4	172.6	76.2	0	0	0	0	118.2
355	N	33.7	Very low	34.8	Very low	146 Å²	146	130.8 Å²	130.8	78%	0.781	73%	0.734	S	S	*	*				1.9	119.8	127.8	-58.7	-14.7	0	0	0	115.6
356	N	33.5	Very low	34.7	Very low	156 Å²	156	133.4 Å²	133.4	83%	0.834	75%	0.75	S	S	*	*				-178.6	138	106.6	-87.5	-31.3	0	0	0	111.9
357	S	34.5	Very low	34.2	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	76%	0.759	S	S	*	*			trans	-36.9	144.1	174.2	-48.4	0	0	0	0	117.7
358	S	32.3	Very low	34.2	Very low	102 Å²	102	135.7 Å²	135.7	71%	0.713	77%	0.766	S	S	*	*				102.3	134.8	127.4	78.1	0	0	0	0	120.1
359	L	34.4	Very low	34.2	Very low	138 Å²	138	133 Å²	133	72%	0.723	76%	0.756	S	S	*	*			trans	103.9	96.4	147.5	-48.8	-174.7	0	0	0	119
360	F	33.4	Very low	34.2	Very low	177 Å²	177	129.5 Å²	129.5	78%	0.776	75%	0.751	S	S	*	*				64.9	110.1	122.6	-72.7	-75.9	0	0	0	121.3
361	L	34	Very low	34.4	Very low	164 Å²	164	128.5 Å²	128.5	86%	0.859	75%	0.752	S	S	*	*				149.6	145.5	104.8	-89.8	137.1	0	0	0	112.8
362	P	36.2	Very low	34.4	Very low	106 Å²	106	130.3 Å²	130.3	69%	0.688	76%	0.762	S	S	*	*			trans	-113.3	151.6	-170.4	38.4	-25.9	0	0	0	116.2
363	N	32.8	Very low	34.3	Very low	154 Å²	154	133.1 Å²	133.1	82%	0.824	76%	0.76	S	S	*	*			trans	60	170.8	151.9	-89.1	-11.4	0	0	0	118.8
364	P	39.4	Very low	34.3	Very low	120 Å²	120	133.4 Å²	133.4	78%	0.779	76%	0.762	S	S	*	*			cis	-141.4	175.9	15.9	31.9	-7.1	0	0	0	118.2
365	L	33.5	Very low	34.2	Very low	150 Å²	150	136.1 Å²	136.1	79%	0.785	76%	0.762	S	S	*	*			trans	-67.9	166	168.5	-92.2	99.8	0	0	0	114.9
366	P	40.1	Very low	33.8	Very low	122 Å²	122	135 Å²	135	79%	0.792	77%	0.765	S	S	*	*			trans	-108.3	148.7	152.7	34.7	-22.9	0	0	0	114.6
367	V	32.5	Very low	33.9	Very low	123 Å²	123	135.5 Å²	135.5	75%	0.745	76%	0.762	S	S	*	*			trans	-105.6	164.1	-177.1	177	0	0	0	0	110.4
368	L	36.3	Very low	33.6	Very low	153 Å²	153	138.3 Å²	138.3	80%	0.801	77%	0.768	S	S	*	*			trans	123.2	138.4	151.7	-71.6	148.4	0	0	0	113.5
369	T	34	Very low	33.9	Very low	95 Å²	95	140.2 Å²	140.2	58%	0.583	77%	0.769	S	S	*	*			cis	178.4	146	-22.9	21	0	0	0	0	106.4
370	N	30.8	Very low	33.5	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	78%	0.777	S	S	*	*			trans	65.5	144.6	144.4	-60	-9.2	0	0	0	118.4
371	T	35.8	Very low	33.5	Very low	115 Å²	115	140 Å²	140	71%	0.706	78%	0.776	S	S	*	*			cis	-172.7	137.1	21.7	1.8	0	0	0	0	110.5
372	T	35	Very low	33.2	Very low	117 Å²	117	140 Å²	140	72%	0.718	78%	0.776	S	S	*	*			trans	49.6	120.5	139.9	55.6	0	0	0	0	125.4
373	K	32.3	Very low	32.8	Very low	193 Å²	193	141 Å²	141	84%	0.839	78%	0.784	S	S	*	*				79.4	127.3	123.9	-77.2	-176.4	176.8	177.2	0	123.2
374	S	32.5	Very low	32.7	Very low	115 Å²	115	138.8 Å²	138.8	80%	0.804	78%	0.776	S	S	*	*			trans	68.5	134.5	153.5	74.5	0	0	0	0	115.6
375	Q	31.2	Very low	32.6	Very low	168 Å²	168	139.3 Å²	139.3	79%	0.785	78%	0.78	S	S	*	*			cis	-168.2	137.1	43.6	-172.3	173.7	13.5	0	0	107.6
376	C	26.2	Very low	32.9	Very low	122 Å²	122	139.2 Å²	139.2	82%	0.824	78%	0.78	S	S	*	*			trans	-79	132.8	174	-82.5	0	0	0	0	110.8
377	H	34.5	Very low	32.6	Very low	168 Å²	168	142.2 Å²	142.2	78%	0.778	78%	0.783	S	S	*	*			trans	-141.1	138.2	147.8	-88	-43.6	0	0	0	110.8
378	D	28.7	Very low	33.3	Very low	162 Å²	162	141.2 Å²	141.2	87%	0.866	78%	0.778	S	S	*	*			trans	-53.2	129	-177.9	-66.8	-68.1	0	0	0	114
379	I	37.4	Very low	33.7	Very low	143 Å²	143	137.8 Å²	137.8	73%	0.733	76%	0.76	S	S	*	*			trans	-141.4	112.6	156.1	-50.1	178	0	0	0	109.1	L381	I379-L381 HydrophobicContact CG2-CD1 3.87Å; I379-L381 PolarHBondContact O-N 3.21Å
380	N	27.3	Very low	34.2	Very low	163 Å²	163	143.1 Å²	143.1	87%	0.872	77%	0.771	S	S	*	*			trans	-51.2	119	160.4	-77.5	-57.4	0	0	0	110.1
381	L	33	Very low	34.8	Very low	148 Å²	148	143.6 Å²	143.6	78%	0.775	77%	0.769	S	S	*	*			trans	-146.7	117.8	163.6	-101	144.3	0	0	0	110.5	I379 C383	I379-L381 HydrophobicContact CG2-CD1 3.87Å; I379-L381 PolarHBondContact O-N 3.21Å; L381-C383 PolarHBondContact O-N 3.21Å
382	L	27.7	Very low	35.6	Very low	163 Å²	163	144.9 Å²	144.9	85%	0.853	76%	0.764	S	S	*	*			trans	-40.9	119	173.1	-77.9	67.2	0	0	0	111.6	T384	L382-T384 PolarHBondContact O-N 3.49Å
383	C	27.8	Very low	36.2	Very low	126 Å²	126	143.5 Å²	143.5	85%	0.851	75%	0.752	S	S	*	*			trans	-88.1	106.4	167.2	-158.9	0	0	0	0	108.7	L381	L381-C383 PolarHBondContact O-N 3.21Å
384	T	31.8	Very low	37.1	Very low	108 Å²	108	140.4 Å²	140.4	66%	0.663	74%	0.736	S	S	*	*			trans	-67.5	137.6	168	42.5	0	0	0	0	109.8	L382 N386	L382-T384 PolarHBondContact O-N 3.49Å; T384-N386 PolarHBondContact O-N 3.3Å
385	P	36	Very low	38.1	Very low	131 Å²	131	139 Å²	139	85%	0.851	72%	0.719	S	S	*	*			trans	-73.1	113.9	176.8	27	-28.5	0	0	0	109.5
386	N	39.1	Very low	39.2	Very low	148 Å²	148	134.7 Å²	134.7	79%	0.791	70%	0.702	S	S	*	*			trans	-50.5	137.8	176.4	-97.4	-49.6	0	0	0	112.6	T384 V388	T384-N386 PolarHBondContact O-N 3.3Å; N386-V388 PolarHBondContact O-N 3.21Å
387	Q	34.9	Very low	40.6	Very low	185 Å²	185	130.8 Å²	130.8	86%	0.864	67%	0.672	S	S	*	*			trans	-50.2	86.3	171.6	-173.7	171.8	-1.4	0	0	111.8	D389	Q387-D389 PolarHBondContact O-N 2.88Å
388	V	46.8	Very low	41.6	Very low	103 Å²	103	127 Å²	127	62%	0.624	66%	0.657	S	S	*	*			trans	-76.6	116.4	166.1	-179.5	0	0	0	0	107.2	N386 Y390	N386-V388 PolarHBondContact O-N 3.21Å; V388-Y390 PolarHBondContact O-N 3.31Å
389	D	44.3	Very low	42.8	Very low	80 Å²	80	125.7 Å²	125.7	43%	0.428	65%	0.649	S	S	.	*			trans	-42.8	101.4	175.3	-92.3	-34.3	0	0	0	111.7	Q387 E391 K392 L393	Q387-D389 PolarHBondContact O-N 2.88Å; D389-E391 PolarHBondContact O-N 2.85Å; D389-K392 HydrophobicContact CB-CB 4.04Å; D389-K392 HydrophobicContact CB-CD 4.08Å; D389-K392 HydrophobicContact CB-CG 4Å; D389-K392 PolarHBondContact O-N 3.46Å; D389-K392 VanDerWaalsContact O-N 3.09Å; D389-K392 IonicContact OD2-NZ 2.89Å; D389-K392 PolarHBondContact OD2-NZ 2.86Å; D389-L393 PolarHBondContact O-N 3.34Å
390	Y	45.6	Very low	43.4	Very low	207 Å²	207	124.1 Å²	124.1	81%	0.812	64%	0.643	S	S	*	*	H	α-helix	trans	-57.6	-28.2	175.3	-77.2	-87.8	0	0	0	112	V388 L393 Y394	V388-Y390 PolarHBondContact O-N 3.31Å; Y390-L393 PolarHBondContact O-N 2.76Å; Y390-Y394 WeakPolarHBondContact O-CB 3.49Å; Y390-Y394 PolarHBondContact O-N 3.39Å
391	E	43.7	Very low	44.3	Very low	150 Å²	150	119.2 Å²	119.2	70%	0.701	62%	0.621	S	S	*	*	H	α-helix	trans	-67.1	-40.7	174.8	-82.8	-139	144.8	0	0	113.5	D389 L393 Y394 N395	D389-E391 PolarHBondContact O-N 2.85Å; E391-L393 VanDerWaalsContact C-N 3.3Å; E391-L393 PolarHBondContact O-N 3.35Å; E391-Y394 WeakPolarHBondContact O-CB 3.4Å; E391-Y394 PolarHBondContact O-N 3.2Å; E391-N395 PolarHBondContact O-N 3.14Å; E391-N395 PolarHBondContact O-ND2 3.41Å
392	K	50.9	Low	44.8	Very low	142 Å²	142	117.5 Å²	117.5	62%	0.617	62%	0.617	S	S	*	*	H	α-helix	trans	-66.2	-37.9	178	-76.3	-178.6	-178	130	0	110.7	D389 L396	D389-K392 HydrophobicContact CB-CB 4.04Å; D389-K392 HydrophobicContact CB-CD 4.08Å; D389-K392 HydrophobicContact CB-CG 4Å; D389-K392 PolarHBondContact O-N 3.46Å; D389-K392 VanDerWaalsContact O-N 3.09Å; D389-K392 IonicContact OD2-NZ 2.89Å; D389-K392 PolarHBondContact OD2-NZ 2.86Å; K392-L396 WeakPolarHBondContact O-CB 3.39Å; K392-L396 PolarHBondContact O-N 2.73Å; K392-L396 VanDerWaalsContact O-N 3.11Å
393	L	47.9	Very low	45.3	Very low	88 Å²	88	114.6 Å²	114.6	46%	0.461	61%	0.607	S	S	.	*	H	α-helix	trans	-66.6	-39.5	174.5	-147.8	102.2	0	0	0	111.7	D389 Y390 E391 L396 I397	D389-L393 PolarHBondContact O-N 3.34Å; Y390-L393 PolarHBondContact O-N 2.76Å; E391-L393 VanDerWaalsContact C-N 3.3Å; E391-L393 PolarHBondContact O-N 3.35Å; L393-L396 PolarHBondContact O-N 3.42Å; L393-I397 HydrophobicContact CD2-CD1 3.98Å; L393-I397 HydrophobicContact CG-CD1 4.38Å; L393-I397 WeakPolarHBondContact O-CD1 3.31Å; L393-I397 VanDerWaalsContact O-CG1 3.25Å; L393-I397 WeakPolarHBondContact O-CG1 3.4Å; L393-I397 PolarHBondContact O-N 3.07Å; L393-I397 VanDerWaalsContact O-N 3.09Å
394	Y	51.1	Low	45.8	Very low	128 Å²	128	117.2 Å²	117.2	50%	0.502	61%	0.612	S	S	.	*	H	α-helix	trans	-61.8	-47.8	177.8	-175.8	-94.8	0	0	0	112.1	Y390 E391 L396 I397 L398	Y390-Y394 WeakPolarHBondContact O-CB 3.49Å; Y390-Y394 PolarHBondContact O-N 3.39Å; E391-Y394 WeakPolarHBondContact O-CB 3.4Å; E391-Y394 PolarHBondContact O-N 3.2Å; Y394-L396 VanDerWaalsContact C-N 3.34Å; Y394-L396 PolarHBondContact O-N 3.32Å; Y394-I397 PolarHBondContact O-N 3.18Å; Y394-L398 HydrophobicContact CD1-CD1 4.33Å; Y394-L398 HydrophobicContact CE1-CD1 3.93Å; Y394-L398 HydrophobicContact CE1-CD2 4.15Å; Y394-L398 HydrophobicContact CE2-CD1 4.26Å; Y394-L398 PolarHBondContact O-N 3.35Å; Y394-L398 VanDerWaalsContact O-N 3.16Å
395	N	53.3	Low	46.1	Very low	85 Å²	85	117.3 Å²	117.3	46%	0.455	61%	0.613	S	S	.	*	H	α-helix	trans	-65.4	-36.7	177.3	-72.6	-35.6	0	0	0	112.1	E391 I397 L398 L399	E391-N395 PolarHBondContact O-N 3.14Å; E391-N395 PolarHBondContact O-ND2 3.41Å; N395-I397 VanDerWaalsContact C-N 3.32Å; N395-I397 PolarHBondContact O-N 3.21Å; N395-L398 PolarHBondContact O-N 3.08Å; N395-L399 WeakPolarHBondContact O-CD1 3.46Å; N395-L399 PolarHBondContact O-N 3.1Å
396	L	55.4	Low	45.9	Very low	79 Å²	79	119.7 Å²	119.7	41%	0.414	61%	0.612	S	S	.	*	H	α-helix	trans	-64.7	-33.9	176.1	-134.2	82.1	0	0	0	113.2	K392 L393 Y394 N400	K392-L396 WeakPolarHBondContact O-CB 3.39Å; K392-L396 PolarHBondContact O-N 2.73Å; K392-L396 VanDerWaalsContact O-N 3.11Å; L393-L396 PolarHBondContact O-N 3.42Å; Y394-L396 VanDerWaalsContact C-N 3.34Å; Y394-L396 PolarHBondContact O-N 3.32Å; L396-N400 PolarHBondContact O-ND2 2.84Å
397	I	55.7	Low	45.7	Very low	39 Å²	39	117.7 Å²	117.7	20%	0.2	61%	0.607	C	S	.	*	H	α-helix	trans	-76.3	-36.2	179.2	-68.7	165.3	0	0	0	110.9	R197 L393 Y394 N395 S401	R197-I397 HydrophobicContact CG-CG2 4.15Å; L393-I397 HydrophobicContact CD2-CD1 3.98Å; L393-I397 HydrophobicContact CG-CD1 4.38Å; L393-I397 WeakPolarHBondContact O-CD1 3.31Å; L393-I397 VanDerWaalsContact O-CG1 3.25Å; L393-I397 WeakPolarHBondContact O-CG1 3.4Å; L393-I397 PolarHBondContact O-N 3.07Å; L393-I397 VanDerWaalsContact O-N 3.09Å; Y394-I397 PolarHBondContact O-N 3.18Å; N395-I397 VanDerWaalsContact C-N 3.32Å; N395-I397 PolarHBondContact O-N 3.21Å; I397-S401 PolarHBondContact O-OG 3.31Å
398	L	55.5	Low	45.8	Very low	88 Å²	88	116.5 Å²	116.5	46%	0.461	61%	0.605	S	S	.	*	H	α-helix	trans	-66.9	-42.5	177.2	-102.9	71.2	0	0	0	112.5	Y394 N395 N400 S401	Y394-L398 HydrophobicContact CD1-CD1 4.33Å; Y394-L398 HydrophobicContact CE1-CD1 3.93Å; Y394-L398 HydrophobicContact CE1-CD2 4.15Å; Y394-L398 HydrophobicContact CE2-CD1 4.26Å; Y394-L398 PolarHBondContact O-N 3.35Å; Y394-L398 VanDerWaalsContact O-N 3.16Å; N395-L398 PolarHBondContact O-N 3.08Å; L398-N400 VanDerWaalsContact C-N 3.3Å; L398-N400 PolarHBondContact O-N 3.08Å; L398-S401 PolarHBondContact O-N 3.13Å
399	L	53.6	Low	45.1	Very low	135 Å²	135	121.2 Å²	121.2	71%	0.707	61%	0.613	S	S	*	*	H	α-helix	trans	-65.4	-27.5	-178.2	-81	155.1	0	0	0	113.9	N395	N395-L399 WeakPolarHBondContact O-CD1 3.46Å; N395-L399 PolarHBondContact O-N 3.1Å
400	N	49.1	Very low	44.6	Very low	111 Å²	111	123 Å²	123	59%	0.594	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	3.7	179.3	-72.9	-59.5	0	0	0	114	L396 L398	L396-N400 PolarHBondContact O-ND2 2.84Å; L398-N400 VanDerWaalsContact C-N 3.3Å; L398-N400 PolarHBondContact O-N 3.08Å
401	S	47.4	Very low	44	Very low	59 Å²	59	117.9 Å²	117.9	41%	0.413	63%	0.627	S	S	.	*			trans	-106.5	7.9	-170.3	-63.2	0	0	0	0	114.7	I397 L398 P403	I397-S401 PolarHBondContact O-OG 3.31Å; L398-S401 PolarHBondContact O-N 3.13Å; S401-P403 WeakPolarHBondContact O-CD 3.38Å
402	T	42.7	Very low	43.6	Very low	113 Å²	113	117.9 Å²	117.9	69%	0.693	63%	0.632	S	S	*	*			trans	-69	122.6	173.5	42.7	0	0	0	0	110.5	L404	T402-L404 PolarHBondContact O-N 3.19Å
403	P	39.2	Very low	42.9	Very low	101 Å²	101	119.5 Å²	119.5	66%	0.656	65%	0.646	S	S	*	*			trans	-64.4	122	174.5	25.5	-30.4	0	0	0	109.3	S401 T405	S401-P403 WeakPolarHBondContact O-CD 3.38Å; P403-T405 HydrophobicContact CB-CG2 4.34Å; P403-T405 PolarHBondContact O-N 3.33Å
404	L	37.9	Very low	42.5	Very low	181 Å²	181	121.1 Å²	121.1	95%	0.948	66%	0.659	S	S	*	*			trans	-66.4	78.9	161.3	-75.9	165.6	0	0	0	108.1	T402	T402-L404 PolarHBondContact O-N 3.19Å
405	T	38.8	Very low	41.9	Very low	110 Å²	110	120.2 Å²	120.2	68%	0.675	67%	0.672	S	S	*	*			trans	-128.1	84.4	167.7	52.9	0	0	0	0	107.1	P403	P403-T405 HydrophobicContact CB-CG2 4.34Å; P403-T405 PolarHBondContact O-N 3.33Å
406	Q	30.9	Very low	41.4	Very low	181 Å²	181	121.8 Å²	121.8	85%	0.846	68%	0.684	S	S	*	*			trans	-87.3	125.9	157.9	-72.9	-156.6	-13.3	0	0	108.1	I408	Q406-I408 PolarHBondContact O-N 3.27Å
407	P	34.1	Very low	40.4	Very low	106 Å²	106	125.4 Å²	125.4	69%	0.688	70%	0.704	S	S	*	*			trans	-75.8	114.4	163.4	29.8	-26.8	0	0	0	107.7	Y409	P407-Y409 VanDerWaalsContact C-N 3.33Å; P407-Y409 PolarHBondContact O-N 3.43Å
408	I	37.4	Very low	39.7	Very low	160 Å²	160	131.6 Å²	131.6	82%	0.821	73%	0.732	S	S	*	*			trans	-71.8	98.5	164.2	-61.2	176	0	0	0	106	Q406 S410	Q406-I408 PolarHBondContact O-N 3.27Å; I408-S410 PolarHBondContact O-N 2.85Å
409	Y	32.8	Very low	39	Very low	202 Å²	202	137.9 Å²	137.9	79%	0.792	75%	0.751	S	S	*	*			trans	-62.2	118.3	165.9	-109.9	-93.2	0	0	0	108.3	P407 S411	P407-Y409 VanDerWaalsContact C-N 3.33Å; P407-Y409 PolarHBondContact O-N 3.43Å; Y409-S411 PolarHBondContact O-N 2.97Å
410	S	32.9	Very low	38.7	Very low	118 Å²	118	144.8 Å²	144.8	83%	0.825	78%	0.776	S	S	*	*			trans	-65.4	118.3	167.9	-67.5	0	0	0	0	108.9	I408	I408-S410 PolarHBondContact O-N 2.85Å
411	S	34.8	Very low	38.1	Very low	99 Å²	99	146.5 Å²	146.5	69%	0.692	79%	0.785	S	S	*	*			trans	-118.6	101.2	165.3	-53.1	0	0	0	0	106	Y409	Y409-S411 PolarHBondContact O-N 2.97Å
412	N	34.3	Very low	37.7	Very low	151 Å²	151	151.1 Å²	151.1	81%	0.807	81%	0.805	S	S	*	*			trans	178.4	73.8	156.1	-85.7	-21.2	0	0	0	108.5
413	L	37.2	Very low	37.4	Very low	175 Å²	175	153.2 Å²	153.2	92%	0.916	81%	0.811	S	S	*	*			trans	-119.3	85	152.3	-79.3	174.8	0	0	0	106.2	S415	L413-S415 PolarHBondContact O-N 3.49Å
414	V	39.6	Very low	37.3	Very low	122 Å²	122	156.3 Å²	156.3	74%	0.739	82%	0.82	S	S	*	*			trans	-75.4	112.1	161.1	174.5	0	0	0	0	105.6	V416	V414-V416 HydrophobicContact CG1-CG2 4.12Å; V414-V416 PolarHBondContact O-N 3.2Å
415	S	37.7	Very low	37.2	Very low	110 Å²	110	154.8 Å²	154.8	77%	0.769	81%	0.812	S	S	*	*			trans	-60.1	122.5	164.6	-74.3	0	0	0	0	108.6	L413	L413-S415 PolarHBondContact O-N 3.49Å
416	V	41.6	Very low	37.1	Very low	117 Å²	117	157.7 Å²	157.7	71%	0.709	82%	0.821	S	S	*	*			trans	-122.4	97.9	155.5	-167.3	0	0	0	0	105.5	V414 E418	V414-V416 HydrophobicContact CG1-CG2 4.12Å; V414-V416 PolarHBondContact O-N 3.2Å; V416-E418 PolarHBondContact O-N 3.19Å
417	N	36.1	Very low	37.6	Very low	156 Å²	156	156.1 Å²	156.1	83%	0.834	82%	0.82	S	S	*	*			trans	-69.2	116.5	158	-83.7	-23.4	0	0	0	106.4
418	E	41.2	Very low	37.8	Very low	168 Å²	168	159.9 Å²	159.9	79%	0.785	83%	0.83	S	S	*	*			trans	-157.6	108.6	152	-118.6	172.1	-179.5	0	0	110.2	V416	V416-E418 PolarHBondContact O-N 3.19Å
419	Y	39.8	Very low	37.9	Very low	220 Å²	220	159.9 Å²	159.9	86%	0.863	83%	0.83	S	S	*	*			trans	17.4	109.5	146.5	-68.5	-93	0	0	0	118.2
420	F	46.9	Very low	38.4	Very low	281 Å²	281	156.1 Å²	156.1	100%	1.232	83%	0.834	S	S	*	*				-172.9	0	112.8	-108.3	-77.2	0	0	0	111.2

Retrieved 420 of 420 residues in 191.9 ms (Link to these results)

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